data_4XAK # _entry.id 4XAK # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4XAK WWPDB D_1000205343 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 4XAK _pdbx_database_status.recvd_initial_deposition_date 2014-12-15 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Zhou, T.' 1 'Dimtrov, D.S.' 2 'Ying, T.' 3 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country UK _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev 'Nat Commun' _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 2041-1723 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 6 _citation.language ? _citation.page_first 8223 _citation.page_last 8223 _citation.title 'Junctional and allele-specific residues are critical for MERS-CoV neutralization by an exceptionally potent germline-like antibody.' _citation.year 2015 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1038/ncomms9223 _citation.pdbx_database_id_PubMed 26370782 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Ying, T.' 1 primary 'Prabakaran, P.' 2 primary 'Du, L.' 3 primary 'Shi, W.' 4 primary 'Feng, Y.' 5 primary 'Wang, Y.' 6 primary 'Wang, L.' 7 primary 'Li, W.' 8 primary 'Jiang, S.' 9 primary 'Dimitrov, D.S.' 10 primary 'Zhou, T.' 11 # _cell.angle_alpha 90.000 _cell.angle_alpha_esd ? _cell.angle_beta 90.000 _cell.angle_beta_esd ? _cell.angle_gamma 90.000 _cell.angle_gamma_esd ? _cell.entry_id 4XAK _cell.details ? _cell.formula_units_Z ? _cell.length_a 47.795 _cell.length_a_esd ? _cell.length_b 146.879 _cell.length_b_esd ? _cell.length_c 200.508 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 8 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? # _symmetry.entry_id 4XAK _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'Spike glycoprotein' 27625.014 2 ? ? 'Receptor-binding domain (UNP residues 367-601)' 'MERS-CoV RBD with HRV3C cleavage site and His 6x tag at the C-terminal.' 2 polymer man 'Heavy chain of neutralizing antibody m336' 26525.562 2 ? ? ? ? 3 polymer man 'Light chain of neutralizing antibody m336' 23211.752 2 ? ? ? ? 4 non-polymer syn N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 5 non-polymer syn GLYCEROL 92.094 2 ? ? ? ? 6 water nat water 18.015 236 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'S glycoprotein,E2,Peplomer protein' # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;EAKPSGSVVEQAEGVECDFSPLLSGTPPQVYNFKRLVFTNCNYNLTKLLSLFSVNDFTCSQISPAAIASNCYSSLILDYF SYPLSMKSDLSVSSAGPISQFNYKQSFSNPTCLILATVPHNLTTITKPLKYSYINKCSRFLSDDRTEVPQLVNANQYSPC VSIVPSTVWEDGDYYRKQLSPLEGGGWLVASGSTVAMTEQLQMGFGITVQYGTDTNSVCPKLEFANDTKIASQLGGSLEV LFQGPGHHHHHH ; ;EAKPSGSVVEQAEGVECDFSPLLSGTPPQVYNFKRLVFTNCNYNLTKLLSLFSVNDFTCSQISPAAIASNCYSSLILDYF SYPLSMKSDLSVSSAGPISQFNYKQSFSNPTCLILATVPHNLTTITKPLKYSYINKCSRFLSDDRTEVPQLVNANQYSPC VSIVPSTVWEDGDYYRKQLSPLEGGGWLVASGSTVAMTEQLQMGFGITVQYGTDTNSVCPKLEFANDTKIASQLGGSLEV LFQGPGHHHHHH ; A,B ? 2 'polypeptide(L)' no no ;QVQLVQSGAEVKKPGSSVKVSCKASGGTFSSYAISWVRQAPGQGLEWMGGIIPIFGTASYAQKFQGRVTITADKSTSTAY MELSSLRSEDTAVYYCARVGYCSSTSCNRGAFDIWGQGTMVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPE PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKTSGQAGHHHH HHGDYKDDDDKG ; ;QVQLVQSGAEVKKPGSSVKVSCKASGGTFSSYAISWVRQAPGQGLEWMGGIIPIFGTASYAQKFQGRVTITADKSTSTAY MELSSLRSEDTAVYYCARVGYCSSTSCNRGAFDIWGQGTMVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPE PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKTSGQAGHHHH HHGDYKDDDDKG ; H,D ? 3 'polypeptide(L)' no no ;DIQLTQSPSSLSASVGDRVTITCRASQGIRNDLGWYQQKPGKAPKLLIYAASSLQSGVPSRFSGSGSGTDFTLTISSLQP EDFATYYCQQLNSYPLTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC ; ;DIQLTQSPSSLSASVGDRVTITCRASQGIRNDLGWYQQKPGKAPKLLIYAASSLQSGVPSRFSGSGSGTDFTLTISSLQP EDFATYYCQQLNSYPLTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC ; L,E ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLU n 1 2 ALA n 1 3 LYS n 1 4 PRO n 1 5 SER n 1 6 GLY n 1 7 SER n 1 8 VAL n 1 9 VAL n 1 10 GLU n 1 11 GLN n 1 12 ALA n 1 13 GLU n 1 14 GLY n 1 15 VAL n 1 16 GLU n 1 17 CYS n 1 18 ASP n 1 19 PHE n 1 20 SER n 1 21 PRO n 1 22 LEU n 1 23 LEU n 1 24 SER n 1 25 GLY n 1 26 THR n 1 27 PRO n 1 28 PRO n 1 29 GLN n 1 30 VAL n 1 31 TYR n 1 32 ASN n 1 33 PHE n 1 34 LYS n 1 35 ARG n 1 36 LEU n 1 37 VAL n 1 38 PHE n 1 39 THR n 1 40 ASN n 1 41 CYS n 1 42 ASN n 1 43 TYR n 1 44 ASN n 1 45 LEU n 1 46 THR n 1 47 LYS n 1 48 LEU n 1 49 LEU n 1 50 SER n 1 51 LEU n 1 52 PHE n 1 53 SER n 1 54 VAL n 1 55 ASN n 1 56 ASP n 1 57 PHE n 1 58 THR n 1 59 CYS n 1 60 SER n 1 61 GLN n 1 62 ILE n 1 63 SER n 1 64 PRO n 1 65 ALA n 1 66 ALA n 1 67 ILE n 1 68 ALA n 1 69 SER n 1 70 ASN n 1 71 CYS n 1 72 TYR n 1 73 SER n 1 74 SER n 1 75 LEU n 1 76 ILE n 1 77 LEU n 1 78 ASP n 1 79 TYR n 1 80 PHE n 1 81 SER n 1 82 TYR n 1 83 PRO n 1 84 LEU n 1 85 SER n 1 86 MET n 1 87 LYS n 1 88 SER n 1 89 ASP n 1 90 LEU n 1 91 SER n 1 92 VAL n 1 93 SER n 1 94 SER n 1 95 ALA n 1 96 GLY n 1 97 PRO n 1 98 ILE n 1 99 SER n 1 100 GLN n 1 101 PHE n 1 102 ASN n 1 103 TYR n 1 104 LYS n 1 105 GLN n 1 106 SER n 1 107 PHE n 1 108 SER n 1 109 ASN n 1 110 PRO n 1 111 THR n 1 112 CYS n 1 113 LEU n 1 114 ILE n 1 115 LEU n 1 116 ALA n 1 117 THR n 1 118 VAL n 1 119 PRO n 1 120 HIS n 1 121 ASN n 1 122 LEU n 1 123 THR n 1 124 THR n 1 125 ILE n 1 126 THR n 1 127 LYS n 1 128 PRO n 1 129 LEU n 1 130 LYS n 1 131 TYR n 1 132 SER n 1 133 TYR n 1 134 ILE n 1 135 ASN n 1 136 LYS n 1 137 CYS n 1 138 SER n 1 139 ARG n 1 140 PHE n 1 141 LEU n 1 142 SER n 1 143 ASP n 1 144 ASP n 1 145 ARG n 1 146 THR n 1 147 GLU n 1 148 VAL n 1 149 PRO n 1 150 GLN n 1 151 LEU n 1 152 VAL n 1 153 ASN n 1 154 ALA n 1 155 ASN n 1 156 GLN n 1 157 TYR n 1 158 SER n 1 159 PRO n 1 160 CYS n 1 161 VAL n 1 162 SER n 1 163 ILE n 1 164 VAL n 1 165 PRO n 1 166 SER n 1 167 THR n 1 168 VAL n 1 169 TRP n 1 170 GLU n 1 171 ASP n 1 172 GLY n 1 173 ASP n 1 174 TYR n 1 175 TYR n 1 176 ARG n 1 177 LYS n 1 178 GLN n 1 179 LEU n 1 180 SER n 1 181 PRO n 1 182 LEU n 1 183 GLU n 1 184 GLY n 1 185 GLY n 1 186 GLY n 1 187 TRP n 1 188 LEU n 1 189 VAL n 1 190 ALA n 1 191 SER n 1 192 GLY n 1 193 SER n 1 194 THR n 1 195 VAL n 1 196 ALA n 1 197 MET n 1 198 THR n 1 199 GLU n 1 200 GLN n 1 201 LEU n 1 202 GLN n 1 203 MET n 1 204 GLY n 1 205 PHE n 1 206 GLY n 1 207 ILE n 1 208 THR n 1 209 VAL n 1 210 GLN n 1 211 TYR n 1 212 GLY n 1 213 THR n 1 214 ASP n 1 215 THR n 1 216 ASN n 1 217 SER n 1 218 VAL n 1 219 CYS n 1 220 PRO n 1 221 LYS n 1 222 LEU n 1 223 GLU n 1 224 PHE n 1 225 ALA n 1 226 ASN n 1 227 ASP n 1 228 THR n 1 229 LYS n 1 230 ILE n 1 231 ALA n 1 232 SER n 1 233 GLN n 1 234 LEU n 1 235 GLY n 1 236 GLY n 1 237 SER n 1 238 LEU n 1 239 GLU n 1 240 VAL n 1 241 LEU n 1 242 PHE n 1 243 GLN n 1 244 GLY n 1 245 PRO n 1 246 GLY n 1 247 HIS n 1 248 HIS n 1 249 HIS n 1 250 HIS n 1 251 HIS n 1 252 HIS n 2 1 GLN n 2 2 VAL n 2 3 GLN n 2 4 LEU n 2 5 VAL n 2 6 GLN n 2 7 SER n 2 8 GLY n 2 9 ALA n 2 10 GLU n 2 11 VAL n 2 12 LYS n 2 13 LYS n 2 14 PRO n 2 15 GLY n 2 16 SER n 2 17 SER n 2 18 VAL n 2 19 LYS n 2 20 VAL n 2 21 SER n 2 22 CYS n 2 23 LYS n 2 24 ALA n 2 25 SER n 2 26 GLY n 2 27 GLY n 2 28 THR n 2 29 PHE n 2 30 SER n 2 31 SER n 2 32 TYR n 2 33 ALA n 2 34 ILE n 2 35 SER n 2 36 TRP n 2 37 VAL n 2 38 ARG n 2 39 GLN n 2 40 ALA n 2 41 PRO n 2 42 GLY n 2 43 GLN n 2 44 GLY n 2 45 LEU n 2 46 GLU n 2 47 TRP n 2 48 MET n 2 49 GLY n 2 50 GLY n 2 51 ILE n 2 52 ILE n 2 53 PRO n 2 54 ILE n 2 55 PHE n 2 56 GLY n 2 57 THR n 2 58 ALA n 2 59 SER n 2 60 TYR n 2 61 ALA n 2 62 GLN n 2 63 LYS n 2 64 PHE n 2 65 GLN n 2 66 GLY n 2 67 ARG n 2 68 VAL n 2 69 THR n 2 70 ILE n 2 71 THR n 2 72 ALA n 2 73 ASP n 2 74 LYS n 2 75 SER n 2 76 THR n 2 77 SER n 2 78 THR n 2 79 ALA n 2 80 TYR n 2 81 MET n 2 82 GLU n 2 83 LEU n 2 84 SER n 2 85 SER n 2 86 LEU n 2 87 ARG n 2 88 SER n 2 89 GLU n 2 90 ASP n 2 91 THR n 2 92 ALA n 2 93 VAL n 2 94 TYR n 2 95 TYR n 2 96 CYS n 2 97 ALA n 2 98 ARG n 2 99 VAL n 2 100 GLY n 2 101 TYR n 2 102 CYS n 2 103 SER n 2 104 SER n 2 105 THR n 2 106 SER n 2 107 CYS n 2 108 ASN n 2 109 ARG n 2 110 GLY n 2 111 ALA n 2 112 PHE n 2 113 ASP n 2 114 ILE n 2 115 TRP n 2 116 GLY n 2 117 GLN n 2 118 GLY n 2 119 THR n 2 120 MET n 2 121 VAL n 2 122 THR n 2 123 VAL n 2 124 SER n 2 125 SER n 2 126 ALA n 2 127 SER n 2 128 THR n 2 129 LYS n 2 130 GLY n 2 131 PRO n 2 132 SER n 2 133 VAL n 2 134 PHE n 2 135 PRO n 2 136 LEU n 2 137 ALA n 2 138 PRO n 2 139 SER n 2 140 SER n 2 141 LYS n 2 142 SER n 2 143 THR n 2 144 SER n 2 145 GLY n 2 146 GLY n 2 147 THR n 2 148 ALA n 2 149 ALA n 2 150 LEU n 2 151 GLY n 2 152 CYS n 2 153 LEU n 2 154 VAL n 2 155 LYS n 2 156 ASP n 2 157 TYR n 2 158 PHE n 2 159 PRO n 2 160 GLU n 2 161 PRO n 2 162 VAL n 2 163 THR n 2 164 VAL n 2 165 SER n 2 166 TRP n 2 167 ASN n 2 168 SER n 2 169 GLY n 2 170 ALA n 2 171 LEU n 2 172 THR n 2 173 SER n 2 174 GLY n 2 175 VAL n 2 176 HIS n 2 177 THR n 2 178 PHE n 2 179 PRO n 2 180 ALA n 2 181 VAL n 2 182 LEU n 2 183 GLN n 2 184 SER n 2 185 SER n 2 186 GLY n 2 187 LEU n 2 188 TYR n 2 189 SER n 2 190 LEU n 2 191 SER n 2 192 SER n 2 193 VAL n 2 194 VAL n 2 195 THR n 2 196 VAL n 2 197 PRO n 2 198 SER n 2 199 SER n 2 200 SER n 2 201 LEU n 2 202 GLY n 2 203 THR n 2 204 GLN n 2 205 THR n 2 206 TYR n 2 207 ILE n 2 208 CYS n 2 209 ASN n 2 210 VAL n 2 211 ASN n 2 212 HIS n 2 213 LYS n 2 214 PRO n 2 215 SER n 2 216 ASN n 2 217 THR n 2 218 LYS n 2 219 VAL n 2 220 ASP n 2 221 LYS n 2 222 LYS n 2 223 VAL n 2 224 GLU n 2 225 PRO n 2 226 LYS n 2 227 SER n 2 228 CYS n 2 229 ASP n 2 230 LYS n 2 231 THR n 2 232 SER n 2 233 GLY n 2 234 GLN n 2 235 ALA n 2 236 GLY n 2 237 HIS n 2 238 HIS n 2 239 HIS n 2 240 HIS n 2 241 HIS n 2 242 HIS n 2 243 GLY n 2 244 ASP n 2 245 TYR n 2 246 LYS n 2 247 ASP n 2 248 ASP n 2 249 ASP n 2 250 ASP n 2 251 LYS n 2 252 GLY n 3 1 ASP n 3 2 ILE n 3 3 GLN n 3 4 LEU n 3 5 THR n 3 6 GLN n 3 7 SER n 3 8 PRO n 3 9 SER n 3 10 SER n 3 11 LEU n 3 12 SER n 3 13 ALA n 3 14 SER n 3 15 VAL n 3 16 GLY n 3 17 ASP n 3 18 ARG n 3 19 VAL n 3 20 THR n 3 21 ILE n 3 22 THR n 3 23 CYS n 3 24 ARG n 3 25 ALA n 3 26 SER n 3 27 GLN n 3 28 GLY n 3 29 ILE n 3 30 ARG n 3 31 ASN n 3 32 ASP n 3 33 LEU n 3 34 GLY n 3 35 TRP n 3 36 TYR n 3 37 GLN n 3 38 GLN n 3 39 LYS n 3 40 PRO n 3 41 GLY n 3 42 LYS n 3 43 ALA n 3 44 PRO n 3 45 LYS n 3 46 LEU n 3 47 LEU n 3 48 ILE n 3 49 TYR n 3 50 ALA n 3 51 ALA n 3 52 SER n 3 53 SER n 3 54 LEU n 3 55 GLN n 3 56 SER n 3 57 GLY n 3 58 VAL n 3 59 PRO n 3 60 SER n 3 61 ARG n 3 62 PHE n 3 63 SER n 3 64 GLY n 3 65 SER n 3 66 GLY n 3 67 SER n 3 68 GLY n 3 69 THR n 3 70 ASP n 3 71 PHE n 3 72 THR n 3 73 LEU n 3 74 THR n 3 75 ILE n 3 76 SER n 3 77 SER n 3 78 LEU n 3 79 GLN n 3 80 PRO n 3 81 GLU n 3 82 ASP n 3 83 PHE n 3 84 ALA n 3 85 THR n 3 86 TYR n 3 87 TYR n 3 88 CYS n 3 89 GLN n 3 90 GLN n 3 91 LEU n 3 92 ASN n 3 93 SER n 3 94 TYR n 3 95 PRO n 3 96 LEU n 3 97 THR n 3 98 PHE n 3 99 GLY n 3 100 GLY n 3 101 GLY n 3 102 THR n 3 103 LYS n 3 104 VAL n 3 105 GLU n 3 106 ILE n 3 107 LYS n 3 108 ARG n 3 109 THR n 3 110 VAL n 3 111 ALA n 3 112 ALA n 3 113 PRO n 3 114 SER n 3 115 VAL n 3 116 PHE n 3 117 ILE n 3 118 PHE n 3 119 PRO n 3 120 PRO n 3 121 SER n 3 122 ASP n 3 123 GLU n 3 124 GLN n 3 125 LEU n 3 126 LYS n 3 127 SER n 3 128 GLY n 3 129 THR n 3 130 ALA n 3 131 SER n 3 132 VAL n 3 133 VAL n 3 134 CYS n 3 135 LEU n 3 136 LEU n 3 137 ASN n 3 138 ASN n 3 139 PHE n 3 140 TYR n 3 141 PRO n 3 142 ARG n 3 143 GLU n 3 144 ALA n 3 145 LYS n 3 146 VAL n 3 147 GLN n 3 148 TRP n 3 149 LYS n 3 150 VAL n 3 151 ASP n 3 152 ASN n 3 153 ALA n 3 154 LEU n 3 155 GLN n 3 156 SER n 3 157 GLY n 3 158 ASN n 3 159 SER n 3 160 GLN n 3 161 GLU n 3 162 SER n 3 163 VAL n 3 164 THR n 3 165 GLU n 3 166 GLN n 3 167 ASP n 3 168 SER n 3 169 LYS n 3 170 ASP n 3 171 SER n 3 172 THR n 3 173 TYR n 3 174 SER n 3 175 LEU n 3 176 SER n 3 177 SER n 3 178 THR n 3 179 LEU n 3 180 THR n 3 181 LEU n 3 182 SER n 3 183 LYS n 3 184 ALA n 3 185 ASP n 3 186 TYR n 3 187 GLU n 3 188 LYS n 3 189 HIS n 3 190 LYS n 3 191 VAL n 3 192 TYR n 3 193 ALA n 3 194 CYS n 3 195 GLU n 3 196 VAL n 3 197 THR n 3 198 HIS n 3 199 GLN n 3 200 GLY n 3 201 LEU n 3 202 SER n 3 203 SER n 3 204 PRO n 3 205 VAL n 3 206 THR n 3 207 LYS n 3 208 SER n 3 209 PHE n 3 210 ASN n 3 211 ARG n 3 212 GLY n 3 213 GLU n 3 214 CYS n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _entity_src_gen.pdbx_seq_type _entity_src_gen.pdbx_beg_seq_num _entity_src_gen.pdbx_end_seq_num _entity_src_gen.gene_src_common_name _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _entity_src_gen.gene_src_species _entity_src_gen.gene_src_strain _entity_src_gen.gene_src_tissue _entity_src_gen.gene_src_tissue_fraction _entity_src_gen.gene_src_details _entity_src_gen.pdbx_gene_src_fragment _entity_src_gen.pdbx_gene_src_scientific_name _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _entity_src_gen.pdbx_gene_src_variant _entity_src_gen.pdbx_gene_src_cell_line _entity_src_gen.pdbx_gene_src_atcc _entity_src_gen.pdbx_gene_src_organ _entity_src_gen.pdbx_gene_src_organelle _entity_src_gen.pdbx_gene_src_cell _entity_src_gen.pdbx_gene_src_cellular_location _entity_src_gen.host_org_common_name _entity_src_gen.pdbx_host_org_scientific_name _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample 'Biological sequence' 1 252 HCoV-EMC ? 'S, 3' ? 'isolate United Kingdom/H123990006/2012' ? ? ? ? 'Human coronavirus EMC' 1263720 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? GNTI-/- ? ? ? ? ? plasmid ? ? ? pVRC8400 ? ? 2 1 sample 'Biological sequence' 1 252 human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'HEK 293F' ? ? ? ? ? plasmid ? ? ? ? ? ? 3 1 sample 'Biological sequence' 1 214 human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'HEK 293F' ? ? ? ? ? ? ? ? ? plasmid ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.pdbx_db_isoform _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin 1 UNP SPIKE_CVEMC K9N5Q8 ? 1 ;EAKPSGSVVEQAEGVECDFSPLLSGTPPQVYNFKRLVFTNCNYNLTKLLSLFSVNDFTCSQISPAAIASNCYSSLILDYF SYPLSMKSDLSVSSAGPISQFNYKQSFSNPTCLILATVPHNLTTITKPLKYSYINKCSRFLSDDRTEVPQLVNANQYSPC VSIVPSTVWEDGDYYRKQLSPLEGGGWLVASGSTVAMTEQLQMGFGITVQYGTDTNSVCPKLEFANDTKIASQLG ; 367 2 PDB 4XAK 4XAK ? 2 ? 1 3 PDB 4XAK 4XAK ? 3 ? 1 # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 4XAK A 1 ? 235 ? K9N5Q8 367 ? 601 ? 367 601 2 2 4XAK H 1 ? 252 ? 4XAK 1 ? 240 ? 1 240 3 3 4XAK L 1 ? 214 ? 4XAK 1 ? 214 ? 1 214 4 1 4XAK B 1 ? 235 ? K9N5Q8 367 ? 601 ? 367 601 5 2 4XAK D 1 ? 252 ? 4XAK 1 ? 240 ? 1 240 6 3 4XAK E 1 ? 214 ? 4XAK 1 ? 214 ? 1 214 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 4XAK GLY A 236 ? UNP K9N5Q8 ? ? 'expression tag' 602 1 1 4XAK SER A 237 ? UNP K9N5Q8 ? ? 'expression tag' 603 2 1 4XAK LEU A 238 ? UNP K9N5Q8 ? ? 'expression tag' 604 3 1 4XAK GLU A 239 ? UNP K9N5Q8 ? ? 'expression tag' 605 4 1 4XAK VAL A 240 ? UNP K9N5Q8 ? ? 'expression tag' 606 5 1 4XAK LEU A 241 ? UNP K9N5Q8 ? ? 'expression tag' 607 6 1 4XAK PHE A 242 ? UNP K9N5Q8 ? ? 'expression tag' 608 7 1 4XAK GLN A 243 ? UNP K9N5Q8 ? ? 'expression tag' 609 8 1 4XAK GLY A 244 ? UNP K9N5Q8 ? ? 'expression tag' 610 9 1 4XAK PRO A 245 ? UNP K9N5Q8 ? ? 'expression tag' 611 10 1 4XAK GLY A 246 ? UNP K9N5Q8 ? ? 'expression tag' 612 11 1 4XAK HIS A 247 ? UNP K9N5Q8 ? ? 'expression tag' 613 12 1 4XAK HIS A 248 ? UNP K9N5Q8 ? ? 'expression tag' 614 13 1 4XAK HIS A 249 ? UNP K9N5Q8 ? ? 'expression tag' 615 14 1 4XAK HIS A 250 ? UNP K9N5Q8 ? ? 'expression tag' 616 15 1 4XAK HIS A 251 ? UNP K9N5Q8 ? ? 'expression tag' 617 16 1 4XAK HIS A 252 ? UNP K9N5Q8 ? ? 'expression tag' 618 17 4 4XAK GLY B 236 ? UNP K9N5Q8 ? ? 'expression tag' 602 18 4 4XAK SER B 237 ? UNP K9N5Q8 ? ? 'expression tag' 603 19 4 4XAK LEU B 238 ? UNP K9N5Q8 ? ? 'expression tag' 604 20 4 4XAK GLU B 239 ? UNP K9N5Q8 ? ? 'expression tag' 605 21 4 4XAK VAL B 240 ? UNP K9N5Q8 ? ? 'expression tag' 606 22 4 4XAK LEU B 241 ? UNP K9N5Q8 ? ? 'expression tag' 607 23 4 4XAK PHE B 242 ? UNP K9N5Q8 ? ? 'expression tag' 608 24 4 4XAK GLN B 243 ? UNP K9N5Q8 ? ? 'expression tag' 609 25 4 4XAK GLY B 244 ? UNP K9N5Q8 ? ? 'expression tag' 610 26 4 4XAK PRO B 245 ? UNP K9N5Q8 ? ? 'expression tag' 611 27 4 4XAK GLY B 246 ? UNP K9N5Q8 ? ? 'expression tag' 612 28 4 4XAK HIS B 247 ? UNP K9N5Q8 ? ? 'expression tag' 613 29 4 4XAK HIS B 248 ? UNP K9N5Q8 ? ? 'expression tag' 614 30 4 4XAK HIS B 249 ? UNP K9N5Q8 ? ? 'expression tag' 615 31 4 4XAK HIS B 250 ? UNP K9N5Q8 ? ? 'expression tag' 616 32 4 4XAK HIS B 251 ? UNP K9N5Q8 ? ? 'expression tag' 617 33 4 4XAK HIS B 252 ? UNP K9N5Q8 ? ? 'expression tag' 618 34 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 4XAK _exptl.crystals_number 1 _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.27 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 45.92 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details '20% PEG 2000MME, 100 mM HEPES, pH7.5' _exptl_crystal_grow.pdbx_pH_range 7.5 # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details 'Liquid nitrogen stream' _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details MAR300HS _diffrn_detector.detector CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'MARMOSAIC 300 mm CCD' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2014-08-23 # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.0000 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source SYNCHROTRON _diffrn_source.target ? _diffrn_source.type 'APS BEAMLINE 22-ID' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 1.0000 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline 22-ID _diffrn_source.pdbx_synchrotron_site APS # _reflns.B_iso_Wilson_estimate 47.670 _reflns.entry_id 4XAK _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.450 _reflns.d_resolution_low 50.000 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 48854 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I -3 _reflns.percent_possible_obs 91.500 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 3.700 _reflns.pdbx_Rmerge_I_obs 0.114 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI 10.912 _reflns.pdbx_netI_over_sigmaI 6.300 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared 0.946 _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all 0.129 _reflns.pdbx_Rpim_I_all 0.060 _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all 181576 _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? # loop_ _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.meanI_over_sigI_all _reflns_shell.meanI_over_sigI_obs _reflns_shell.number_measured_all _reflns_shell.number_measured_obs _reflns_shell.number_possible _reflns_shell.number_unique_all _reflns_shell.number_unique_obs _reflns_shell.percent_possible_all _reflns_shell.percent_possible_obs _reflns_shell.Rmerge_F_all _reflns_shell.Rmerge_F_obs _reflns_shell.Rmerge_I_all _reflns_shell.Rmerge_I_obs _reflns_shell.meanI_over_sigI_gt _reflns_shell.meanI_over_uI_all _reflns_shell.meanI_over_uI_gt _reflns_shell.number_measured_gt _reflns_shell.number_unique_gt _reflns_shell.percent_possible_gt _reflns_shell.Rmerge_F_gt _reflns_shell.Rmerge_I_gt _reflns_shell.pdbx_redundancy _reflns_shell.pdbx_Rsym_value _reflns_shell.pdbx_chi_squared _reflns_shell.pdbx_netI_over_sigmaI_all _reflns_shell.pdbx_netI_over_sigmaI_obs _reflns_shell.pdbx_Rrim_I_all _reflns_shell.pdbx_Rpim_I_all _reflns_shell.pdbx_rejects _reflns_shell.pdbx_ordinal _reflns_shell.pdbx_diffrn_id _reflns_shell.pdbx_CC_half _reflns_shell.pdbx_R_split 2.450 2.490 ? 1.3 ? ? ? 1381 ? 52.600 ? ? ? ? 0.475 ? ? ? ? ? ? ? ? 2.500 ? 0.465 ? ? 0.555 0.278 0 1 1 0.798 ? 2.490 2.540 ? ? ? ? ? 1696 ? 63.800 ? ? ? ? 0.487 ? ? ? ? ? ? ? ? 2.600 ? 0.483 ? ? 0.572 0.290 0 2 1 0.776 ? 2.540 2.590 ? ? ? ? ? 1939 ? 75.100 ? ? ? ? 0.455 ? ? ? ? ? ? ? ? 2.600 ? 0.488 ? ? 0.536 0.274 0 3 1 0.796 ? 2.590 2.640 ? ? ? ? ? 2226 ? 84.000 ? ? ? ? 0.414 ? ? ? ? ? ? ? ? 3.000 ? 0.568 ? ? 0.482 0.238 0 4 1 0.823 ? 2.640 2.700 ? ? ? ? ? 2291 ? 88.300 ? ? ? ? 0.398 ? ? ? ? ? ? ? ? 3.100 ? 0.544 ? ? 0.464 0.229 0 5 1 0.831 ? 2.700 2.760 ? ? ? ? ? 2389 ? 91.600 ? ? ? ? 0.402 ? ? ? ? ? ? ? ? 3.400 ? 0.607 ? ? 0.467 0.228 0 6 1 0.822 ? 2.760 2.830 ? ? ? ? ? 2540 ? 94.400 ? ? ? ? 0.358 ? ? ? ? ? ? ? ? 3.600 ? 0.649 ? ? 0.414 0.201 0 7 1 0.847 ? 2.830 2.900 ? ? ? ? ? 2531 ? 97.600 ? ? ? ? 0.335 ? ? ? ? ? ? ? ? 3.600 ? 0.683 ? ? 0.387 0.187 0 8 1 0.859 ? 2.900 2.990 ? ? ? ? ? 2644 ? 98.800 ? ? ? ? 0.285 ? ? ? ? ? ? ? ? 3.800 ? 0.783 ? ? 0.326 0.153 0 9 1 0.910 ? 2.990 3.090 ? ? ? ? ? 2588 ? 98.900 ? ? ? ? 0.276 ? ? ? ? ? ? ? ? 3.900 ? 0.851 ? ? 0.316 0.147 0 10 1 0.914 ? 3.090 3.200 ? ? ? ? ? 2650 ? 99.400 ? ? ? ? 0.238 ? ? ? ? ? ? ? ? 4.000 ? 1.029 ? ? 0.270 0.125 0 11 1 0.939 ? 3.200 3.320 ? ? ? ? ? 2603 ? 99.500 ? ? ? ? 0.209 ? ? ? ? ? ? ? ? 4.100 ? 1.142 ? ? 0.237 0.109 0 12 1 0.956 ? 3.320 3.480 ? ? ? ? ? 2633 ? 99.100 ? ? ? ? 0.175 ? ? ? ? ? ? ? ? 4.100 ? 1.181 ? ? 0.199 0.091 0 13 1 0.963 ? 3.480 3.660 ? ? ? ? ? 2659 ? 99.100 ? ? ? ? 0.140 ? ? ? ? ? ? ? ? 4.100 ? 1.248 ? ? 0.159 0.073 0 14 1 0.979 ? 3.660 3.890 ? ? ? ? ? 2640 ? 99.100 ? ? ? ? 0.120 ? ? ? ? ? ? ? ? 4.100 ? 1.374 ? ? 0.136 0.062 0 15 1 0.983 ? 3.890 4.190 ? ? ? ? ? 2642 ? 98.700 ? ? ? ? 0.102 ? ? ? ? ? ? ? ? 4.100 ? 1.157 ? ? 0.116 0.053 0 16 1 0.987 ? 4.190 4.610 ? ? ? ? ? 2642 ? 98.200 ? ? ? ? 0.084 ? ? ? ? ? ? ? ? 4.100 ? 1.225 ? ? 0.095 0.043 0 17 1 0.991 ? 4.610 5.280 ? ? ? ? ? 2690 ? 98.100 ? ? ? ? 0.074 ? ? ? ? ? ? ? ? 4.100 ? 1.138 ? ? 0.083 0.037 0 18 1 0.993 ? 5.280 6.650 ? ? ? ? ? 2678 ? 97.600 ? ? ? ? 0.064 ? ? ? ? ? ? ? ? 4.000 ? 0.838 ? ? 0.073 0.034 0 19 1 0.994 ? 6.650 50.000 ? ? ? ? ? 2792 ? 95.200 ? ? ? ? 0.054 ? ? ? ? ? ? ? ? 3.800 ? 0.945 ? ? 0.061 0.029 0 20 1 0.995 ? # _refine.aniso_B[1][1] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][2] ? _refine.aniso_B[2][3] ? _refine.aniso_B[3][3] ? _refine.B_iso_max 166.980 _refine.B_iso_mean 67.0747 _refine.B_iso_min 25.670 _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.details ? _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 4XAK _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.45 _refine.ls_d_res_low 45.4490 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 48806 _refine.ls_number_reflns_R_free 2479 _refine.ls_number_reflns_R_work 46327 _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 91.5100 _refine.ls_percent_reflns_R_free 5.0800 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.2008 _refine.ls_R_factor_R_free 0.2491 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1982 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.360 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 4KQZ _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_R_Free_selection_details 'Random selection' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.1100 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 26.7100 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.3400 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.cycle_id final _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.d_res_high 2.45 _refine_hist.d_res_low 45.4490 _refine_hist.pdbx_number_atoms_ligand 68 _refine_hist.number_atoms_solvent 236 _refine_hist.number_atoms_total 10049 _refine_hist.pdbx_number_residues_total 1286 _refine_hist.pdbx_B_iso_mean_ligand 74.74 _refine_hist.pdbx_B_iso_mean_solvent 53.00 _refine_hist.pdbx_number_atoms_protein 9745 _refine_hist.pdbx_number_atoms_nucleic_acid 0 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.002 ? 10053 ? f_bond_d ? ? 'X-RAY DIFFRACTION' ? 0.624 ? 13656 ? f_angle_d ? ? 'X-RAY DIFFRACTION' ? 0.024 ? 1573 ? f_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.003 ? 1736 ? f_plane_restr ? ? 'X-RAY DIFFRACTION' ? 10.376 ? 3592 ? f_dihedral_angle_d ? ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.R_factor_R_work _refine_ls_shell.redundancy_reflns_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.wR_factor_all _refine_ls_shell.wR_factor_obs _refine_ls_shell.wR_factor_R_free _refine_ls_shell.wR_factor_R_work _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.pdbx_phase_error _refine_ls_shell.pdbx_fsc_work _refine_ls_shell.pdbx_fsc_free 'X-RAY DIFFRACTION' 2.4463 2.4933 . . 76 1435 51.0000 . . . 0.3393 . 0.2783 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.4933 2.5442 . . 93 1807 66.0000 . . . 0.3061 . 0.2867 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.5442 2.5995 . . 112 2142 78.0000 . . . 0.3340 . 0.2735 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.5995 2.6600 . . 137 2386 85.0000 . . . 0.3275 . 0.2623 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.6600 2.7265 . . 146 2458 90.0000 . . . 0.3015 . 0.2581 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.7265 2.8002 . . 155 2621 94.0000 . . . 0.2922 . 0.2502 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.8002 2.8826 . . 147 2631 97.0000 . . . 0.3057 . 0.2542 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.8826 2.9756 . . 148 2801 99.0000 . . . 0.2966 . 0.2379 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.9756 3.0820 . . 161 2729 99.0000 . . . 0.2907 . 0.2414 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.0820 3.2053 . . 143 2808 99.0000 . . . 0.3331 . 0.2280 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.2053 3.3512 . . 123 2765 99.0000 . . . 0.2528 . 0.2114 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.3512 3.5278 . . 160 2750 99.0000 . . . 0.2476 . 0.2064 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.5278 3.7487 . . 132 2829 99.0000 . . . 0.2584 . 0.1919 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.7487 4.0380 . . 141 2816 99.0000 . . . 0.2375 . 0.1907 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.0380 4.4440 . . 152 2778 98.0000 . . . 0.2381 . 0.1596 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.4440 5.0864 . . 155 2788 98.0000 . . . 0.1967 . 0.1545 . . . . . . . . . . 'X-RAY DIFFRACTION' 5.0864 6.4054 . . 140 2855 98.0000 . . . 0.2293 . 0.1813 . . . . . . . . . . 'X-RAY DIFFRACTION' 6.4054 45.4571 . . 158 2928 96.0000 . . . 0.2012 . 0.1758 . . . . . . . . . . # _struct.entry_id 4XAK _struct.title 'Crystal structure of potent neutralizing antibody m336 in complex with MERS Co-V RBD' _struct.pdbx_descriptor 'MERS-CoV Receptor-binding domain' _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag ? # _struct_keywords.entry_id 4XAK _struct_keywords.text 'MERS-CoV RBD, antibody m336, neutralization, IMMUNE SYSTEM' _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 1 ? E N N 2 ? F N N 3 ? G N N 4 ? H N N 4 ? I N N 5 ? J N N 5 ? K N N 4 ? L N N 4 ? M N N 6 ? N N N 6 ? O N N 6 ? P N N 6 ? Q N N 6 ? R N N 6 ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 AA1 PHE A 19 ? SER A 24 ? PHE A 385 SER A 390 1 ? 6 HELX_P HELX_P2 AA2 GLN A 29 ? PHE A 33 ? GLN A 395 PHE A 399 5 ? 5 HELX_P HELX_P3 AA3 ASN A 44 ? LEU A 51 ? ASN A 410 LEU A 417 1 ? 8 HELX_P HELX_P4 AA4 PRO A 83 ? SER A 91 ? PRO A 449 SER A 457 5 ? 9 HELX_P HELX_P5 AA5 GLY A 96 ? ASN A 102 ? GLY A 462 ASN A 468 1 ? 7 HELX_P HELX_P6 AA6 SER A 158 ? ILE A 163 ? SER A 524 ILE A 529 5 ? 6 HELX_P HELX_P7 AA7 SER A 180 ? GLY A 184 ? SER A 546 GLY A 550 5 ? 5 HELX_P HELX_P8 AA8 ARG B 87 ? THR B 91 ? ARG H 83 THR H 87 5 ? 5 HELX_P HELX_P9 AA9 SER B 139 ? THR B 143 ? SER H 127 THR H 131 5 ? 5 HELX_P HELX_P10 AB1 SER B 168 ? ALA B 170 ? SER H 156 ALA H 158 5 ? 3 HELX_P HELX_P11 AB2 SER B 199 ? THR B 203 ? SER H 187 THR H 191 5 ? 5 HELX_P HELX_P12 AB3 LYS B 213 ? ASN B 216 ? LYS H 201 ASN H 204 5 ? 4 HELX_P HELX_P13 AB4 GLN C 79 ? PHE C 83 ? GLN L 79 PHE L 83 5 ? 5 HELX_P HELX_P14 AB5 SER C 121 ? LYS C 126 ? SER L 121 LYS L 126 1 ? 6 HELX_P HELX_P15 AB6 LYS C 183 ? HIS C 189 ? LYS L 183 HIS L 189 1 ? 7 HELX_P HELX_P16 AB7 PHE D 19 ? SER D 24 ? PHE B 385 SER B 390 5 ? 6 HELX_P HELX_P17 AB8 GLN D 29 ? PHE D 33 ? GLN B 395 PHE B 399 5 ? 5 HELX_P HELX_P18 AB9 ASN D 44 ? LEU D 51 ? ASN B 410 LEU B 417 1 ? 8 HELX_P HELX_P19 AC1 SER D 63 ? ALA D 68 ? SER B 429 ALA B 434 1 ? 6 HELX_P HELX_P20 AC2 PRO D 83 ? LYS D 87 ? PRO B 449 LYS B 453 5 ? 5 HELX_P HELX_P21 AC3 GLY D 96 ? ASN D 102 ? GLY B 462 ASN B 468 1 ? 7 HELX_P HELX_P22 AC4 SER D 158 ? ILE D 163 ? SER B 524 ILE B 529 5 ? 6 HELX_P HELX_P23 AC5 SER D 180 ? GLY D 184 ? SER B 546 GLY B 550 5 ? 5 HELX_P HELX_P24 AC6 ARG E 87 ? THR E 91 ? ARG D 83 THR D 87 5 ? 5 HELX_P HELX_P25 AC7 SER E 168 ? ALA E 170 ? SER D 156 ALA D 158 5 ? 3 HELX_P HELX_P26 AC8 PRO E 197 ? LEU E 201 ? PRO D 185 LEU D 189 5 ? 5 HELX_P HELX_P27 AC9 LYS E 213 ? ASN E 216 ? LYS D 201 ASN D 204 5 ? 4 HELX_P HELX_P28 AD1 SER F 121 ? LYS F 126 ? SER E 121 LYS E 126 1 ? 6 HELX_P HELX_P29 AD2 LYS F 183 ? GLU F 187 ? LYS E 183 GLU E 187 1 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 17 SG ? ? ? 1_555 A CYS 41 SG ? ? A CYS 383 A CYS 407 1_555 ? ? ? ? ? ? ? 2.031 ? disulf2 disulf ? ? A CYS 59 SG ? ? ? 1_555 A CYS 112 SG ? ? A CYS 425 A CYS 478 1_555 ? ? ? ? ? ? ? 2.027 ? disulf3 disulf ? ? A CYS 71 SG ? ? ? 1_555 A CYS 219 SG ? ? A CYS 437 A CYS 585 1_555 ? ? ? ? ? ? ? 2.036 ? disulf4 disulf ? ? A CYS 137 SG ? ? ? 1_555 A CYS 160 SG ? ? A CYS 503 A CYS 526 1_555 ? ? ? ? ? ? ? 2.033 ? disulf5 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 96 SG ? ? H CYS 22 H CYS 92 1_555 ? ? ? ? ? ? ? 2.035 ? disulf6 disulf ? ? B CYS 102 SG ? ? ? 1_555 B CYS 107 SG ? C H CYS 98 H CYS 100 1_555 ? ? ? ? ? ? ? 2.038 ? disulf7 disulf ? ? B CYS 152 SG ? ? ? 1_555 B CYS 208 SG ? ? H CYS 140 H CYS 196 1_555 ? ? ? ? ? ? ? 2.037 ? disulf8 disulf ? ? C CYS 23 SG ? ? ? 1_555 C CYS 88 SG ? ? L CYS 23 L CYS 88 1_555 ? ? ? ? ? ? ? 2.030 ? disulf9 disulf ? ? C CYS 134 SG ? ? ? 1_555 C CYS 194 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 2.031 ? disulf10 disulf ? ? D CYS 17 SG ? ? ? 1_555 D CYS 41 SG ? ? B CYS 383 B CYS 407 1_555 ? ? ? ? ? ? ? 2.031 ? disulf11 disulf ? ? D CYS 59 SG ? ? ? 1_555 D CYS 112 SG ? ? B CYS 425 B CYS 478 1_555 ? ? ? ? ? ? ? 2.034 ? disulf12 disulf ? ? D CYS 71 SG ? ? ? 1_555 D CYS 219 SG ? ? B CYS 437 B CYS 585 1_555 ? ? ? ? ? ? ? 2.037 ? disulf13 disulf ? ? D CYS 137 SG ? ? ? 1_555 D CYS 160 SG ? ? B CYS 503 B CYS 526 1_555 ? ? ? ? ? ? ? 2.030 ? disulf14 disulf ? ? E CYS 22 SG ? ? ? 1_555 E CYS 96 SG ? ? D CYS 22 D CYS 92 1_555 ? ? ? ? ? ? ? 2.031 ? disulf15 disulf ? ? E CYS 102 SG ? ? ? 1_555 E CYS 107 SG ? C D CYS 98 D CYS 100 1_555 ? ? ? ? ? ? ? 2.034 ? disulf16 disulf ? ? E CYS 152 SG ? ? ? 1_555 E CYS 208 SG ? ? D CYS 140 D CYS 196 1_555 ? ? ? ? ? ? ? 2.033 ? disulf17 disulf ? ? F CYS 23 SG ? ? ? 1_555 F CYS 88 SG ? ? E CYS 23 E CYS 88 1_555 ? ? ? ? ? ? ? 2.033 ? disulf18 disulf ? ? F CYS 134 SG ? ? ? 1_555 F CYS 194 SG ? ? E CYS 134 E CYS 194 1_555 ? ? ? ? ? ? ? 2.028 ? covale1 covale one ? A ASN 44 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 410 A NAG 701 1_555 ? ? ? ? ? ? ? 1.442 ? covale2 covale one ? A ASN 121 ND2 ? ? ? 1_555 H NAG . C1 ? ? A ASN 487 A NAG 702 1_555 ? ? ? ? ? ? ? 1.441 ? covale3 covale one ? D ASN 44 ND2 ? ? ? 1_555 K NAG . C1 ? ? B ASN 410 B NAG 701 1_555 ? ? ? ? ? ? ? 1.439 ? covale4 covale one ? D ASN 121 ND2 ? ? ? 1_555 L NAG . C1 ? ? B ASN 487 B NAG 702 1_555 ? ? ? ? ? ? ? 1.428 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 PHE 158 B . ? PHE 146 H PRO 159 B ? PRO 147 H 1 -4.71 2 GLU 160 B . ? GLU 148 H PRO 161 B ? PRO 149 H 1 -7.14 3 SER 7 C . ? SER 7 L PRO 8 C ? PRO 8 L 1 -0.89 4 TYR 94 C . ? TYR 94 L PRO 95 C ? PRO 95 L 1 -4.65 5 TYR 140 C . ? TYR 140 L PRO 141 C ? PRO 141 L 1 2.30 6 PHE 158 E . ? PHE 146 D PRO 159 E ? PRO 147 D 1 -4.33 7 GLU 160 E . ? GLU 148 D PRO 161 E ? PRO 149 D 1 -3.68 8 SER 7 F . ? SER 7 E PRO 8 F ? PRO 8 E 1 -0.59 9 TYR 94 F . ? TYR 94 E PRO 95 F ? PRO 95 E 1 -2.63 10 TYR 140 F . ? TYR 140 E PRO 141 F ? PRO 141 E 1 -0.28 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 5 ? AA2 ? 2 ? AA3 ? 4 ? AA4 ? 4 ? AA5 ? 6 ? AA6 ? 4 ? AA7 ? 4 ? AA8 ? 4 ? AA9 ? 3 ? AB1 ? 4 ? AB2 ? 6 ? AB3 ? 4 ? AB4 ? 4 ? AB5 ? 5 ? AB6 ? 2 ? AB7 ? 4 ? AB8 ? 4 ? AB9 ? 6 ? AC1 ? 4 ? AC2 ? 4 ? AC3 ? 4 ? AC4 ? 3 ? AC5 ? 4 ? AC6 ? 6 ? AC7 ? 4 ? AC8 ? 3 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA2 1 2 ? parallel AA3 1 2 ? anti-parallel AA3 2 3 ? anti-parallel AA3 3 4 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? anti-parallel AA4 3 4 ? anti-parallel AA5 1 2 ? parallel AA5 2 3 ? anti-parallel AA5 3 4 ? anti-parallel AA5 4 5 ? anti-parallel AA5 5 6 ? anti-parallel AA6 1 2 ? parallel AA6 2 3 ? anti-parallel AA6 3 4 ? anti-parallel AA7 1 2 ? anti-parallel AA7 2 3 ? anti-parallel AA7 3 4 ? anti-parallel AA8 1 2 ? anti-parallel AA8 2 3 ? anti-parallel AA8 3 4 ? anti-parallel AA9 1 2 ? anti-parallel AA9 2 3 ? anti-parallel AB1 1 2 ? anti-parallel AB1 2 3 ? anti-parallel AB1 3 4 ? anti-parallel AB2 1 2 ? parallel AB2 2 3 ? anti-parallel AB2 3 4 ? anti-parallel AB2 4 5 ? anti-parallel AB2 5 6 ? anti-parallel AB3 1 2 ? anti-parallel AB3 2 3 ? anti-parallel AB3 3 4 ? anti-parallel AB4 1 2 ? anti-parallel AB4 2 3 ? anti-parallel AB4 3 4 ? anti-parallel AB5 1 2 ? anti-parallel AB5 2 3 ? anti-parallel AB5 3 4 ? anti-parallel AB5 4 5 ? anti-parallel AB6 1 2 ? parallel AB7 1 2 ? anti-parallel AB7 2 3 ? anti-parallel AB7 3 4 ? anti-parallel AB8 1 2 ? anti-parallel AB8 2 3 ? anti-parallel AB8 3 4 ? anti-parallel AB9 1 2 ? parallel AB9 2 3 ? anti-parallel AB9 3 4 ? anti-parallel AB9 4 5 ? anti-parallel AB9 5 6 ? anti-parallel AC1 1 2 ? parallel AC1 2 3 ? anti-parallel AC1 3 4 ? anti-parallel AC2 1 2 ? anti-parallel AC2 2 3 ? anti-parallel AC2 3 4 ? anti-parallel AC3 1 2 ? anti-parallel AC3 2 3 ? anti-parallel AC3 3 4 ? anti-parallel AC4 1 2 ? anti-parallel AC4 2 3 ? anti-parallel AC5 1 2 ? anti-parallel AC5 2 3 ? anti-parallel AC5 3 4 ? anti-parallel AC6 1 2 ? parallel AC6 2 3 ? anti-parallel AC6 3 4 ? anti-parallel AC6 4 5 ? anti-parallel AC6 5 6 ? anti-parallel AC7 1 2 ? anti-parallel AC7 2 3 ? anti-parallel AC7 3 4 ? anti-parallel AC8 1 2 ? anti-parallel AC8 2 3 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id AA1 1 LYS A 34 ? PHE A 38 ? LYS A 400 PHE A 404 AA1 2 SER A 74 ? SER A 81 ? SER A 440 SER A 447 AA1 3 GLN A 202 ? GLN A 210 ? GLN A 568 GLN A 576 AA1 4 THR A 111 ? THR A 117 ? THR A 477 THR A 483 AA1 5 SER A 53 ? SER A 60 ? SER A 419 SER A 426 AA2 1 ASN A 42 ? TYR A 43 ? ASN A 408 TYR A 409 AA2 2 CYS A 219 ? PRO A 220 ? CYS A 585 PRO A 586 AA3 1 GLU A 147 ? PRO A 149 ? GLU A 513 PRO A 515 AA3 2 TYR A 131 ? PHE A 140 ? TYR A 497 PHE A 506 AA3 3 TRP A 187 ? VAL A 195 ? TRP A 553 VAL A 561 AA3 4 ASP A 173 ? GLN A 178 ? ASP A 539 GLN A 544 AA4 1 GLN B 3 ? GLN B 6 ? GLN H 3 GLN H 6 AA4 2 VAL B 18 ? SER B 25 ? VAL H 18 SER H 25 AA4 3 THR B 78 ? LEU B 83 ? THR H 77 LEU H 82 AA4 4 VAL B 68 ? ASP B 73 ? VAL H 67 ASP H 72 AA5 1 GLU B 10 ? LYS B 12 ? GLU H 10 LYS H 12 AA5 2 THR B 119 ? VAL B 123 ? THR H 107 VAL H 111 AA5 3 ALA B 92 ? CYS B 102 ? ALA H 88 CYS H 98 AA5 4 ILE B 34 ? GLN B 39 ? ILE H 34 GLN H 39 AA5 5 GLU B 46 ? ILE B 51 ? GLU H 46 ILE H 51 AA5 6 ALA B 58 ? TYR B 60 ? ALA H 57 TYR H 59 AA6 1 GLU B 10 ? LYS B 12 ? GLU H 10 LYS H 12 AA6 2 THR B 119 ? VAL B 123 ? THR H 107 VAL H 111 AA6 3 ALA B 92 ? CYS B 102 ? ALA H 88 CYS H 98 AA6 4 GLY B 110 F TRP B 115 ? GLY H 100 TRP H 103 AA7 1 SER B 132 ? LEU B 136 ? SER H 120 LEU H 124 AA7 2 THR B 147 ? TYR B 157 ? THR H 135 TYR H 145 AA7 3 TYR B 188 ? PRO B 197 ? TYR H 176 PRO H 185 AA7 4 VAL B 175 ? THR B 177 ? VAL H 163 THR H 165 AA8 1 SER B 132 ? LEU B 136 ? SER H 120 LEU H 124 AA8 2 THR B 147 ? TYR B 157 ? THR H 135 TYR H 145 AA8 3 TYR B 188 ? PRO B 197 ? TYR H 176 PRO H 185 AA8 4 VAL B 181 ? LEU B 182 ? VAL H 169 LEU H 170 AA9 1 THR B 163 ? TRP B 166 ? THR H 151 TRP H 154 AA9 2 TYR B 206 ? HIS B 212 ? TYR H 194 HIS H 200 AA9 3 THR B 217 ? VAL B 223 ? THR H 205 VAL H 211 AB1 1 LEU C 4 ? SER C 7 ? LEU L 4 SER L 7 AB1 2 VAL C 19 ? ALA C 25 ? VAL L 19 ALA L 25 AB1 3 ASP C 70 ? ILE C 75 ? ASP L 70 ILE L 75 AB1 4 PHE C 62 ? GLY C 66 ? PHE L 62 GLY L 66 AB2 1 SER C 10 ? ALA C 13 ? SER L 10 ALA L 13 AB2 2 THR C 102 ? ILE C 106 ? THR L 102 ILE L 106 AB2 3 THR C 85 ? GLN C 90 ? THR L 85 GLN L 90 AB2 4 LEU C 33 ? GLN C 38 ? LEU L 33 GLN L 38 AB2 5 LYS C 45 ? TYR C 49 ? LYS L 45 TYR L 49 AB2 6 SER C 53 ? LEU C 54 ? SER L 53 LEU L 54 AB3 1 SER C 114 ? PHE C 118 ? SER L 114 PHE L 118 AB3 2 THR C 129 ? PHE C 139 ? THR L 129 PHE L 139 AB3 3 TYR C 173 ? SER C 182 ? TYR L 173 SER L 182 AB3 4 SER C 159 ? VAL C 163 ? SER L 159 VAL L 163 AB4 1 ALA C 153 ? LEU C 154 ? ALA L 153 LEU L 154 AB4 2 LYS C 145 ? VAL C 150 ? LYS L 145 VAL L 150 AB4 3 VAL C 191 ? THR C 197 ? VAL L 191 THR L 197 AB4 4 VAL C 205 ? ASN C 210 ? VAL L 205 ASN L 210 AB5 1 LYS D 34 ? PHE D 38 ? LYS B 400 PHE B 404 AB5 2 SER D 74 ? SER D 81 ? SER B 440 SER B 447 AB5 3 GLN D 202 ? GLN D 210 ? GLN B 568 GLN B 576 AB5 4 THR D 111 ? THR D 117 ? THR B 477 THR B 483 AB5 5 SER D 53 ? SER D 60 ? SER B 419 SER B 426 AB6 1 ASN D 42 ? TYR D 43 ? ASN B 408 TYR B 409 AB6 2 CYS D 219 ? PRO D 220 ? CYS B 585 PRO B 586 AB7 1 GLU D 147 ? PRO D 149 ? GLU B 513 PRO B 515 AB7 2 TYR D 131 ? PHE D 140 ? TYR B 497 PHE B 506 AB7 3 TRP D 187 ? VAL D 195 ? TRP B 553 VAL B 561 AB7 4 ASP D 173 ? GLN D 178 ? ASP B 539 GLN B 544 AB8 1 GLN E 3 ? GLN E 6 ? GLN D 3 GLN D 6 AB8 2 VAL E 18 ? SER E 25 ? VAL D 18 SER D 25 AB8 3 THR E 78 ? LEU E 83 ? THR D 77 LEU D 82 AB8 4 VAL E 68 ? ASP E 73 ? VAL D 67 ASP D 72 AB9 1 GLU E 10 ? LYS E 12 ? GLU D 10 LYS D 12 AB9 2 THR E 119 ? VAL E 123 ? THR D 107 VAL D 111 AB9 3 ALA E 92 ? CYS E 102 ? ALA D 88 CYS D 98 AB9 4 ILE E 34 ? GLN E 39 ? ILE D 34 GLN D 39 AB9 5 LEU E 45 ? ILE E 51 ? LEU D 45 ILE D 51 AB9 6 ALA E 58 ? TYR E 60 ? ALA D 57 TYR D 59 AC1 1 GLU E 10 ? LYS E 12 ? GLU D 10 LYS D 12 AC1 2 THR E 119 ? VAL E 123 ? THR D 107 VAL D 111 AC1 3 ALA E 92 ? CYS E 102 ? ALA D 88 CYS D 98 AC1 4 GLY E 110 F TRP E 115 ? GLY D 100 TRP D 103 AC2 1 SER E 132 ? LEU E 136 ? SER D 120 LEU D 124 AC2 2 ALA E 148 ? TYR E 157 ? ALA D 136 TYR D 145 AC2 3 TYR E 188 ? VAL E 196 ? TYR D 176 VAL D 184 AC2 4 VAL E 175 ? THR E 177 ? VAL D 163 THR D 165 AC3 1 SER E 132 ? LEU E 136 ? SER D 120 LEU D 124 AC3 2 ALA E 148 ? TYR E 157 ? ALA D 136 TYR D 145 AC3 3 TYR E 188 ? VAL E 196 ? TYR D 176 VAL D 184 AC3 4 VAL E 181 ? LEU E 182 ? VAL D 169 LEU D 170 AC4 1 THR E 163 ? TRP E 166 ? THR D 151 TRP D 154 AC4 2 ILE E 207 ? HIS E 212 ? ILE D 195 HIS D 200 AC4 3 THR E 217 ? LYS E 222 ? THR D 205 LYS D 210 AC5 1 LEU F 4 ? SER F 7 ? LEU E 4 SER E 7 AC5 2 VAL F 19 ? ALA F 25 ? VAL E 19 ALA E 25 AC5 3 ASP F 70 ? ILE F 75 ? ASP E 70 ILE E 75 AC5 4 PHE F 62 ? SER F 65 ? PHE E 62 SER E 65 AC6 1 SER F 10 ? ALA F 13 ? SER E 10 ALA E 13 AC6 2 THR F 102 ? ILE F 106 ? THR E 102 ILE E 106 AC6 3 THR F 85 ? GLN F 90 ? THR E 85 GLN E 90 AC6 4 LEU F 33 ? GLN F 38 ? LEU E 33 GLN E 38 AC6 5 LYS F 45 ? TYR F 49 ? LYS E 45 TYR E 49 AC6 6 SER F 53 ? LEU F 54 ? SER E 53 LEU E 54 AC7 1 SER F 114 ? PHE F 118 ? SER E 114 PHE E 118 AC7 2 THR F 129 ? PHE F 139 ? THR E 129 PHE E 139 AC7 3 TYR F 173 ? SER F 182 ? TYR E 173 SER E 182 AC7 4 SER F 159 ? VAL F 163 ? SER E 159 VAL E 163 AC8 1 LYS F 145 ? LYS F 149 ? LYS E 145 LYS E 149 AC8 2 VAL F 191 ? THR F 197 ? VAL E 191 THR E 197 AC8 3 VAL F 205 ? ASN F 210 ? VAL E 205 ASN E 210 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 N PHE A 38 ? N PHE A 404 O LEU A 75 ? O LEU A 441 AA1 2 3 N ASP A 78 ? N ASP A 444 O GLY A 206 ? O GLY A 572 AA1 3 4 O MET A 203 ? O MET A 569 N ALA A 116 ? N ALA A 482 AA1 4 5 O THR A 111 ? O THR A 477 N SER A 60 ? N SER A 426 AA2 1 2 N TYR A 43 ? N TYR A 409 O CYS A 219 ? O CYS A 585 AA3 1 2 O VAL A 148 ? O VAL A 514 N ARG A 139 ? N ARG A 505 AA3 2 3 N SER A 138 ? N SER A 504 O VAL A 189 ? O VAL A 555 AA3 3 4 O LEU A 188 ? O LEU A 554 N LYS A 177 ? N LYS A 543 AA4 1 2 N GLN B 3 ? N GLN H 3 O SER B 25 ? O SER H 25 AA4 2 3 N CYS B 22 ? N CYS H 22 O ALA B 79 ? O ALA H 78 AA4 3 4 O GLU B 82 ? O GLU H 81 N THR B 69 ? N THR H 68 AA5 1 2 N GLU B 10 ? N GLU H 10 O THR B 122 ? O THR H 110 AA5 2 3 O THR B 119 ? O THR H 107 N TYR B 94 ? N TYR H 90 AA5 3 4 O TYR B 95 ? O TYR H 91 N VAL B 37 ? N VAL H 37 AA5 4 5 N TRP B 36 ? N TRP H 36 O GLY B 49 ? O GLY H 49 AA5 5 6 N GLY B 50 ? N GLY H 50 O SER B 59 ? O SER H 58 AA6 1 2 N GLU B 10 ? N GLU H 10 O THR B 122 ? O THR H 110 AA6 2 3 O THR B 119 ? O THR H 107 N TYR B 94 ? N TYR H 90 AA6 3 4 N ARG B 98 ? N ARG H 94 O ILE B 114 ? O ILE H 102 AA7 1 2 N PHE B 134 ? N PHE H 122 O LEU B 153 ? O LEU H 141 AA7 2 3 N ALA B 148 ? N ALA H 136 O VAL B 196 ? O VAL H 184 AA7 3 4 O VAL B 193 ? O VAL H 181 N HIS B 176 ? N HIS H 164 AA8 1 2 N PHE B 134 ? N PHE H 122 O LEU B 153 ? O LEU H 141 AA8 2 3 N ALA B 148 ? N ALA H 136 O VAL B 196 ? O VAL H 184 AA8 3 4 O SER B 189 ? O SER H 177 N VAL B 181 ? N VAL H 169 AA9 1 2 N THR B 163 ? N THR H 151 O ASN B 211 ? O ASN H 199 AA9 2 3 N CYS B 208 ? N CYS H 196 O LYS B 221 ? O LYS H 209 AB1 1 2 N SER C 7 ? N SER L 7 O THR C 22 ? O THR L 22 AB1 2 3 N ILE C 21 ? N ILE L 21 O LEU C 73 ? O LEU L 73 AB1 3 4 O THR C 74 ? O THR L 74 N SER C 63 ? N SER L 63 AB2 1 2 N LEU C 11 ? N LEU L 11 O LYS C 103 ? O LYS L 103 AB2 2 3 O THR C 102 ? O THR L 102 N TYR C 86 ? N TYR L 86 AB2 3 4 O GLN C 89 ? O GLN L 89 N GLY C 34 ? N GLY L 34 AB2 4 5 N TRP C 35 ? N TRP L 35 O LEU C 47 ? O LEU L 47 AB2 5 6 N TYR C 49 ? N TYR L 49 O SER C 53 ? O SER L 53 AB3 1 2 N PHE C 116 ? N PHE L 116 O LEU C 135 ? O LEU L 135 AB3 2 3 N ALA C 130 ? N ALA L 130 O LEU C 181 ? O LEU L 181 AB3 3 4 O THR C 178 ? O THR L 178 N GLN C 160 ? N GLN L 160 AB4 1 2 O ALA C 153 ? O ALA L 153 N VAL C 150 ? N VAL L 150 AB4 2 3 N GLN C 147 ? N GLN L 147 O GLU C 195 ? O GLU L 195 AB4 3 4 N VAL C 196 ? N VAL L 196 O VAL C 205 ? O VAL L 205 AB5 1 2 N LEU D 36 ? N LEU B 402 O LEU D 77 ? O LEU B 443 AB5 2 3 N ASP D 78 ? N ASP B 444 O GLY D 206 ? O GLY B 572 AB5 3 4 O PHE D 205 ? O PHE B 571 N ILE D 114 ? N ILE B 480 AB5 4 5 O THR D 111 ? O THR B 477 N SER D 60 ? N SER B 426 AB6 1 2 N TYR D 43 ? N TYR B 409 O CYS D 219 ? O CYS B 585 AB7 1 2 O VAL D 148 ? O VAL B 514 N ARG D 139 ? N ARG B 505 AB7 2 3 N PHE D 140 ? N PHE B 506 O TRP D 187 ? O TRP B 553 AB7 3 4 O ALA D 190 ? O ALA B 556 N TYR D 175 ? N TYR B 541 AB8 1 2 N VAL E 5 ? N VAL D 5 O LYS E 23 ? O LYS D 23 AB8 2 3 N CYS E 22 ? N CYS D 22 O ALA E 79 ? O ALA D 78 AB8 3 4 O TYR E 80 ? O TYR D 79 N THR E 71 ? N THR D 70 AB9 1 2 N GLU E 10 ? N GLU D 10 O MET E 120 ? O MET D 108 AB9 2 3 O THR E 119 ? O THR D 107 N TYR E 94 ? N TYR D 90 AB9 3 4 O ALA E 97 ? O ALA D 93 N SER E 35 ? N SER D 35 AB9 4 5 N TRP E 36 ? N TRP D 36 O GLY E 49 ? O GLY D 49 AB9 5 6 N GLY E 50 ? N GLY D 50 O SER E 59 ? O SER D 58 AC1 1 2 N GLU E 10 ? N GLU D 10 O MET E 120 ? O MET D 108 AC1 2 3 O THR E 119 ? O THR D 107 N TYR E 94 ? N TYR D 90 AC1 3 4 N ARG E 98 ? N ARG D 94 O ILE E 114 ? O ILE D 102 AC2 1 2 N LEU E 136 ? N LEU D 124 O GLY E 151 ? O GLY D 139 AC2 2 3 N VAL E 154 ? N VAL D 142 O LEU E 190 ? O LEU D 178 AC2 3 4 O VAL E 193 ? O VAL D 181 N HIS E 176 ? N HIS D 164 AC3 1 2 N LEU E 136 ? N LEU D 124 O GLY E 151 ? O GLY D 139 AC3 2 3 N VAL E 154 ? N VAL D 142 O LEU E 190 ? O LEU D 178 AC3 3 4 O SER E 189 ? O SER D 177 N VAL E 181 ? N VAL D 169 AC4 1 2 N SER E 165 ? N SER D 153 O ASN E 209 ? O ASN D 197 AC4 2 3 N CYS E 208 ? N CYS D 196 O LYS E 221 ? O LYS D 209 AC5 1 2 N SER F 7 ? N SER E 7 O THR F 22 ? O THR E 22 AC5 2 3 N ILE F 21 ? N ILE E 21 O LEU F 73 ? O LEU E 73 AC5 3 4 O THR F 72 ? O THR E 72 N SER F 65 ? N SER E 65 AC6 1 2 N LEU F 11 ? N LEU E 11 O GLU F 105 ? O GLU E 105 AC6 2 3 O THR F 102 ? O THR E 102 N TYR F 86 ? N TYR E 86 AC6 3 4 O THR F 85 ? O THR E 85 N GLN F 38 ? N GLN E 38 AC6 4 5 N GLN F 37 ? N GLN E 37 O LYS F 45 ? O LYS E 45 AC6 5 6 N TYR F 49 ? N TYR E 49 O SER F 53 ? O SER E 53 AC7 1 2 N PHE F 116 ? N PHE E 116 O LEU F 135 ? O LEU E 135 AC7 2 3 N VAL F 132 ? N VAL E 132 O LEU F 179 ? O LEU E 179 AC7 3 4 O THR F 178 ? O THR E 178 N GLN F 160 ? N GLN E 160 AC8 1 2 N LYS F 145 ? N LYS E 145 O THR F 197 ? O THR E 197 AC8 2 3 N VAL F 196 ? N VAL E 196 O VAL F 205 ? O VAL E 205 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software L GOL 500 ? 11 'binding site for residue GOL L 500' AC2 Software L GOL 501 ? 6 'binding site for residue GOL L 501' AC3 Software A NAG 701 ? 7 'binding site for Mono-Saccharide NAG A 701 bound to ASN A 410' AC4 Software A NAG 702 ? 2 'binding site for Mono-Saccharide NAG A 702 bound to ASN A 487' AC5 Software B NAG 701 ? 6 'binding site for Mono-Saccharide NAG B 701 bound to ASN B 410' AC6 Software B NAG 702 ? 2 'binding site for Mono-Saccharide NAG B 702 bound to ASN B 487' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 11 PHE B 178 ? PHE H 166 . ? 1_555 ? 2 AC1 11 PRO B 179 ? PRO H 167 . ? 1_555 ? 3 AC1 11 SER B 189 ? SER H 177 . ? 1_555 ? 4 AC1 11 LEU B 190 ? LEU H 178 . ? 1_555 ? 5 AC1 11 SER B 191 ? SER H 179 . ? 1_555 ? 6 AC1 11 GLN C 160 ? GLN L 160 . ? 1_555 ? 7 AC1 11 SER C 162 ? SER L 162 . ? 1_555 ? 8 AC1 11 SER C 176 ? SER L 176 . ? 1_555 ? 9 AC1 11 SER C 177 ? SER L 177 . ? 1_555 ? 10 AC1 11 THR C 178 ? THR L 178 . ? 1_555 ? 11 AC1 11 HOH O . ? HOH L 663 . ? 1_555 ? 12 AC2 6 GLN C 37 ? GLN L 37 . ? 1_555 ? 13 AC2 6 LYS C 45 ? LYS L 45 . ? 1_555 ? 14 AC2 6 PRO C 59 ? PRO L 59 . ? 1_555 ? 15 AC2 6 PHE C 62 ? PHE L 62 . ? 1_555 ? 16 AC2 6 GLU C 81 ? GLU L 81 . ? 1_555 ? 17 AC2 6 ASP C 82 ? ASP L 82 . ? 1_555 ? 18 AC3 7 ASN A 44 ? ASN A 410 . ? 1_555 ? 19 AC3 7 THR A 46 ? THR A 412 . ? 1_555 ? 20 AC3 7 LYS A 47 ? LYS A 413 . ? 1_555 ? 21 AC3 7 LYS A 221 ? LYS A 587 . ? 1_555 ? 22 AC3 7 LEU A 222 ? LEU A 588 . ? 1_555 ? 23 AC3 7 GLU A 223 ? GLU A 589 . ? 1_555 ? 24 AC3 7 LYS F 149 ? LYS E 149 . ? 3_655 ? 25 AC4 2 ASN A 121 ? ASN A 487 . ? 1_555 ? 26 AC4 2 LYS F 145 ? LYS E 145 . ? 3_655 ? 27 AC5 6 ASN D 44 ? ASN B 410 . ? 1_555 ? 28 AC5 6 LYS D 47 ? LYS B 413 . ? 1_555 ? 29 AC5 6 SER D 50 ? SER B 416 . ? 1_555 ? 30 AC5 6 LYS D 221 ? LYS B 587 . ? 1_555 ? 31 AC5 6 GLU D 223 ? GLU B 589 . ? 1_555 ? 32 AC5 6 LYS B 222 ? LYS H 210 . ? 2_755 ? 33 AC6 2 ASN D 121 ? ASN B 487 . ? 1_555 ? 34 AC6 2 LYS C 188 ? LYS L 188 . ? 3_745 ? # _atom_sites.entry_id 4XAK _atom_sites.fract_transf_matrix[1][1] 0.020923 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.006808 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.004987 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . VAL A 1 15 ? 11.727 112.388 70.055 1.00 66.68 ? 381 VAL A N 1 ATOM 2 C CA . VAL A 1 15 ? 10.276 112.253 70.060 1.00 65.78 ? 381 VAL A CA 1 ATOM 3 C C . VAL A 1 15 ? 9.816 111.188 69.068 1.00 65.79 ? 381 VAL A C 1 ATOM 4 O O . VAL A 1 15 ? 9.083 110.268 69.428 1.00 68.75 ? 381 VAL A O 1 ATOM 5 C CB . VAL A 1 15 ? 9.580 113.592 69.726 1.00 67.55 ? 381 VAL A CB 1 ATOM 6 C CG1 . VAL A 1 15 ? 8.078 113.397 69.591 1.00 66.50 ? 381 VAL A CG1 1 ATOM 7 C CG2 . VAL A 1 15 ? 9.892 114.632 70.788 1.00 74.40 ? 381 VAL A CG2 1 ATOM 8 N N . GLU A 1 16 ? 10.259 111.311 67.821 1.00 65.31 ? 382 GLU A N 1 ATOM 9 C CA . GLU A 1 16 ? 9.804 110.417 66.760 1.00 63.95 ? 382 GLU A CA 1 ATOM 10 C C . GLU A 1 16 ? 10.841 109.356 66.393 1.00 57.47 ? 382 GLU A C 1 ATOM 11 O O . GLU A 1 16 ? 12.027 109.653 66.265 1.00 58.69 ? 382 GLU A O 1 ATOM 12 C CB . GLU A 1 16 ? 9.427 111.228 65.518 1.00 70.13 ? 382 GLU A CB 1 ATOM 13 C CG . GLU A 1 16 ? 8.930 110.384 64.357 1.00 72.17 ? 382 GLU A CG 1 ATOM 14 C CD . GLU A 1 16 ? 8.478 111.220 63.178 1.00 77.79 ? 382 GLU A CD 1 ATOM 15 O OE1 . GLU A 1 16 ? 8.404 110.672 62.057 1.00 77.12 ? 382 GLU A OE1 1 ATOM 16 O OE2 . GLU A 1 16 ? 8.192 112.423 63.373 1.00 80.58 ? 382 GLU A OE2 1 ATOM 17 N N . CYS A 1 17 ? 10.380 108.119 66.226 1.00 52.01 ? 383 CYS A N 1 ATOM 18 C CA . CYS A 1 17 ? 11.242 107.008 65.825 1.00 55.29 ? 383 CYS A CA 1 ATOM 19 C C . CYS A 1 17 ? 11.782 107.201 64.411 1.00 62.31 ? 383 CYS A C 1 ATOM 20 O O . CYS A 1 17 ? 11.029 107.522 63.492 1.00 68.93 ? 383 CYS A O 1 ATOM 21 C CB . CYS A 1 17 ? 10.482 105.681 65.909 1.00 54.95 ? 383 CYS A CB 1 ATOM 22 S SG . CYS A 1 17 ? 9.899 105.247 67.560 1.00 66.03 ? 383 CYS A SG 1 ATOM 23 N N . ASP A 1 18 ? 13.083 106.990 64.238 1.00 64.06 ? 384 ASP A N 1 ATOM 24 C CA . ASP A 1 18 ? 13.729 107.233 62.953 1.00 64.86 ? 384 ASP A CA 1 ATOM 25 C C . ASP A 1 18 ? 14.038 105.943 62.192 1.00 56.57 ? 384 ASP A C 1 ATOM 26 O O . ASP A 1 18 ? 14.868 105.144 62.625 1.00 54.37 ? 384 ASP A O 1 ATOM 27 C CB . ASP A 1 18 ? 15.017 108.030 63.158 1.00 71.08 ? 384 ASP A CB 1 ATOM 28 C CG . ASP A 1 18 ? 15.668 108.424 61.852 1.00 78.60 ? 384 ASP A CG 1 ATOM 29 O OD1 . ASP A 1 18 ? 14.929 108.671 60.876 1.00 78.21 ? 384 ASP A OD1 1 ATOM 30 O OD2 . ASP A 1 18 ? 16.915 108.487 61.804 1.00 84.74 ? 384 ASP A OD2 1 ATOM 31 N N . PHE A 1 19 ? 13.374 105.754 61.053 1.00 57.07 ? 385 PHE A N 1 ATOM 32 C CA . PHE A 1 19 ? 13.582 104.568 60.222 1.00 57.83 ? 385 PHE A CA 1 ATOM 33 C C . PHE A 1 19 ? 14.431 104.887 58.994 1.00 62.93 ? 385 PHE A C 1 ATOM 34 O O . PHE A 1 19 ? 14.464 104.113 58.037 1.00 66.33 ? 385 PHE A O 1 ATOM 35 C CB . PHE A 1 19 ? 12.242 103.975 59.776 1.00 56.82 ? 385 PHE A CB 1 ATOM 36 C CG . PHE A 1 19 ? 11.299 103.676 60.906 1.00 61.39 ? 385 PHE A CG 1 ATOM 37 C CD1 . PHE A 1 19 ? 11.399 102.491 61.615 1.00 58.08 ? 385 PHE A CD1 1 ATOM 38 C CD2 . PHE A 1 19 ? 10.305 104.576 61.250 1.00 64.51 ? 385 PHE A CD2 1 ATOM 39 C CE1 . PHE A 1 19 ? 10.530 102.213 62.654 1.00 55.02 ? 385 PHE A CE1 1 ATOM 40 C CE2 . PHE A 1 19 ? 9.433 104.303 62.287 1.00 64.44 ? 385 PHE A CE2 1 ATOM 41 C CZ . PHE A 1 19 ? 9.547 103.119 62.988 1.00 58.67 ? 385 PHE A CZ 1 ATOM 42 N N . SER A 1 20 ? 15.107 106.031 59.028 1.00 64.99 ? 386 SER A N 1 ATOM 43 C CA . SER A 1 20 ? 15.920 106.497 57.905 1.00 62.90 ? 386 SER A CA 1 ATOM 44 C C . SER A 1 20 ? 17.047 105.553 57.451 1.00 61.13 ? 386 SER A C 1 ATOM 45 O O . SER A 1 20 ? 17.240 105.387 56.246 1.00 59.92 ? 386 SER A O 1 ATOM 46 C CB . SER A 1 20 ? 16.519 107.865 58.237 1.00 68.03 ? 386 SER A CB 1 ATOM 47 O OG . SER A 1 20 ? 15.497 108.829 58.404 1.00 74.14 ? 386 SER A OG 1 ATOM 48 N N . PRO A 1 21 ? 17.803 104.945 58.393 1.00 62.31 ? 387 PRO A N 1 ATOM 49 C CA . PRO A 1 21 ? 18.875 104.046 57.940 1.00 62.54 ? 387 PRO A CA 1 ATOM 50 C C . PRO A 1 21 ? 18.386 102.917 57.035 1.00 67.69 ? 387 PRO A C 1 ATOM 51 O O . PRO A 1 21 ? 19.157 102.381 56.238 1.00 75.16 ? 387 PRO A O 1 ATOM 52 C CB . PRO A 1 21 ? 19.426 103.476 59.249 1.00 63.15 ? 387 PRO A CB 1 ATOM 53 C CG . PRO A 1 21 ? 19.145 104.522 60.254 1.00 66.02 ? 387 PRO A CG 1 ATOM 54 C CD . PRO A 1 21 ? 17.825 105.110 59.860 1.00 64.25 ? 387 PRO A CD 1 ATOM 55 N N . LEU A 1 22 ? 17.112 102.565 57.164 1.00 65.70 ? 388 LEU A N 1 ATOM 56 C CA . LEU A 1 22 ? 16.505 101.539 56.330 1.00 64.26 ? 388 LEU A CA 1 ATOM 57 C C . LEU A 1 22 ? 16.367 102.004 54.882 1.00 64.95 ? 388 LEU A C 1 ATOM 58 O O . LEU A 1 22 ? 16.535 101.219 53.948 1.00 63.67 ? 388 LEU A O 1 ATOM 59 C CB . LEU A 1 22 ? 15.138 101.149 56.897 1.00 65.21 ? 388 LEU A CB 1 ATOM 60 C CG . LEU A 1 22 ? 14.124 100.488 55.965 1.00 66.08 ? 388 LEU A CG 1 ATOM 61 C CD1 . LEU A 1 22 ? 14.641 99.153 55.465 1.00 68.93 ? 388 LEU A CD1 1 ATOM 62 C CD2 . LEU A 1 22 ? 12.790 100.316 56.672 1.00 65.65 ? 388 LEU A CD2 1 ATOM 63 N N . LEU A 1 23 ? 16.071 103.287 54.702 1.00 65.93 ? 389 LEU A N 1 ATOM 64 C CA . LEU A 1 23 ? 15.752 103.822 53.383 1.00 61.03 ? 389 LEU A CA 1 ATOM 65 C C . LEU A 1 23 ? 16.988 104.202 52.575 1.00 59.30 ? 389 LEU A C 1 ATOM 66 O O . LEU A 1 23 ? 16.876 104.649 51.436 1.00 60.76 ? 389 LEU A O 1 ATOM 67 C CB . LEU A 1 23 ? 14.837 105.039 53.526 1.00 59.16 ? 389 LEU A CB 1 ATOM 68 C CG . LEU A 1 23 ? 13.530 104.789 54.283 1.00 53.19 ? 389 LEU A CG 1 ATOM 69 C CD1 . LEU A 1 23 ? 12.770 106.087 54.487 1.00 57.86 ? 389 LEU A CD1 1 ATOM 70 C CD2 . LEU A 1 23 ? 12.673 103.775 53.542 1.00 50.32 ? 389 LEU A CD2 1 ATOM 71 N N . SER A 1 24 ? 18.165 104.021 53.161 1.00 60.06 ? 390 SER A N 1 ATOM 72 C CA . SER A 1 24 ? 19.400 104.451 52.513 1.00 61.76 ? 390 SER A CA 1 ATOM 73 C C . SER A 1 24 ? 20.438 103.334 52.448 1.00 64.42 ? 390 SER A C 1 ATOM 74 O O . SER A 1 24 ? 20.664 102.623 53.427 1.00 70.17 ? 390 SER A O 1 ATOM 75 C CB . SER A 1 24 ? 19.980 105.663 53.241 1.00 63.55 ? 390 SER A CB 1 ATOM 76 O OG . SER A 1 24 ? 21.191 106.088 52.641 1.00 73.06 ? 390 SER A OG 1 ATOM 77 N N . GLY A 1 25 ? 21.065 103.184 51.285 1.00 62.15 ? 391 GLY A N 1 ATOM 78 C CA . GLY A 1 25 ? 22.101 102.184 51.098 1.00 58.20 ? 391 GLY A CA 1 ATOM 79 C C . GLY A 1 25 ? 21.573 100.860 50.579 1.00 57.21 ? 391 GLY A C 1 ATOM 80 O O . GLY A 1 25 ? 20.387 100.721 50.279 1.00 55.23 ? 391 GLY A O 1 ATOM 81 N N . THR A 1 26 ? 22.467 99.884 50.470 1.00 55.72 ? 392 THR A N 1 ATOM 82 C CA . THR A 1 26 ? 22.101 98.547 50.020 1.00 47.54 ? 392 THR A CA 1 ATOM 83 C C . THR A 1 26 ? 21.802 97.642 51.206 1.00 50.73 ? 392 THR A C 1 ATOM 84 O O . THR A 1 26 ? 22.683 97.379 52.023 1.00 56.40 ? 392 THR A O 1 ATOM 85 C CB . THR A 1 26 ? 23.221 97.911 49.173 1.00 47.60 ? 392 THR A CB 1 ATOM 86 O OG1 . THR A 1 26 ? 23.453 98.705 48.002 1.00 47.72 ? 392 THR A OG1 1 ATOM 87 C CG2 . THR A 1 26 ? 22.844 96.494 48.762 1.00 42.13 ? 392 THR A CG2 1 ATOM 88 N N . PRO A 1 27 ? 20.554 97.163 51.309 1.00 50.75 ? 393 PRO A N 1 ATOM 89 C CA . PRO A 1 27 ? 20.195 96.255 52.403 1.00 49.48 ? 393 PRO A CA 1 ATOM 90 C C . PRO A 1 27 ? 20.965 94.941 52.317 1.00 49.25 ? 393 PRO A C 1 ATOM 91 O O . PRO A 1 27 ? 21.169 94.423 51.220 1.00 51.76 ? 393 PRO A O 1 ATOM 92 C CB . PRO A 1 27 ? 18.690 96.035 52.206 1.00 45.46 ? 393 PRO A CB 1 ATOM 93 C CG . PRO A 1 27 ? 18.440 96.360 50.780 1.00 49.31 ? 393 PRO A CG 1 ATOM 94 C CD . PRO A 1 27 ? 19.416 97.434 50.415 1.00 51.85 ? 393 PRO A CD 1 ATOM 95 N N . PRO A 1 28 ? 21.396 94.411 53.470 1.00 46.29 ? 394 PRO A N 1 ATOM 96 C CA . PRO A 1 28 ? 22.203 93.188 53.521 1.00 44.31 ? 394 PRO A CA 1 ATOM 97 C C . PRO A 1 28 ? 21.372 91.943 53.238 1.00 45.83 ? 394 PRO A C 1 ATOM 98 O O . PRO A 1 28 ? 20.146 92.026 53.182 1.00 49.09 ? 394 PRO A O 1 ATOM 99 C CB . PRO A 1 28 ? 22.722 93.178 54.958 1.00 40.33 ? 394 PRO A CB 1 ATOM 100 C CG . PRO A 1 28 ? 21.649 93.867 55.730 1.00 42.54 ? 394 PRO A CG 1 ATOM 101 C CD . PRO A 1 28 ? 21.099 94.933 54.816 1.00 44.75 ? 394 PRO A CD 1 ATOM 102 N N . GLN A 1 29 ? 22.034 90.804 53.062 1.00 42.84 ? 395 GLN A N 1 ATOM 103 C CA . GLN A 1 29 ? 21.326 89.542 52.906 1.00 40.57 ? 395 GLN A CA 1 ATOM 104 C C . GLN A 1 29 ? 20.784 89.077 54.255 1.00 41.48 ? 395 GLN A C 1 ATOM 105 O O . GLN A 1 29 ? 21.109 89.653 55.296 1.00 41.66 ? 395 GLN A O 1 ATOM 106 C CB . GLN A 1 29 ? 22.237 88.475 52.300 1.00 41.61 ? 395 GLN A CB 1 ATOM 107 C CG . GLN A 1 29 ? 23.006 88.927 51.068 1.00 46.54 ? 395 GLN A CG 1 ATOM 108 C CD . GLN A 1 29 ? 22.106 89.293 49.902 1.00 53.89 ? 395 GLN A CD 1 ATOM 109 O OE1 . GLN A 1 29 ? 20.963 88.845 49.813 1.00 54.53 ? 395 GLN A OE1 1 ATOM 110 N NE2 . GLN A 1 29 ? 22.627 90.111 48.994 1.00 61.63 ? 395 GLN A NE2 1 ATOM 111 N N . VAL A 1 30 ? 19.973 88.024 54.228 1.00 39.52 ? 396 VAL A N 1 ATOM 112 C CA . VAL A 1 30 ? 19.245 87.571 55.406 1.00 33.93 ? 396 VAL A CA 1 ATOM 113 C C . VAL A 1 30 ? 20.167 87.190 56.571 1.00 35.08 ? 396 VAL A C 1 ATOM 114 O O . VAL A 1 30 ? 19.892 87.534 57.722 1.00 38.07 ? 396 VAL A O 1 ATOM 115 C CB . VAL A 1 30 ? 18.317 86.381 55.049 1.00 36.96 ? 396 VAL A CB 1 ATOM 116 C CG1 . VAL A 1 30 ? 19.075 85.287 54.309 1.00 40.17 ? 396 VAL A CG1 1 ATOM 117 C CG2 . VAL A 1 30 ? 17.632 85.835 56.291 1.00 38.55 ? 396 VAL A CG2 1 ATOM 118 N N . TYR A 1 31 ? 21.276 86.515 56.279 1.00 35.59 ? 397 TYR A N 1 ATOM 119 C CA . TYR A 1 31 ? 22.193 86.090 57.336 1.00 36.25 ? 397 TYR A CA 1 ATOM 120 C C . TYR A 1 31 ? 22.958 87.259 57.961 1.00 39.24 ? 397 TYR A C 1 ATOM 121 O O . TYR A 1 31 ? 23.549 87.116 59.031 1.00 41.81 ? 397 TYR A O 1 ATOM 122 C CB . TYR A 1 31 ? 23.178 85.040 56.811 1.00 37.61 ? 397 TYR A CB 1 ATOM 123 C CG . TYR A 1 31 ? 23.906 85.418 55.538 1.00 38.26 ? 397 TYR A CG 1 ATOM 124 C CD1 . TYR A 1 31 ? 23.373 85.109 54.293 1.00 36.67 ? 397 TYR A CD1 1 ATOM 125 C CD2 . TYR A 1 31 ? 25.134 86.062 55.582 1.00 40.01 ? 397 TYR A CD2 1 ATOM 126 C CE1 . TYR A 1 31 ? 24.032 85.444 53.130 1.00 45.47 ? 397 TYR A CE1 1 ATOM 127 C CE2 . TYR A 1 31 ? 25.806 86.401 54.420 1.00 46.57 ? 397 TYR A CE2 1 ATOM 128 C CZ . TYR A 1 31 ? 25.249 86.089 53.197 1.00 49.74 ? 397 TYR A CZ 1 ATOM 129 O OH . TYR A 1 31 ? 25.906 86.420 52.035 1.00 47.50 ? 397 TYR A OH 1 ATOM 130 N N . ASN A 1 32 ? 22.942 88.415 57.303 1.00 40.30 ? 398 ASN A N 1 ATOM 131 C CA . ASN A 1 32 ? 23.551 89.615 57.870 1.00 44.96 ? 398 ASN A CA 1 ATOM 132 C C . ASN A 1 32 ? 22.525 90.710 58.138 1.00 48.47 ? 398 ASN A C 1 ATOM 133 O O . ASN A 1 32 ? 22.815 91.889 57.950 1.00 54.76 ? 398 ASN A O 1 ATOM 134 C CB . ASN A 1 32 ? 24.644 90.161 56.943 1.00 45.02 ? 398 ASN A CB 1 ATOM 135 C CG . ASN A 1 32 ? 25.922 89.344 56.993 1.00 50.76 ? 398 ASN A CG 1 ATOM 136 O OD1 . ASN A 1 32 ? 26.327 88.860 58.051 1.00 53.17 ? 398 ASN A OD1 1 ATOM 137 N ND2 . ASN A 1 32 ? 26.568 89.194 55.843 1.00 51.20 ? 398 ASN A ND2 1 ATOM 138 N N . PHE A 1 33 ? 21.334 90.316 58.584 1.00 46.76 ? 399 PHE A N 1 ATOM 139 C CA . PHE A 1 33 ? 20.229 91.254 58.796 1.00 44.99 ? 399 PHE A CA 1 ATOM 140 C C . PHE A 1 33 ? 20.612 92.440 59.678 1.00 45.69 ? 399 PHE A C 1 ATOM 141 O O . PHE A 1 33 ? 21.254 92.278 60.715 1.00 47.13 ? 399 PHE A O 1 ATOM 142 C CB . PHE A 1 33 ? 19.020 90.532 59.404 1.00 37.23 ? 399 PHE A CB 1 ATOM 143 C CG . PHE A 1 33 ? 19.286 89.906 60.749 1.00 38.44 ? 399 PHE A CG 1 ATOM 144 C CD1 . PHE A 1 33 ? 18.966 90.575 61.920 1.00 36.27 ? 399 PHE A CD1 1 ATOM 145 C CD2 . PHE A 1 33 ? 19.839 88.639 60.840 1.00 40.77 ? 399 PHE A CD2 1 ATOM 146 C CE1 . PHE A 1 33 ? 19.206 89.996 63.152 1.00 39.20 ? 399 PHE A CE1 1 ATOM 147 C CE2 . PHE A 1 33 ? 20.081 88.055 62.069 1.00 37.71 ? 399 PHE A CE2 1 ATOM 148 C CZ . PHE A 1 33 ? 19.766 88.734 63.227 1.00 39.13 ? 399 PHE A CZ 1 ATOM 149 N N . LYS A 1 34 ? 20.218 93.634 59.248 1.00 42.50 ? 400 LYS A N 1 ATOM 150 C CA . LYS A 1 34 ? 20.463 94.849 60.016 1.00 42.95 ? 400 LYS A CA 1 ATOM 151 C C . LYS A 1 34 ? 19.360 95.036 61.052 1.00 43.67 ? 400 LYS A C 1 ATOM 152 O O . LYS A 1 34 ? 18.178 94.916 60.736 1.00 46.66 ? 400 LYS A O 1 ATOM 153 C CB . LYS A 1 34 ? 20.543 96.066 59.093 1.00 45.22 ? 400 LYS A CB 1 ATOM 154 C CG . LYS A 1 34 ? 20.773 97.385 59.811 1.00 52.25 ? 400 LYS A CG 1 ATOM 155 C CD . LYS A 1 34 ? 22.139 97.436 60.476 1.00 60.34 ? 400 LYS A CD 1 ATOM 156 C CE . LYS A 1 34 ? 22.379 98.784 61.136 1.00 70.17 ? 400 LYS A CE 1 ATOM 157 N NZ . LYS A 1 34 ? 23.748 98.890 61.719 1.00 76.80 ? 400 LYS A NZ 1 ATOM 158 N N . ARG A 1 35 ? 19.751 95.325 62.289 1.00 44.16 ? 401 ARG A N 1 ATOM 159 C CA . ARG A 1 35 ? 18.791 95.449 63.378 1.00 46.21 ? 401 ARG A CA 1 ATOM 160 C C . ARG A 1 35 ? 18.711 96.868 63.931 1.00 51.78 ? 401 ARG A C 1 ATOM 161 O O . ARG A 1 35 ? 19.717 97.459 64.315 1.00 52.41 ? 401 ARG A O 1 ATOM 162 C CB . ARG A 1 35 ? 19.138 94.477 64.509 1.00 45.26 ? 401 ARG A CB 1 ATOM 163 C CG . ARG A 1 35 ? 18.303 94.677 65.768 1.00 44.37 ? 401 ARG A CG 1 ATOM 164 C CD . ARG A 1 35 ? 18.377 93.476 66.699 1.00 48.93 ? 401 ARG A CD 1 ATOM 165 N NE . ARG A 1 35 ? 17.674 92.319 66.152 1.00 48.51 ? 401 ARG A NE 1 ATOM 166 C CZ . ARG A 1 35 ? 17.317 91.254 66.863 1.00 48.52 ? 401 ARG A CZ 1 ATOM 167 N NH1 . ARG A 1 35 ? 17.590 91.194 68.159 1.00 39.12 ? 401 ARG A NH1 1 ATOM 168 N NH2 . ARG A 1 35 ? 16.680 90.248 66.279 1.00 44.85 ? 401 ARG A NH2 1 ATOM 169 N N . LEU A 1 36 ? 17.497 97.405 63.967 1.00 53.45 ? 402 LEU A N 1 ATOM 170 C CA . LEU A 1 36 ? 17.247 98.690 64.600 1.00 49.65 ? 402 LEU A CA 1 ATOM 171 C C . LEU A 1 36 ? 16.493 98.473 65.905 1.00 48.00 ? 402 LEU A C 1 ATOM 172 O O . LEU A 1 36 ? 15.529 97.712 65.954 1.00 50.18 ? 402 LEU A O 1 ATOM 173 C CB . LEU A 1 36 ? 16.463 99.613 63.665 1.00 48.79 ? 402 LEU A CB 1 ATOM 174 C CG . LEU A 1 36 ? 17.088 99.849 62.286 1.00 51.16 ? 402 LEU A CG 1 ATOM 175 C CD1 . LEU A 1 36 ? 16.180 100.707 61.420 1.00 52.19 ? 402 LEU A CD1 1 ATOM 176 C CD2 . LEU A 1 36 ? 18.464 100.485 62.416 1.00 53.61 ? 402 LEU A CD2 1 ATOM 177 N N . VAL A 1 37 ? 16.951 99.131 66.963 1.00 52.93 ? 403 VAL A N 1 ATOM 178 C CA . VAL A 1 37 ? 16.315 99.034 68.274 1.00 56.18 ? 403 VAL A CA 1 ATOM 179 C C . VAL A 1 37 ? 15.740 100.385 68.691 1.00 57.50 ? 403 VAL A C 1 ATOM 180 O O . VAL A 1 37 ? 16.465 101.376 68.773 1.00 58.09 ? 403 VAL A O 1 ATOM 181 C CB . VAL A 1 37 ? 17.309 98.546 69.349 1.00 56.39 ? 403 VAL A CB 1 ATOM 182 C CG1 . VAL A 1 37 ? 16.641 98.509 70.708 1.00 57.97 ? 403 VAL A CG1 1 ATOM 183 C CG2 . VAL A 1 37 ? 17.864 97.177 68.980 1.00 53.81 ? 403 VAL A CG2 1 ATOM 184 N N . PHE A 1 38 ? 14.435 100.420 68.948 1.00 58.66 ? 404 PHE A N 1 ATOM 185 C CA . PHE A 1 38 ? 13.757 101.668 69.293 1.00 56.12 ? 404 PHE A CA 1 ATOM 186 C C . PHE A 1 38 ? 13.214 101.679 70.718 1.00 58.05 ? 404 PHE A C 1 ATOM 187 O O . PHE A 1 38 ? 12.451 100.797 71.112 1.00 59.61 ? 404 PHE A O 1 ATOM 188 C CB . PHE A 1 38 ? 12.608 101.942 68.320 1.00 48.56 ? 404 PHE A CB 1 ATOM 189 C CG . PHE A 1 38 ? 13.052 102.177 66.909 1.00 50.53 ? 404 PHE A CG 1 ATOM 190 C CD1 . PHE A 1 38 ? 13.559 103.407 66.525 1.00 53.99 ? 404 PHE A CD1 1 ATOM 191 C CD2 . PHE A 1 38 ? 12.953 101.170 65.960 1.00 49.03 ? 404 PHE A CD2 1 ATOM 192 C CE1 . PHE A 1 38 ? 13.967 103.626 65.222 1.00 51.45 ? 404 PHE A CE1 1 ATOM 193 C CE2 . PHE A 1 38 ? 13.357 101.385 64.656 1.00 46.74 ? 404 PHE A CE2 1 ATOM 194 C CZ . PHE A 1 38 ? 13.865 102.615 64.289 1.00 47.71 ? 404 PHE A CZ 1 ATOM 195 N N . THR A 1 39 ? 13.619 102.687 71.484 1.00 56.24 ? 405 THR A N 1 ATOM 196 C CA . THR A 1 39 ? 13.057 102.935 72.803 1.00 56.98 ? 405 THR A CA 1 ATOM 197 C C . THR A 1 39 ? 12.785 104.427 72.944 1.00 62.05 ? 405 THR A C 1 ATOM 198 O O . THR A 1 39 ? 13.474 105.243 72.331 1.00 66.69 ? 405 THR A O 1 ATOM 199 C CB . THR A 1 39 ? 13.994 102.468 73.936 1.00 59.67 ? 405 THR A CB 1 ATOM 200 O OG1 . THR A 1 39 ? 15.241 103.165 73.847 1.00 63.08 ? 405 THR A OG1 1 ATOM 201 C CG2 . THR A 1 39 ? 14.248 100.969 73.854 1.00 58.94 ? 405 THR A CG2 1 ATOM 202 N N . ASN A 1 40 ? 11.773 104.771 73.737 1.00 60.57 ? 406 ASN A N 1 ATOM 203 C CA . ASN A 1 40 ? 11.426 106.165 74.009 1.00 66.97 ? 406 ASN A CA 1 ATOM 204 C C . ASN A 1 40 ? 11.214 107.008 72.752 1.00 63.71 ? 406 ASN A C 1 ATOM 205 O O . ASN A 1 40 ? 11.861 108.039 72.580 1.00 65.60 ? 406 ASN A O 1 ATOM 206 C CB . ASN A 1 40 ? 12.507 106.823 74.874 1.00 75.69 ? 406 ASN A CB 1 ATOM 207 C CG . ASN A 1 40 ? 12.650 106.169 76.233 1.00 81.06 ? 406 ASN A CG 1 ATOM 208 O OD1 . ASN A 1 40 ? 11.665 105.753 76.842 1.00 84.68 ? 406 ASN A OD1 1 ATOM 209 N ND2 . ASN A 1 40 ? 13.883 106.078 76.717 1.00 81.66 ? 406 ASN A ND2 1 ATOM 210 N N . CYS A 1 41 ? 10.313 106.576 71.877 1.00 58.63 ? 407 CYS A N 1 ATOM 211 C CA . CYS A 1 41 ? 10.017 107.345 70.672 1.00 52.80 ? 407 CYS A CA 1 ATOM 212 C C . CYS A 1 41 ? 8.633 107.033 70.112 1.00 57.02 ? 407 CYS A C 1 ATOM 213 O O . CYS A 1 41 ? 7.987 106.066 70.516 1.00 55.66 ? 407 CYS A O 1 ATOM 214 C CB . CYS A 1 41 ? 11.083 107.092 69.600 1.00 51.80 ? 407 CYS A CB 1 ATOM 215 S SG . CYS A 1 41 ? 11.247 105.371 69.074 1.00 65.24 ? 407 CYS A SG 1 ATOM 216 N N . ASN A 1 42 ? 8.188 107.864 69.175 1.00 54.52 ? 408 ASN A N 1 ATOM 217 C CA . ASN A 1 42 ? 6.887 107.696 68.544 1.00 50.40 ? 408 ASN A CA 1 ATOM 218 C C . ASN A 1 42 ? 7.037 107.294 67.079 1.00 51.01 ? 408 ASN A C 1 ATOM 219 O O . ASN A 1 42 ? 7.837 107.879 66.352 1.00 53.09 ? 408 ASN A O 1 ATOM 220 C CB . ASN A 1 42 ? 6.073 108.985 68.666 1.00 53.86 ? 408 ASN A CB 1 ATOM 221 C CG . ASN A 1 42 ? 6.002 109.495 70.095 1.00 62.83 ? 408 ASN A CG 1 ATOM 222 O OD1 . ASN A 1 42 ? 5.992 108.712 71.046 1.00 63.93 ? 408 ASN A OD1 1 ATOM 223 N ND2 . ASN A 1 42 ? 5.959 110.815 70.255 1.00 64.78 ? 408 ASN A ND2 1 ATOM 224 N N . TYR A 1 43 ? 6.265 106.301 66.647 1.00 45.39 ? 409 TYR A N 1 ATOM 225 C CA . TYR A 1 43 ? 6.412 105.760 65.298 1.00 43.65 ? 409 TYR A CA 1 ATOM 226 C C . TYR A 1 43 ? 5.172 105.936 64.427 1.00 47.66 ? 409 TYR A C 1 ATOM 227 O O . TYR A 1 43 ? 4.049 106.022 64.929 1.00 46.94 ? 409 TYR A O 1 ATOM 228 C CB . TYR A 1 43 ? 6.764 104.271 65.367 1.00 42.34 ? 409 TYR A CB 1 ATOM 229 C CG . TYR A 1 43 ? 5.681 103.407 65.985 1.00 45.54 ? 409 TYR A CG 1 ATOM 230 C CD1 . TYR A 1 43 ? 4.654 102.876 65.209 1.00 44.70 ? 409 TYR A CD1 1 ATOM 231 C CD2 . TYR A 1 43 ? 5.687 103.119 67.344 1.00 46.21 ? 409 TYR A CD2 1 ATOM 232 C CE1 . TYR A 1 43 ? 3.666 102.089 65.769 1.00 42.29 ? 409 TYR A CE1 1 ATOM 233 C CE2 . TYR A 1 43 ? 4.704 102.330 67.911 1.00 44.31 ? 409 TYR A CE2 1 ATOM 234 C CZ . TYR A 1 43 ? 3.697 101.819 67.119 1.00 44.33 ? 409 TYR A CZ 1 ATOM 235 O OH . TYR A 1 43 ? 2.715 101.037 67.680 1.00 46.93 ? 409 TYR A OH 1 ATOM 236 N N . ASN A 1 44 ? 5.390 105.983 63.117 1.00 48.31 ? 410 ASN A N 1 ATOM 237 C CA . ASN A 1 44 ? 4.309 105.871 62.145 1.00 59.69 ? 410 ASN A CA 1 ATOM 238 C C . ASN A 1 44 ? 4.607 104.703 61.211 1.00 65.46 ? 410 ASN A C 1 ATOM 239 O O . ASN A 1 44 ? 5.242 104.873 60.171 1.00 69.97 ? 410 ASN A O 1 ATOM 240 C CB . ASN A 1 44 ? 4.132 107.170 61.351 1.00 62.37 ? 410 ASN A CB 1 ATOM 241 C CG . ASN A 1 44 ? 2.843 107.190 60.539 1.00 72.95 ? 410 ASN A CG 1 ATOM 242 O OD1 . ASN A 1 44 ? 2.203 106.157 60.343 1.00 73.42 ? 410 ASN A OD1 1 ATOM 243 N ND2 . ASN A 1 44 ? 2.456 108.370 60.060 1.00 91.95 ? 410 ASN A ND2 1 ATOM 244 N N . LEU A 1 45 ? 4.157 103.515 61.599 1.00 62.61 ? 411 LEU A N 1 ATOM 245 C CA . LEU A 1 45 ? 4.424 102.304 60.833 1.00 61.74 ? 411 LEU A CA 1 ATOM 246 C C . LEU A 1 45 ? 3.766 102.359 59.458 1.00 64.50 ? 411 LEU A C 1 ATOM 247 O O . LEU A 1 45 ? 4.349 101.920 58.465 1.00 64.63 ? 411 LEU A O 1 ATOM 248 C CB . LEU A 1 45 ? 3.945 101.072 61.609 1.00 62.18 ? 411 LEU A CB 1 ATOM 249 C CG . LEU A 1 45 ? 4.066 99.692 60.955 1.00 65.74 ? 411 LEU A CG 1 ATOM 250 C CD1 . LEU A 1 45 ? 4.474 98.654 61.984 1.00 63.10 ? 411 LEU A CD1 1 ATOM 251 C CD2 . LEU A 1 45 ? 2.751 99.286 60.308 1.00 75.26 ? 411 LEU A CD2 1 ATOM 252 N N . THR A 1 46 ? 2.554 102.902 59.406 1.00 67.84 ? 412 THR A N 1 ATOM 253 C CA . THR A 1 46 ? 1.795 102.968 58.162 1.00 69.12 ? 412 THR A CA 1 ATOM 254 C C . THR A 1 46 ? 2.508 103.813 57.113 1.00 70.28 ? 412 THR A C 1 ATOM 255 O O . THR A 1 46 ? 2.431 103.528 55.918 1.00 76.23 ? 412 THR A O 1 ATOM 256 C CB . THR A 1 46 ? 0.384 103.544 58.387 1.00 72.10 ? 412 THR A CB 1 ATOM 257 O OG1 . THR A 1 46 ? 0.480 104.927 58.751 1.00 76.47 ? 412 THR A OG1 1 ATOM 258 C CG2 . THR A 1 46 ? -0.338 102.778 59.485 1.00 70.05 ? 412 THR A CG2 1 ATOM 259 N N . LYS A 1 47 ? 3.207 104.848 57.565 1.00 67.49 ? 413 LYS A N 1 ATOM 260 C CA . LYS A 1 47 ? 3.923 105.735 56.656 1.00 68.53 ? 413 LYS A CA 1 ATOM 261 C C . LYS A 1 47 ? 5.157 105.044 56.090 1.00 67.91 ? 413 LYS A C 1 ATOM 262 O O . LYS A 1 47 ? 5.528 105.267 54.937 1.00 72.60 ? 413 LYS A O 1 ATOM 263 C CB . LYS A 1 47 ? 4.320 107.030 57.365 1.00 72.22 ? 413 LYS A CB 1 ATOM 264 C CG . LYS A 1 47 ? 4.515 108.210 56.427 1.00 79.89 ? 413 LYS A CG 1 ATOM 265 C CD . LYS A 1 47 ? 4.451 109.526 57.184 1.00 87.07 ? 413 LYS A CD 1 ATOM 266 C CE . LYS A 1 47 ? 4.431 110.711 56.235 1.00 91.66 ? 413 LYS A CE 1 ATOM 267 N NZ . LYS A 1 47 ? 4.260 111.996 56.967 1.00 95.09 ? 413 LYS A NZ 1 ATOM 268 N N . LEU A 1 48 ? 5.789 104.205 56.905 1.00 61.52 ? 414 LEU A N 1 ATOM 269 C CA . LEU A 1 48 ? 6.959 103.453 56.469 1.00 58.64 ? 414 LEU A CA 1 ATOM 270 C C . LEU A 1 48 ? 6.587 102.425 55.407 1.00 52.57 ? 414 LEU A C 1 ATOM 271 O O . LEU A 1 48 ? 7.319 102.224 54.438 1.00 51.03 ? 414 LEU A O 1 ATOM 272 C CB . LEU A 1 48 ? 7.629 102.755 57.654 1.00 58.49 ? 414 LEU A CB 1 ATOM 273 C CG . LEU A 1 48 ? 8.827 101.880 57.275 1.00 55.91 ? 414 LEU A CG 1 ATOM 274 C CD1 . LEU A 1 48 ? 9.897 102.719 56.595 1.00 59.57 ? 414 LEU A CD1 1 ATOM 275 C CD2 . LEU A 1 48 ? 9.395 101.165 58.489 1.00 55.17 ? 414 LEU A CD2 1 ATOM 276 N N . LEU A 1 49 ? 5.441 101.781 55.595 1.00 51.00 ? 415 LEU A N 1 ATOM 277 C CA . LEU A 1 49 ? 4.990 100.745 54.677 1.00 50.59 ? 415 LEU A CA 1 ATOM 278 C C . LEU A 1 49 ? 4.385 101.336 53.404 1.00 54.68 ? 415 LEU A C 1 ATOM 279 O O . LEU A 1 49 ? 4.284 100.655 52.381 1.00 59.10 ? 415 LEU A O 1 ATOM 280 C CB . LEU A 1 49 ? 3.978 99.830 55.369 1.00 48.45 ? 415 LEU A CB 1 ATOM 281 C CG . LEU A 1 49 ? 4.489 99.086 56.604 1.00 48.20 ? 415 LEU A CG 1 ATOM 282 C CD1 . LEU A 1 49 ? 3.501 98.007 57.018 1.00 55.50 ? 415 LEU A CD1 1 ATOM 283 C CD2 . LEU A 1 49 ? 5.861 98.488 56.345 1.00 42.00 ? 415 LEU A CD2 1 ATOM 284 N N . SER A 1 50 ? 3.988 102.604 53.470 1.00 52.35 ? 416 SER A N 1 ATOM 285 C CA . SER A 1 50 ? 3.424 103.289 52.312 1.00 51.45 ? 416 SER A CA 1 ATOM 286 C C . SER A 1 50 ? 4.496 103.591 51.267 1.00 52.68 ? 416 SER A C 1 ATOM 287 O O . SER A 1 50 ? 4.188 103.839 50.102 1.00 55.30 ? 416 SER A O 1 ATOM 288 C CB . SER A 1 50 ? 2.730 104.582 52.742 1.00 56.85 ? 416 SER A CB 1 ATOM 289 O OG . SER A 1 50 ? 3.648 105.481 53.341 1.00 60.17 ? 416 SER A OG 1 ATOM 290 N N . LEU A 1 51 ? 5.756 103.570 51.691 1.00 53.26 ? 417 LEU A N 1 ATOM 291 C CA . LEU A 1 51 ? 6.876 103.799 50.784 1.00 54.93 ? 417 LEU A CA 1 ATOM 292 C C . LEU A 1 51 ? 7.220 102.539 49.998 1.00 56.31 ? 417 LEU A C 1 ATOM 293 O O . LEU A 1 51 ? 7.998 102.585 49.046 1.00 58.77 ? 417 LEU A O 1 ATOM 294 C CB . LEU A 1 51 ? 8.107 104.274 51.558 1.00 52.39 ? 417 LEU A CB 1 ATOM 295 C CG . LEU A 1 51 ? 7.976 105.595 52.311 1.00 54.20 ? 417 LEU A CG 1 ATOM 296 C CD1 . LEU A 1 51 ? 9.253 105.884 53.078 1.00 55.36 ? 417 LEU A CD1 1 ATOM 297 C CD2 . LEU A 1 51 ? 7.657 106.726 51.348 1.00 54.90 ? 417 LEU A CD2 1 ATOM 298 N N . PHE A 1 52 ? 6.636 101.416 50.405 1.00 53.15 ? 418 PHE A N 1 ATOM 299 C CA . PHE A 1 52 ? 6.918 100.126 49.786 1.00 47.24 ? 418 PHE A CA 1 ATOM 300 C C . PHE A 1 52 ? 5.655 99.467 49.246 1.00 50.36 ? 418 PHE A C 1 ATOM 301 O O . PHE A 1 52 ? 4.541 99.893 49.548 1.00 56.91 ? 418 PHE A O 1 ATOM 302 C CB . PHE A 1 52 ? 7.584 99.184 50.791 1.00 43.01 ? 418 PHE A CB 1 ATOM 303 C CG . PHE A 1 52 ? 8.907 99.671 51.304 1.00 45.06 ? 418 PHE A CG 1 ATOM 304 C CD1 . PHE A 1 52 ? 8.976 100.464 52.438 1.00 43.92 ? 418 PHE A CD1 1 ATOM 305 C CD2 . PHE A 1 52 ? 10.084 99.320 50.664 1.00 44.37 ? 418 PHE A CD2 1 ATOM 306 C CE1 . PHE A 1 52 ? 10.193 100.908 52.918 1.00 43.52 ? 418 PHE A CE1 1 ATOM 307 C CE2 . PHE A 1 52 ? 11.304 99.760 51.140 1.00 50.06 ? 418 PHE A CE2 1 ATOM 308 C CZ . PHE A 1 52 ? 11.357 100.556 52.271 1.00 49.70 ? 418 PHE A CZ 1 ATOM 309 N N . SER A 1 53 ? 5.837 98.418 48.450 1.00 48.68 ? 419 SER A N 1 ATOM 310 C CA . SER A 1 53 ? 4.722 97.578 48.035 1.00 48.23 ? 419 SER A CA 1 ATOM 311 C C . SER A 1 53 ? 4.694 96.322 48.894 1.00 50.69 ? 419 SER A C 1 ATOM 312 O O . SER A 1 53 ? 5.364 95.334 48.591 1.00 48.56 ? 419 SER A O 1 ATOM 313 C CB . SER A 1 53 ? 4.822 97.211 46.556 1.00 50.40 ? 419 SER A CB 1 ATOM 314 O OG . SER A 1 53 ? 4.760 98.367 45.741 1.00 64.23 ? 419 SER A OG 1 ATOM 315 N N . VAL A 1 54 ? 3.922 96.375 49.975 1.00 48.74 ? 420 VAL A N 1 ATOM 316 C CA . VAL A 1 54 ? 3.801 95.251 50.892 1.00 44.53 ? 420 VAL A CA 1 ATOM 317 C C . VAL A 1 54 ? 3.109 94.069 50.222 1.00 43.11 ? 420 VAL A C 1 ATOM 318 O O . VAL A 1 54 ? 1.925 94.133 49.894 1.00 39.69 ? 420 VAL A O 1 ATOM 319 C CB . VAL A 1 54 ? 3.023 95.645 52.159 1.00 39.33 ? 420 VAL A CB 1 ATOM 320 C CG1 . VAL A 1 54 ? 2.936 94.465 53.115 1.00 39.50 ? 420 VAL A CG1 1 ATOM 321 C CG2 . VAL A 1 54 ? 3.689 96.832 52.830 1.00 39.02 ? 420 VAL A CG2 1 ATOM 322 N N . ASN A 1 55 ? 3.860 92.994 50.019 1.00 43.84 ? 421 ASN A N 1 ATOM 323 C CA . ASN A 1 55 ? 3.333 91.805 49.364 1.00 42.05 ? 421 ASN A CA 1 ATOM 324 C C . ASN A 1 55 ? 2.725 90.835 50.362 1.00 40.59 ? 421 ASN A C 1 ATOM 325 O O . ASN A 1 55 ? 1.804 90.093 50.039 1.00 46.67 ? 421 ASN A O 1 ATOM 326 C CB . ASN A 1 55 ? 4.434 91.110 48.568 1.00 44.01 ? 421 ASN A CB 1 ATOM 327 C CG . ASN A 1 55 ? 5.050 92.011 47.523 1.00 46.34 ? 421 ASN A CG 1 ATOM 328 O OD1 . ASN A 1 55 ? 6.251 92.279 47.547 1.00 54.74 ? 421 ASN A OD1 1 ATOM 329 N ND2 . ASN A 1 55 ? 4.228 92.488 46.596 1.00 42.20 ? 421 ASN A ND2 1 ATOM 330 N N . ASP A 1 56 ? 3.251 90.847 51.580 1.00 41.15 ? 422 ASP A N 1 ATOM 331 C CA . ASP A 1 56 ? 2.791 89.936 52.614 1.00 42.68 ? 422 ASP A CA 1 ATOM 332 C C . ASP A 1 56 ? 3.037 90.522 53.999 1.00 45.23 ? 422 ASP A C 1 ATOM 333 O O . ASP A 1 56 ? 4.081 91.114 54.259 1.00 47.92 ? 422 ASP A O 1 ATOM 334 C CB . ASP A 1 56 ? 3.485 88.582 52.474 1.00 48.40 ? 422 ASP A CB 1 ATOM 335 C CG . ASP A 1 56 ? 2.959 87.557 53.454 1.00 62.17 ? 422 ASP A CG 1 ATOM 336 O OD1 . ASP A 1 56 ? 1.961 86.879 53.126 1.00 71.30 ? 422 ASP A OD1 1 ATOM 337 O OD2 . ASP A 1 56 ? 3.540 87.432 54.552 1.00 63.09 ? 422 ASP A OD2 1 ATOM 338 N N . PHE A 1 57 ? 2.063 90.352 54.883 1.00 48.24 ? 423 PHE A N 1 ATOM 339 C CA . PHE A 1 57 ? 2.125 90.931 56.218 1.00 44.43 ? 423 PHE A CA 1 ATOM 340 C C . PHE A 1 57 ? 1.463 89.976 57.211 1.00 43.53 ? 423 PHE A C 1 ATOM 341 O O . PHE A 1 57 ? 0.240 89.941 57.331 1.00 46.09 ? 423 PHE A O 1 ATOM 342 C CB . PHE A 1 57 ? 1.443 92.304 56.231 1.00 43.99 ? 423 PHE A CB 1 ATOM 343 C CG . PHE A 1 57 ? 1.748 93.141 57.449 1.00 45.29 ? 423 PHE A CG 1 ATOM 344 C CD1 . PHE A 1 57 ? 2.463 92.627 58.520 1.00 48.66 ? 423 PHE A CD1 1 ATOM 345 C CD2 . PHE A 1 57 ? 1.304 94.452 57.518 1.00 47.66 ? 423 PHE A CD2 1 ATOM 346 C CE1 . PHE A 1 57 ? 2.729 93.406 59.634 1.00 49.05 ? 423 PHE A CE1 1 ATOM 347 C CE2 . PHE A 1 57 ? 1.568 95.235 58.626 1.00 52.06 ? 423 PHE A CE2 1 ATOM 348 C CZ . PHE A 1 57 ? 2.282 94.710 59.687 1.00 52.24 ? 423 PHE A CZ 1 ATOM 349 N N . THR A 1 58 ? 2.281 89.198 57.911 1.00 41.45 ? 424 THR A N 1 ATOM 350 C CA . THR A 1 58 ? 1.781 88.242 58.889 1.00 42.83 ? 424 THR A CA 1 ATOM 351 C C . THR A 1 58 ? 2.475 88.435 60.234 1.00 48.23 ? 424 THR A C 1 ATOM 352 O O . THR A 1 58 ? 3.632 88.854 60.293 1.00 49.95 ? 424 THR A O 1 ATOM 353 C CB . THR A 1 58 ? 1.979 86.791 58.417 1.00 43.25 ? 424 THR A CB 1 ATOM 354 O OG1 . THR A 1 58 ? 3.375 86.531 58.239 1.00 45.50 ? 424 THR A OG1 1 ATOM 355 C CG2 . THR A 1 58 ? 1.253 86.552 57.100 1.00 48.55 ? 424 THR A CG2 1 ATOM 356 N N . CYS A 1 59 ? 1.760 88.130 61.313 1.00 52.72 ? 425 CYS A N 1 ATOM 357 C CA . CYS A 1 59 ? 2.276 88.348 62.659 1.00 47.57 ? 425 CYS A CA 1 ATOM 358 C C . CYS A 1 59 ? 1.985 87.167 63.575 1.00 45.99 ? 425 CYS A C 1 ATOM 359 O O . CYS A 1 59 ? 1.101 86.359 63.300 1.00 43.13 ? 425 CYS A O 1 ATOM 360 C CB . CYS A 1 59 ? 1.680 89.623 63.260 1.00 38.67 ? 425 CYS A CB 1 ATOM 361 S SG . CYS A 1 59 ? 1.768 91.076 62.196 1.00 66.74 ? 425 CYS A SG 1 ATOM 362 N N . SER A 1 60 ? 2.733 87.080 64.671 1.00 47.09 ? 426 SER A N 1 ATOM 363 C CA . SER A 1 60 ? 2.540 86.018 65.650 1.00 44.63 ? 426 SER A CA 1 ATOM 364 C C . SER A 1 60 ? 2.336 86.602 67.046 1.00 40.81 ? 426 SER A C 1 ATOM 365 O O . SER A 1 60 ? 3.094 87.474 67.479 1.00 39.72 ? 426 SER A O 1 ATOM 366 C CB . SER A 1 60 ? 3.731 85.057 65.639 1.00 44.93 ? 426 SER A CB 1 ATOM 367 O OG . SER A 1 60 ? 3.504 83.971 66.518 1.00 56.36 ? 426 SER A OG 1 ATOM 368 N N . GLN A 1 61 ? 1.305 86.111 67.732 1.00 39.41 ? 427 GLN A N 1 ATOM 369 C CA . GLN A 1 61 ? 0.875 86.622 69.037 1.00 42.09 ? 427 GLN A CA 1 ATOM 370 C C . GLN A 1 61 ? 0.526 88.108 68.993 1.00 46.82 ? 427 GLN A C 1 ATOM 371 O O . GLN A 1 61 ? 0.534 88.789 70.019 1.00 45.76 ? 427 GLN A O 1 ATOM 372 C CB . GLN A 1 61 ? 1.941 86.369 70.102 1.00 43.97 ? 427 GLN A CB 1 ATOM 373 C CG . GLN A 1 61 ? 2.258 84.907 70.306 1.00 47.02 ? 427 GLN A CG 1 ATOM 374 C CD . GLN A 1 61 ? 3.100 84.665 71.537 1.00 56.95 ? 427 GLN A CD 1 ATOM 375 O OE1 . GLN A 1 61 ? 2.580 84.570 72.648 1.00 57.92 ? 427 GLN A OE1 1 ATOM 376 N NE2 . GLN A 1 61 ? 4.413 84.568 71.347 1.00 61.46 ? 427 GLN A NE2 1 ATOM 377 N N . ILE A 1 62 ? 0.219 88.598 67.798 1.00 37.89 ? 428 ILE A N 1 ATOM 378 C CA . ILE A 1 62 ? -0.259 89.959 67.614 1.00 48.27 ? 428 ILE A CA 1 ATOM 379 C C . ILE A 1 62 ? -0.832 90.063 66.203 1.00 43.33 ? 428 ILE A C 1 ATOM 380 O O . ILE A 1 62 ? -0.634 89.168 65.386 1.00 43.11 ? 428 ILE A O 1 ATOM 381 C CB . ILE A 1 62 ? 0.864 91.003 67.838 1.00 48.54 ? 428 ILE A CB 1 ATOM 382 C CG1 . ILE A 1 62 ? 0.271 92.387 68.128 1.00 36.92 ? 428 ILE A CG1 1 ATOM 383 C CG2 . ILE A 1 62 ? 1.833 91.022 66.660 1.00 35.05 ? 428 ILE A CG2 1 ATOM 384 C CD1 . ILE A 1 62 ? 1.290 93.422 68.544 1.00 43.56 ? 428 ILE A CD1 1 ATOM 385 N N . SER A 1 63 ? -1.567 91.133 65.927 1.00 42.85 ? 429 SER A N 1 ATOM 386 C CA . SER A 1 63 ? -2.117 91.353 64.596 1.00 43.28 ? 429 SER A CA 1 ATOM 387 C C . SER A 1 63 ? -1.440 92.549 63.935 1.00 43.79 ? 429 SER A C 1 ATOM 388 O O . SER A 1 63 ? -0.918 93.426 64.625 1.00 46.71 ? 429 SER A O 1 ATOM 389 C CB . SER A 1 63 ? -3.630 91.567 64.665 1.00 45.91 ? 429 SER A CB 1 ATOM 390 O OG . SER A 1 63 ? -3.939 92.803 65.280 1.00 52.04 ? 429 SER A OG 1 ATOM 391 N N . PRO A 1 64 ? -1.431 92.577 62.592 1.00 42.54 ? 430 PRO A N 1 ATOM 392 C CA . PRO A 1 64 ? -0.887 93.701 61.822 1.00 42.60 ? 430 PRO A CA 1 ATOM 393 C C . PRO A 1 64 ? -1.477 95.042 62.252 1.00 42.39 ? 430 PRO A C 1 ATOM 394 O O . PRO A 1 64 ? -0.749 96.031 62.352 1.00 43.90 ? 430 PRO A O 1 ATOM 395 C CB . PRO A 1 64 ? -1.289 93.361 60.386 1.00 42.99 ? 430 PRO A CB 1 ATOM 396 C CG . PRO A 1 64 ? -1.325 91.873 60.366 1.00 41.70 ? 430 PRO A CG 1 ATOM 397 C CD . PRO A 1 64 ? -1.837 91.461 61.719 1.00 41.34 ? 430 PRO A CD 1 ATOM 398 N N . ALA A 1 65 ? -2.780 95.061 62.515 1.00 43.89 ? 431 ALA A N 1 ATOM 399 C CA . ALA A 1 65 ? -3.463 96.277 62.945 1.00 47.81 ? 431 ALA A CA 1 ATOM 400 C C . ALA A 1 65 ? -3.017 96.711 64.340 1.00 52.98 ? 431 ALA A C 1 ATOM 401 O O . ALA A 1 65 ? -2.844 97.904 64.602 1.00 57.36 ? 431 ALA A O 1 ATOM 402 C CB . ALA A 1 65 ? -4.973 96.077 62.915 1.00 44.08 ? 431 ALA A CB 1 ATOM 403 N N . ALA A 1 66 ? -2.825 95.740 65.228 1.00 49.99 ? 432 ALA A N 1 ATOM 404 C CA . ALA A 1 66 ? -2.487 96.034 66.616 1.00 48.52 ? 432 ALA A CA 1 ATOM 405 C C . ALA A 1 66 ? -1.035 96.478 66.782 1.00 50.84 ? 432 ALA A C 1 ATOM 406 O O . ALA A 1 66 ? -0.730 97.303 67.645 1.00 53.61 ? 432 ALA A O 1 ATOM 407 C CB . ALA A 1 66 ? -2.768 94.823 67.493 1.00 45.74 ? 432 ALA A CB 1 ATOM 408 N N . ILE A 1 67 ? -0.141 95.940 65.960 1.00 44.42 ? 433 ILE A N 1 ATOM 409 C CA . ILE A 1 67 ? 1.276 96.253 66.099 1.00 44.93 ? 433 ILE A CA 1 ATOM 410 C C . ILE A 1 67 ? 1.586 97.670 65.614 1.00 42.77 ? 433 ILE A C 1 ATOM 411 O O . ILE A 1 67 ? 2.668 98.202 65.863 1.00 41.11 ? 433 ILE A O 1 ATOM 412 C CB . ILE A 1 67 ? 2.166 95.248 65.339 1.00 46.31 ? 433 ILE A CB 1 ATOM 413 C CG1 . ILE A 1 67 ? 3.570 95.223 65.950 1.00 45.69 ? 433 ILE A CG1 1 ATOM 414 C CG2 . ILE A 1 67 ? 2.212 95.578 63.855 1.00 47.35 ? 433 ILE A CG2 1 ATOM 415 C CD1 . ILE A 1 67 ? 4.541 94.343 65.222 1.00 44.20 ? 433 ILE A CD1 1 ATOM 416 N N . ALA A 1 68 ? 0.626 98.286 64.935 1.00 45.55 ? 434 ALA A N 1 ATOM 417 C CA . ALA A 1 68 ? 0.798 99.649 64.453 1.00 45.20 ? 434 ALA A CA 1 ATOM 418 C C . ALA A 1 68 ? 0.087 100.648 65.355 1.00 48.82 ? 434 ALA A C 1 ATOM 419 O O . ALA A 1 68 ? 0.000 101.831 65.029 1.00 56.33 ? 434 ALA A O 1 ATOM 420 C CB . ALA A 1 68 ? 0.290 99.775 63.028 1.00 42.18 ? 434 ALA A CB 1 ATOM 421 N N . SER A 1 69 ? -0.413 100.176 66.494 1.00 47.25 ? 435 SER A N 1 ATOM 422 C CA . SER A 1 69 ? -1.227 101.021 67.359 1.00 49.60 ? 435 SER A CA 1 ATOM 423 C C . SER A 1 69 ? -1.052 100.741 68.852 1.00 45.81 ? 435 SER A C 1 ATOM 424 O O . SER A 1 69 ? -1.908 101.107 69.656 1.00 45.70 ? 435 SER A O 1 ATOM 425 C CB . SER A 1 69 ? -2.702 100.868 66.986 1.00 56.07 ? 435 SER A CB 1 ATOM 426 O OG . SER A 1 69 ? -3.118 99.520 67.111 1.00 56.80 ? 435 SER A OG 1 ATOM 427 N N . ASN A 1 70 ? 0.053 100.102 69.222 1.00 42.81 ? 436 ASN A N 1 ATOM 428 C CA . ASN A 1 70 ? 0.309 99.784 70.624 1.00 47.98 ? 436 ASN A CA 1 ATOM 429 C C . ASN A 1 70 ? 1.607 100.395 71.146 1.00 51.77 ? 436 ASN A C 1 ATOM 430 O O . ASN A 1 70 ? 2.508 100.718 70.371 1.00 50.90 ? 436 ASN A O 1 ATOM 431 C CB . ASN A 1 70 ? 0.341 98.268 70.829 1.00 49.30 ? 436 ASN A CB 1 ATOM 432 C CG . ASN A 1 70 ? -1.044 97.651 70.877 1.00 49.01 ? 436 ASN A CG 1 ATOM 433 O OD1 . ASN A 1 70 ? -2.029 98.270 70.478 1.00 53.03 ? 436 ASN A OD1 1 ATOM 434 N ND2 . ASN A 1 70 ? -1.124 96.421 71.368 1.00 51.63 ? 436 ASN A ND2 1 ATOM 435 N N . CYS A 1 71 ? 1.696 100.545 72.465 1.00 51.16 ? 437 CYS A N 1 ATOM 436 C CA . CYS A 1 71 ? 2.900 101.062 73.109 1.00 53.81 ? 437 CYS A CA 1 ATOM 437 C C . CYS A 1 71 ? 3.755 99.930 73.666 1.00 51.18 ? 437 CYS A C 1 ATOM 438 O O . CYS A 1 71 ? 3.243 99.014 74.306 1.00 52.11 ? 437 CYS A O 1 ATOM 439 C CB . CYS A 1 71 ? 2.536 102.040 74.231 1.00 47.83 ? 437 CYS A CB 1 ATOM 440 S SG . CYS A 1 71 ? 1.780 103.586 73.676 1.00 63.09 ? 437 CYS A SG 1 ATOM 441 N N . TYR A 1 72 ? 5.061 100.000 73.428 1.00 48.78 ? 438 TYR A N 1 ATOM 442 C CA . TYR A 1 72 ? 5.972 98.962 73.898 1.00 49.02 ? 438 TYR A CA 1 ATOM 443 C C . TYR A 1 72 ? 7.130 99.559 74.681 1.00 53.86 ? 438 TYR A C 1 ATOM 444 O O . TYR A 1 72 ? 7.352 100.768 74.647 1.00 59.16 ? 438 TYR A O 1 ATOM 445 C CB . TYR A 1 72 ? 6.506 98.148 72.722 1.00 46.82 ? 438 TYR A CB 1 ATOM 446 C CG . TYR A 1 72 ? 5.517 98.008 71.593 1.00 47.00 ? 438 TYR A CG 1 ATOM 447 C CD1 . TYR A 1 72 ? 4.475 97.093 71.666 1.00 41.66 ? 438 TYR A CD1 1 ATOM 448 C CD2 . TYR A 1 72 ? 5.620 98.796 70.454 1.00 49.32 ? 438 TYR A CD2 1 ATOM 449 C CE1 . TYR A 1 72 ? 3.567 96.964 70.637 1.00 39.96 ? 438 TYR A CE1 1 ATOM 450 C CE2 . TYR A 1 72 ? 4.716 98.675 69.419 1.00 45.43 ? 438 TYR A CE2 1 ATOM 451 C CZ . TYR A 1 72 ? 3.693 97.759 69.517 1.00 44.25 ? 438 TYR A CZ 1 ATOM 452 O OH . TYR A 1 72 ? 2.789 97.636 68.489 1.00 46.13 ? 438 TYR A OH 1 ATOM 453 N N . SER A 1 73 ? 7.865 98.706 75.387 1.00 56.57 ? 439 SER A N 1 ATOM 454 C CA . SER A 1 73 ? 9.064 99.140 76.090 1.00 62.29 ? 439 SER A CA 1 ATOM 455 C C . SER A 1 73 ? 10.264 99.140 75.146 1.00 62.75 ? 439 SER A C 1 ATOM 456 O O . SER A 1 73 ? 11.258 99.827 75.385 1.00 68.63 ? 439 SER A O 1 ATOM 457 C CB . SER A 1 73 ? 9.334 98.248 77.302 1.00 70.77 ? 439 SER A CB 1 ATOM 458 O OG . SER A 1 73 ? 9.445 96.888 76.924 1.00 75.33 ? 439 SER A OG 1 ATOM 459 N N . SER A 1 74 ? 10.161 98.369 74.069 1.00 59.98 ? 440 SER A N 1 ATOM 460 C CA . SER A 1 74 ? 11.201 98.335 73.048 1.00 63.24 ? 440 SER A CA 1 ATOM 461 C C . SER A 1 74 ? 10.655 97.797 71.730 1.00 60.38 ? 440 SER A C 1 ATOM 462 O O . SER A 1 74 ? 9.797 96.914 71.717 1.00 55.85 ? 440 SER A O 1 ATOM 463 C CB . SER A 1 74 ? 12.386 97.483 73.508 1.00 65.68 ? 440 SER A CB 1 ATOM 464 O OG . SER A 1 74 ? 12.005 96.130 73.680 1.00 65.62 ? 440 SER A OG 1 ATOM 465 N N . LEU A 1 75 ? 11.150 98.342 70.624 1.00 60.67 ? 441 LEU A N 1 ATOM 466 C CA . LEU A 1 75 ? 10.752 97.874 69.303 1.00 55.60 ? 441 LEU A CA 1 ATOM 467 C C . LEU A 1 75 ? 11.984 97.532 68.477 1.00 54.72 ? 441 LEU A C 1 ATOM 468 O O . LEU A 1 75 ? 12.846 98.379 68.239 1.00 49.30 ? 441 LEU A O 1 ATOM 469 C CB . LEU A 1 75 ? 9.898 98.924 68.586 1.00 50.86 ? 441 LEU A CB 1 ATOM 470 C CG . LEU A 1 75 ? 9.091 98.463 67.366 1.00 48.16 ? 441 LEU A CG 1 ATOM 471 C CD1 . LEU A 1 75 ? 7.831 99.302 67.224 1.00 52.90 ? 441 LEU A CD1 1 ATOM 472 C CD2 . LEU A 1 75 ? 9.910 98.527 66.081 1.00 42.09 ? 441 LEU A CD2 1 ATOM 473 N N . ILE A 1 76 ? 12.054 96.279 68.043 1.00 56.20 ? 442 ILE A N 1 ATOM 474 C CA . ILE A 1 76 ? 13.173 95.801 67.247 1.00 56.85 ? 442 ILE A CA 1 ATOM 475 C C . ILE A 1 76 ? 12.749 95.589 65.797 1.00 53.41 ? 442 ILE A C 1 ATOM 476 O O . ILE A 1 76 ? 11.763 94.904 65.520 1.00 47.55 ? 442 ILE A O 1 ATOM 477 C CB . ILE A 1 76 ? 13.745 94.490 67.818 1.00 57.67 ? 442 ILE A CB 1 ATOM 478 C CG1 . ILE A 1 76 ? 14.376 94.745 69.188 1.00 56.02 ? 442 ILE A CG1 1 ATOM 479 C CG2 . ILE A 1 76 ? 14.757 93.886 66.860 1.00 56.83 ? 442 ILE A CG2 1 ATOM 480 C CD1 . ILE A 1 76 ? 15.023 93.521 69.802 1.00 56.76 ? 442 ILE A CD1 1 ATOM 481 N N . LEU A 1 77 ? 13.496 96.187 64.877 1.00 52.02 ? 443 LEU A N 1 ATOM 482 C CA . LEU A 1 77 ? 13.205 96.064 63.456 1.00 42.27 ? 443 LEU A CA 1 ATOM 483 C C . LEU A 1 77 ? 14.400 95.496 62.700 1.00 41.06 ? 443 LEU A C 1 ATOM 484 O O . LEU A 1 77 ? 15.465 96.109 62.646 1.00 42.96 ? 443 LEU A O 1 ATOM 485 C CB . LEU A 1 77 ? 12.806 97.420 62.873 1.00 40.28 ? 443 LEU A CB 1 ATOM 486 C CG . LEU A 1 77 ? 12.563 97.482 61.365 1.00 44.62 ? 443 LEU A CG 1 ATOM 487 C CD1 . LEU A 1 77 ? 11.466 96.515 60.956 1.00 45.78 ? 443 LEU A CD1 1 ATOM 488 C CD2 . LEU A 1 77 ? 12.212 98.898 60.945 1.00 49.45 ? 443 LEU A CD2 1 ATOM 489 N N . ASP A 1 78 ? 14.214 94.316 62.121 1.00 44.30 ? 444 ASP A N 1 ATOM 490 C CA . ASP A 1 78 ? 15.246 93.681 61.311 1.00 46.65 ? 444 ASP A CA 1 ATOM 491 C C . ASP A 1 78 ? 14.870 93.745 59.836 1.00 47.09 ? 444 ASP A C 1 ATOM 492 O O . ASP A 1 78 ? 13.753 93.387 59.466 1.00 44.01 ? 444 ASP A O 1 ATOM 493 C CB . ASP A 1 78 ? 15.452 92.227 61.742 1.00 45.02 ? 444 ASP A CB 1 ATOM 494 C CG . ASP A 1 78 ? 15.765 92.095 63.219 1.00 46.22 ? 444 ASP A CG 1 ATOM 495 O OD1 . ASP A 1 78 ? 16.368 93.033 63.783 1.00 48.94 ? 444 ASP A OD1 1 ATOM 496 O OD2 . ASP A 1 78 ? 15.408 91.056 63.816 1.00 46.11 ? 444 ASP A OD2 1 ATOM 497 N N . TYR A 1 79 ? 15.793 94.205 58.997 1.00 44.62 ? 445 TYR A N 1 ATOM 498 C CA . TYR A 1 79 ? 15.530 94.260 57.564 1.00 42.98 ? 445 TYR A CA 1 ATOM 499 C C . TYR A 1 79 ? 16.687 93.711 56.743 1.00 46.35 ? 445 TYR A C 1 ATOM 500 O O . TYR A 1 79 ? 17.846 93.767 57.157 1.00 49.01 ? 445 TYR A O 1 ATOM 501 C CB . TYR A 1 79 ? 15.212 95.691 57.123 1.00 39.76 ? 445 TYR A CB 1 ATOM 502 C CG . TYR A 1 79 ? 16.354 96.672 57.248 1.00 37.74 ? 445 TYR A CG 1 ATOM 503 C CD1 . TYR A 1 79 ? 16.556 97.381 58.422 1.00 34.56 ? 445 TYR A CD1 1 ATOM 504 C CD2 . TYR A 1 79 ? 17.217 96.908 56.184 1.00 38.19 ? 445 TYR A CD2 1 ATOM 505 C CE1 . TYR A 1 79 ? 17.593 98.289 58.539 1.00 39.67 ? 445 TYR A CE1 1 ATOM 506 C CE2 . TYR A 1 79 ? 18.254 97.813 56.292 1.00 38.60 ? 445 TYR A CE2 1 ATOM 507 C CZ . TYR A 1 79 ? 18.438 98.502 57.471 1.00 40.99 ? 445 TYR A CZ 1 ATOM 508 O OH . TYR A 1 79 ? 19.470 99.406 57.584 1.00 44.42 ? 445 TYR A OH 1 ATOM 509 N N . PHE A 1 80 ? 16.352 93.194 55.565 1.00 45.62 ? 446 PHE A N 1 ATOM 510 C CA . PHE A 1 80 ? 17.310 92.522 54.704 1.00 41.14 ? 446 PHE A CA 1 ATOM 511 C C . PHE A 1 80 ? 16.720 92.283 53.320 1.00 43.03 ? 446 PHE A C 1 ATOM 512 O O . PHE A 1 80 ? 15.503 92.198 53.162 1.00 43.95 ? 446 PHE A O 1 ATOM 513 C CB . PHE A 1 80 ? 17.744 91.191 55.326 1.00 41.27 ? 446 PHE A CB 1 ATOM 514 C CG . PHE A 1 80 ? 16.598 90.358 55.844 1.00 40.71 ? 446 PHE A CG 1 ATOM 515 C CD1 . PHE A 1 80 ? 16.237 90.405 57.181 1.00 42.02 ? 446 PHE A CD1 1 ATOM 516 C CD2 . PHE A 1 80 ? 15.885 89.530 54.994 1.00 40.61 ? 446 PHE A CD2 1 ATOM 517 C CE1 . PHE A 1 80 ? 15.187 89.642 57.662 1.00 44.49 ? 446 PHE A CE1 1 ATOM 518 C CE2 . PHE A 1 80 ? 14.833 88.766 55.467 1.00 42.84 ? 446 PHE A CE2 1 ATOM 519 C CZ . PHE A 1 80 ? 14.484 88.821 56.803 1.00 45.84 ? 446 PHE A CZ 1 ATOM 520 N N . SER A 1 81 ? 17.588 92.177 52.320 1.00 46.50 ? 447 SER A N 1 ATOM 521 C CA . SER A 1 81 ? 17.167 91.784 50.982 1.00 40.60 ? 447 SER A CA 1 ATOM 522 C C . SER A 1 81 ? 16.658 90.347 51.014 1.00 43.58 ? 447 SER A C 1 ATOM 523 O O . SER A 1 81 ? 17.338 89.455 51.526 1.00 47.34 ? 447 SER A O 1 ATOM 524 C CB . SER A 1 81 ? 18.321 91.921 49.984 1.00 40.89 ? 447 SER A CB 1 ATOM 525 O OG . SER A 1 81 ? 18.863 93.230 50.003 1.00 41.10 ? 447 SER A OG 1 ATOM 526 N N . TYR A 1 82 ? 15.462 90.125 50.478 1.00 43.77 ? 448 TYR A N 1 ATOM 527 C CA . TYR A 1 82 ? 14.868 88.791 50.480 1.00 42.50 ? 448 TYR A CA 1 ATOM 528 C C . TYR A 1 82 ? 13.924 88.592 49.299 1.00 40.70 ? 448 TYR A C 1 ATOM 529 O O . TYR A 1 82 ? 13.010 89.388 49.090 1.00 41.89 ? 448 TYR A O 1 ATOM 530 C CB . TYR A 1 82 ? 14.115 88.534 51.789 1.00 43.41 ? 448 TYR A CB 1 ATOM 531 C CG . TYR A 1 82 ? 13.821 87.071 52.040 1.00 39.76 ? 448 TYR A CG 1 ATOM 532 C CD1 . TYR A 1 82 ? 14.797 86.231 52.559 1.00 36.80 ? 448 TYR A CD1 1 ATOM 533 C CD2 . TYR A 1 82 ? 12.576 86.530 51.757 1.00 36.64 ? 448 TYR A CD2 1 ATOM 534 C CE1 . TYR A 1 82 ? 14.543 84.895 52.790 1.00 33.55 ? 448 TYR A CE1 1 ATOM 535 C CE2 . TYR A 1 82 ? 12.311 85.187 51.988 1.00 39.03 ? 448 TYR A CE2 1 ATOM 536 C CZ . TYR A 1 82 ? 13.303 84.376 52.505 1.00 38.48 ? 448 TYR A CZ 1 ATOM 537 O OH . TYR A 1 82 ? 13.064 83.042 52.740 1.00 39.16 ? 448 TYR A OH 1 ATOM 538 N N . PRO A 1 83 ? 14.141 87.516 48.528 1.00 36.14 ? 449 PRO A N 1 ATOM 539 C CA . PRO A 1 83 ? 13.296 87.189 47.375 1.00 40.39 ? 449 PRO A CA 1 ATOM 540 C C . PRO A 1 83 ? 11.892 86.751 47.791 1.00 42.01 ? 449 PRO A C 1 ATOM 541 O O . PRO A 1 83 ? 11.740 85.875 48.643 1.00 42.15 ? 449 PRO A O 1 ATOM 542 C CB . PRO A 1 83 ? 14.052 86.041 46.701 1.00 37.10 ? 449 PRO A CB 1 ATOM 543 C CG . PRO A 1 83 ? 14.845 85.421 47.796 1.00 33.70 ? 449 PRO A CG 1 ATOM 544 C CD . PRO A 1 83 ? 15.229 86.541 48.713 1.00 30.93 ? 449 PRO A CD 1 ATOM 545 N N . LEU A 1 84 ? 10.882 87.361 47.181 1.00 39.70 ? 450 LEU A N 1 ATOM 546 C CA . LEU A 1 84 ? 9.487 87.103 47.524 1.00 39.62 ? 450 LEU A CA 1 ATOM 547 C C . LEU A 1 84 ? 9.105 85.627 47.374 1.00 38.92 ? 450 LEU A C 1 ATOM 548 O O . LEU A 1 84 ? 8.258 85.120 48.107 1.00 33.40 ? 450 LEU A O 1 ATOM 549 C CB . LEU A 1 84 ? 8.570 87.970 46.658 1.00 40.07 ? 450 LEU A CB 1 ATOM 550 C CG . LEU A 1 84 ? 7.076 87.936 46.981 1.00 42.02 ? 450 LEU A CG 1 ATOM 551 C CD1 . LEU A 1 84 ? 6.849 88.300 48.437 1.00 32.97 ? 450 LEU A CD1 1 ATOM 552 C CD2 . LEU A 1 84 ? 6.303 88.871 46.062 1.00 35.61 ? 450 LEU A CD2 1 ATOM 553 N N . SER A 1 85 ? 9.752 84.945 46.435 1.00 37.37 ? 451 SER A N 1 ATOM 554 C CA . SER A 1 85 ? 9.453 83.546 46.126 1.00 44.11 ? 451 SER A CA 1 ATOM 555 C C . SER A 1 85 ? 9.680 82.585 47.292 1.00 43.34 ? 451 SER A C 1 ATOM 556 O O . SER A 1 85 ? 9.016 81.558 47.392 1.00 43.49 ? 451 SER A O 1 ATOM 557 C CB . SER A 1 85 ? 10.293 83.087 44.937 1.00 46.58 ? 451 SER A CB 1 ATOM 558 O OG . SER A 1 85 ? 11.668 83.090 45.273 1.00 52.21 ? 451 SER A OG 1 ATOM 559 N N . MET A 1 86 ? 10.622 82.913 48.170 1.00 43.77 ? 452 MET A N 1 ATOM 560 C CA . MET A 1 86 ? 10.978 82.016 49.268 1.00 37.73 ? 452 MET A CA 1 ATOM 561 C C . MET A 1 86 ? 10.241 82.389 50.545 1.00 35.24 ? 452 MET A C 1 ATOM 562 O O . MET A 1 86 ? 10.740 82.179 51.652 1.00 36.59 ? 452 MET A O 1 ATOM 563 C CB . MET A 1 86 ? 12.489 82.031 49.503 1.00 38.06 ? 452 MET A CB 1 ATOM 564 C CG . MET A 1 86 ? 13.300 81.659 48.271 1.00 33.33 ? 452 MET A CG 1 ATOM 565 S SD . MET A 1 86 ? 15.066 81.549 48.602 1.00 52.17 ? 452 MET A SD 1 ATOM 566 C CE . MET A 1 86 ? 15.130 80.061 49.602 1.00 73.60 ? 452 MET A CE 1 ATOM 567 N N . LYS A 1 87 ? 9.049 82.944 50.367 1.00 38.22 ? 453 LYS A N 1 ATOM 568 C CA . LYS A 1 87 ? 8.166 83.333 51.461 1.00 39.58 ? 453 LYS A CA 1 ATOM 569 C C . LYS A 1 87 ? 7.995 82.250 52.526 1.00 40.72 ? 453 LYS A C 1 ATOM 570 O O . LYS A 1 87 ? 8.189 82.507 53.712 1.00 42.97 ? 453 LYS A O 1 ATOM 571 C CB . LYS A 1 87 ? 6.798 83.715 50.894 1.00 37.60 ? 453 LYS A CB 1 ATOM 572 C CG . LYS A 1 87 ? 5.720 83.914 51.933 1.00 35.66 ? 453 LYS A CG 1 ATOM 573 C CD . LYS A 1 87 ? 4.386 84.165 51.261 1.00 40.95 ? 453 LYS A CD 1 ATOM 574 C CE . LYS A 1 87 ? 3.247 84.099 52.254 1.00 44.01 ? 453 LYS A CE 1 ATOM 575 N NZ . LYS A 1 87 ? 1.949 84.359 51.581 1.00 49.35 ? 453 LYS A NZ 1 ATOM 576 N N . SER A 1 88 ? 7.638 81.042 52.103 1.00 41.18 ? 454 SER A N 1 ATOM 577 C CA . SER A 1 88 ? 7.368 79.962 53.047 1.00 45.49 ? 454 SER A CA 1 ATOM 578 C C . SER A 1 88 ? 8.630 79.509 53.779 1.00 53.13 ? 454 SER A C 1 ATOM 579 O O . SER A 1 88 ? 8.556 78.936 54.863 1.00 59.34 ? 454 SER A O 1 ATOM 580 C CB . SER A 1 88 ? 6.724 78.772 52.334 1.00 48.47 ? 454 SER A CB 1 ATOM 581 O OG . SER A 1 88 ? 7.607 78.198 51.386 1.00 61.69 ? 454 SER A OG 1 ATOM 582 N N . ASP A 1 89 ? 9.790 79.767 53.188 1.00 54.17 ? 455 ASP A N 1 ATOM 583 C CA . ASP A 1 89 ? 11.050 79.413 53.831 1.00 56.58 ? 455 ASP A CA 1 ATOM 584 C C . ASP A 1 89 ? 11.324 80.315 55.028 1.00 57.28 ? 455 ASP A C 1 ATOM 585 O O . ASP A 1 89 ? 12.111 79.979 55.915 1.00 58.39 ? 455 ASP A O 1 ATOM 586 C CB . ASP A 1 89 ? 12.210 79.499 52.838 1.00 53.92 ? 455 ASP A CB 1 ATOM 587 C CG . ASP A 1 89 ? 12.946 78.186 52.695 1.00 58.11 ? 455 ASP A CG 1 ATOM 588 O OD1 . ASP A 1 89 ? 13.669 77.809 53.642 1.00 59.05 ? 455 ASP A OD1 1 ATOM 589 O OD2 . ASP A 1 89 ? 12.801 77.540 51.636 1.00 64.74 ? 455 ASP A OD2 1 ATOM 590 N N . LEU A 1 90 ? 10.673 81.470 55.042 1.00 55.72 ? 456 LEU A N 1 ATOM 591 C CA . LEU A 1 90 ? 10.878 82.441 56.104 1.00 54.17 ? 456 LEU A CA 1 ATOM 592 C C . LEU A 1 90 ? 9.863 82.206 57.216 1.00 65.67 ? 456 LEU A C 1 ATOM 593 O O . LEU A 1 90 ? 9.300 83.142 57.786 1.00 66.47 ? 456 LEU A O 1 ATOM 594 C CB . LEU A 1 90 ? 10.775 83.861 55.552 1.00 47.96 ? 456 LEU A CB 1 ATOM 595 C CG . LEU A 1 90 ? 11.385 85.008 56.355 1.00 45.47 ? 456 LEU A CG 1 ATOM 596 C CD1 . LEU A 1 90 ? 12.766 84.655 56.879 1.00 43.23 ? 456 LEU A CD1 1 ATOM 597 C CD2 . LEU A 1 90 ? 11.444 86.246 55.483 1.00 45.57 ? 456 LEU A CD2 1 ATOM 598 N N . SER A 1 91 ? 9.623 80.935 57.508 1.00 76.34 ? 457 SER A N 1 ATOM 599 C CA . SER A 1 91 ? 8.760 80.554 58.612 1.00 85.87 ? 457 SER A CA 1 ATOM 600 C C . SER A 1 91 ? 9.447 79.475 59.428 1.00 96.14 ? 457 SER A C 1 ATOM 601 O O . SER A 1 91 ? 10.098 78.585 58.876 1.00 91.80 ? 457 SER A O 1 ATOM 602 C CB . SER A 1 91 ? 7.402 80.066 58.106 1.00 86.28 ? 457 SER A CB 1 ATOM 603 O OG . SER A 1 91 ? 6.690 81.120 57.482 1.00 85.40 ? 457 SER A OG 1 ATOM 604 N N . VAL A 1 92 ? 9.313 79.564 60.746 1.00 109.34 ? 458 VAL A N 1 ATOM 605 C CA . VAL A 1 92 ? 9.950 78.599 61.629 1.00 113.94 ? 458 VAL A CA 1 ATOM 606 C C . VAL A 1 92 ? 9.207 77.270 61.573 1.00 114.68 ? 458 VAL A C 1 ATOM 607 O O . VAL A 1 92 ? 9.752 76.227 61.941 1.00 115.51 ? 458 VAL A O 1 ATOM 608 C CB . VAL A 1 92 ? 10.001 79.097 63.081 1.00 118.20 ? 458 VAL A CB 1 ATOM 609 C CG1 . VAL A 1 92 ? 11.228 78.533 63.786 1.00 119.97 ? 458 VAL A CG1 1 ATOM 610 C CG2 . VAL A 1 92 ? 10.022 80.615 63.116 1.00 119.73 ? 458 VAL A CG2 1 ATOM 611 N N . SER A 1 93 ? 7.962 77.310 61.106 1.00 113.01 ? 459 SER A N 1 ATOM 612 C CA . SER A 1 93 ? 7.191 76.088 60.917 1.00 107.38 ? 459 SER A CA 1 ATOM 613 C C . SER A 1 93 ? 7.889 75.213 59.883 1.00 105.29 ? 459 SER A C 1 ATOM 614 O O . SER A 1 93 ? 7.861 73.984 59.960 1.00 107.69 ? 459 SER A O 1 ATOM 615 C CB . SER A 1 93 ? 5.759 76.400 60.478 1.00 100.67 ? 459 SER A CB 1 ATOM 616 O OG . SER A 1 93 ? 5.650 76.388 59.067 1.00 97.82 ? 459 SER A OG 1 ATOM 617 N N . SER A 1 94 ? 8.521 75.868 58.916 1.00 101.73 ? 460 SER A N 1 ATOM 618 C CA . SER A 1 94 ? 9.297 75.178 57.896 1.00 99.02 ? 460 SER A CA 1 ATOM 619 C C . SER A 1 94 ? 10.683 74.830 58.422 1.00 93.75 ? 460 SER A C 1 ATOM 620 O O . SER A 1 94 ? 11.253 75.566 59.231 1.00 90.55 ? 460 SER A O 1 ATOM 621 C CB . SER A 1 94 ? 9.412 76.036 56.636 1.00 100.82 ? 460 SER A CB 1 ATOM 622 O OG . SER A 1 94 ? 10.273 75.428 55.690 1.00 103.78 ? 460 SER A OG 1 ATOM 623 N N . ALA A 1 95 ? 11.218 73.704 57.963 1.00 85.72 ? 461 ALA A N 1 ATOM 624 C CA . ALA A 1 95 ? 12.548 73.275 58.365 1.00 78.83 ? 461 ALA A CA 1 ATOM 625 C C . ALA A 1 95 ? 13.564 73.656 57.301 1.00 78.71 ? 461 ALA A C 1 ATOM 626 O O . ALA A 1 95 ? 14.401 72.845 56.906 1.00 82.14 ? 461 ALA A O 1 ATOM 627 C CB . ALA A 1 95 ? 12.574 71.775 58.614 1.00 76.27 ? 461 ALA A CB 1 ATOM 628 N N . GLY A 1 96 ? 13.482 74.895 56.832 1.00 74.33 ? 462 GLY A N 1 ATOM 629 C CA . GLY A 1 96 ? 14.373 75.375 55.793 1.00 65.65 ? 462 GLY A CA 1 ATOM 630 C C . GLY A 1 96 ? 15.674 75.929 56.336 1.00 57.61 ? 462 GLY A C 1 ATOM 631 O O . GLY A 1 96 ? 15.792 76.202 57.530 1.00 51.84 ? 462 GLY A O 1 ATOM 632 N N . PRO A 1 97 ? 16.664 76.109 55.452 1.00 54.77 ? 463 PRO A N 1 ATOM 633 C CA . PRO A 1 97 ? 17.976 76.628 55.851 1.00 49.67 ? 463 PRO A CA 1 ATOM 634 C C . PRO A 1 97 ? 17.898 78.076 56.332 1.00 41.77 ? 463 PRO A C 1 ATOM 635 O O . PRO A 1 97 ? 18.758 78.518 57.094 1.00 40.03 ? 463 PRO A O 1 ATOM 636 C CB . PRO A 1 97 ? 18.805 76.512 54.567 1.00 48.64 ? 463 PRO A CB 1 ATOM 637 C CG . PRO A 1 97 ? 17.802 76.549 53.468 1.00 50.08 ? 463 PRO A CG 1 ATOM 638 C CD . PRO A 1 97 ? 16.582 75.859 54.002 1.00 51.11 ? 463 PRO A CD 1 ATOM 639 N N . ILE A 1 98 ? 16.870 78.796 55.894 1.00 42.23 ? 464 ILE A N 1 ATOM 640 C CA . ILE A 1 98 ? 16.672 80.182 56.307 1.00 42.54 ? 464 ILE A CA 1 ATOM 641 C C . ILE A 1 98 ? 16.411 80.298 57.809 1.00 44.07 ? 464 ILE A C 1 ATOM 642 O O . ILE A 1 98 ? 17.029 81.115 58.492 1.00 53.77 ? 464 ILE A O 1 ATOM 643 C CB . ILE A 1 98 ? 15.502 80.837 55.549 1.00 42.77 ? 464 ILE A CB 1 ATOM 644 C CG1 . ILE A 1 98 ? 15.720 80.740 54.039 1.00 42.88 ? 464 ILE A CG1 1 ATOM 645 C CG2 . ILE A 1 98 ? 15.341 82.285 55.976 1.00 42.52 ? 464 ILE A CG2 1 ATOM 646 C CD1 . ILE A 1 98 ? 16.961 81.454 53.560 1.00 42.56 ? 464 ILE A CD1 1 ATOM 647 N N . SER A 1 99 ? 15.498 79.482 58.323 1.00 43.07 ? 465 SER A N 1 ATOM 648 C CA . SER A 1 99 ? 15.162 79.541 59.741 1.00 50.96 ? 465 SER A CA 1 ATOM 649 C C . SER A 1 99 ? 16.138 78.715 60.574 1.00 49.69 ? 465 SER A C 1 ATOM 650 O O . SER A 1 99 ? 16.218 78.875 61.791 1.00 54.43 ? 465 SER A O 1 ATOM 651 C CB . SER A 1 99 ? 13.720 79.072 59.981 1.00 55.39 ? 465 SER A CB 1 ATOM 652 O OG . SER A 1 99 ? 13.503 77.759 59.492 1.00 58.65 ? 465 SER A OG 1 ATOM 653 N N . GLN A 1 100 ? 16.890 77.843 59.911 1.00 47.75 ? 466 GLN A N 1 ATOM 654 C CA . GLN A 1 100 ? 17.862 76.999 60.600 1.00 50.26 ? 466 GLN A CA 1 ATOM 655 C C . GLN A 1 100 ? 19.231 77.661 60.752 1.00 51.43 ? 466 GLN A C 1 ATOM 656 O O . GLN A 1 100 ? 19.863 77.550 61.802 1.00 52.58 ? 466 GLN A O 1 ATOM 657 C CB . GLN A 1 100 ? 18.026 75.667 59.870 1.00 48.90 ? 466 GLN A CB 1 ATOM 658 C CG . GLN A 1 100 ? 16.883 74.692 60.077 1.00 50.60 ? 466 GLN A CG 1 ATOM 659 C CD . GLN A 1 100 ? 17.089 73.398 59.314 1.00 61.44 ? 466 GLN A CD 1 ATOM 660 O OE1 . GLN A 1 100 ? 17.899 73.332 58.388 1.00 65.09 ? 466 GLN A OE1 1 ATOM 661 N NE2 . GLN A 1 100 ? 16.359 72.361 59.703 1.00 69.83 ? 466 GLN A NE2 1 ATOM 662 N N . PHE A 1 101 ? 19.690 78.346 59.709 1.00 50.19 ? 467 PHE A N 1 ATOM 663 C CA . PHE A 1 101 ? 21.059 78.858 59.696 1.00 46.26 ? 467 PHE A CA 1 ATOM 664 C C . PHE A 1 101 ? 21.160 80.375 59.539 1.00 43.97 ? 467 PHE A C 1 ATOM 665 O O . PHE A 1 101 ? 22.200 80.955 59.839 1.00 47.21 ? 467 PHE A O 1 ATOM 666 C CB . PHE A 1 101 ? 21.864 78.191 58.576 1.00 40.92 ? 467 PHE A CB 1 ATOM 667 C CG . PHE A 1 101 ? 21.914 76.690 58.665 1.00 40.58 ? 467 PHE A CG 1 ATOM 668 C CD1 . PHE A 1 101 ? 22.569 76.061 59.714 1.00 45.86 ? 467 PHE A CD1 1 ATOM 669 C CD2 . PHE A 1 101 ? 21.331 75.906 57.683 1.00 41.29 ? 467 PHE A CD2 1 ATOM 670 C CE1 . PHE A 1 101 ? 22.623 74.680 59.789 1.00 49.44 ? 467 PHE A CE1 1 ATOM 671 C CE2 . PHE A 1 101 ? 21.386 74.523 57.753 1.00 41.85 ? 467 PHE A CE2 1 ATOM 672 C CZ . PHE A 1 101 ? 22.030 73.912 58.805 1.00 43.79 ? 467 PHE A CZ 1 ATOM 673 N N . ASN A 1 102 ? 20.096 81.019 59.071 1.00 41.53 ? 468 ASN A N 1 ATOM 674 C CA . ASN A 1 102 ? 20.164 82.448 58.775 1.00 39.84 ? 468 ASN A CA 1 ATOM 675 C C . ASN A 1 102 ? 19.435 83.329 59.784 1.00 44.02 ? 468 ASN A C 1 ATOM 676 O O . ASN A 1 102 ? 20.062 84.031 60.577 1.00 43.45 ? 468 ASN A O 1 ATOM 677 C CB . ASN A 1 102 ? 19.611 82.719 57.375 1.00 41.07 ? 468 ASN A CB 1 ATOM 678 C CG . ASN A 1 102 ? 20.421 82.041 56.287 1.00 45.60 ? 468 ASN A CG 1 ATOM 679 O OD1 . ASN A 1 102 ? 21.270 82.663 55.650 1.00 45.64 ? 468 ASN A OD1 1 ATOM 680 N ND2 . ASN A 1 102 ? 20.161 80.756 56.071 1.00 43.61 ? 468 ASN A ND2 1 ATOM 681 N N . TYR A 1 103 ? 18.107 83.294 59.751 1.00 46.36 ? 469 TYR A N 1 ATOM 682 C CA . TYR A 1 103 ? 17.312 84.197 60.575 1.00 47.20 ? 469 TYR A CA 1 ATOM 683 C C . TYR A 1 103 ? 16.225 83.454 61.343 1.00 48.87 ? 469 TYR A C 1 ATOM 684 O O . TYR A 1 103 ? 15.564 82.563 60.808 1.00 48.13 ? 469 TYR A O 1 ATOM 685 C CB . TYR A 1 103 ? 16.693 85.296 59.707 1.00 47.76 ? 469 TYR A CB 1 ATOM 686 C CG . TYR A 1 103 ? 15.945 86.357 60.478 1.00 49.40 ? 469 TYR A CG 1 ATOM 687 C CD1 . TYR A 1 103 ? 16.605 87.194 61.371 1.00 50.21 ? 469 TYR A CD1 1 ATOM 688 C CD2 . TYR A 1 103 ? 14.583 86.537 60.296 1.00 50.61 ? 469 TYR A CD2 1 ATOM 689 C CE1 . TYR A 1 103 ? 15.924 88.170 62.072 1.00 47.27 ? 469 TYR A CE1 1 ATOM 690 C CE2 . TYR A 1 103 ? 13.890 87.515 60.992 1.00 51.96 ? 469 TYR A CE2 1 ATOM 691 C CZ . TYR A 1 103 ? 14.567 88.326 61.878 1.00 49.48 ? 469 TYR A CZ 1 ATOM 692 O OH . TYR A 1 103 ? 13.881 89.295 62.569 1.00 50.98 ? 469 TYR A OH 1 ATOM 693 N N . LYS A 1 104 ? 16.043 83.842 62.599 1.00 46.94 ? 470 LYS A N 1 ATOM 694 C CA . LYS A 1 104 ? 15.127 83.160 63.497 1.00 45.25 ? 470 LYS A CA 1 ATOM 695 C C . LYS A 1 104 ? 14.592 84.155 64.518 1.00 47.27 ? 470 LYS A C 1 ATOM 696 O O . LYS A 1 104 ? 15.334 84.638 65.369 1.00 44.73 ? 470 LYS A O 1 ATOM 697 C CB . LYS A 1 104 ? 15.838 81.998 64.187 1.00 47.78 ? 470 LYS A CB 1 ATOM 698 C CG . LYS A 1 104 ? 14.934 81.016 64.903 1.00 48.61 ? 470 LYS A CG 1 ATOM 699 C CD . LYS A 1 104 ? 15.774 79.919 65.539 1.00 57.12 ? 470 LYS A CD 1 ATOM 700 C CE . LYS A 1 104 ? 14.918 78.784 66.068 1.00 62.96 ? 470 LYS A CE 1 ATOM 701 N NZ . LYS A 1 104 ? 15.734 77.764 66.786 1.00 69.64 ? 470 LYS A NZ 1 ATOM 702 N N . GLN A 1 105 ? 13.305 84.470 64.426 1.00 49.91 ? 471 GLN A N 1 ATOM 703 C CA . GLN A 1 105 ? 12.715 85.471 65.306 1.00 46.18 ? 471 GLN A CA 1 ATOM 704 C C . GLN A 1 105 ? 12.437 84.916 66.697 1.00 47.86 ? 471 GLN A C 1 ATOM 705 O O . GLN A 1 105 ? 12.465 83.706 66.915 1.00 49.14 ? 471 GLN A O 1 ATOM 706 C CB . GLN A 1 105 ? 11.428 86.025 64.697 1.00 46.73 ? 471 GLN A CB 1 ATOM 707 C CG . GLN A 1 105 ? 11.668 86.999 63.563 1.00 41.97 ? 471 GLN A CG 1 ATOM 708 C CD . GLN A 1 105 ? 10.384 87.490 62.932 1.00 48.99 ? 471 GLN A CD 1 ATOM 709 O OE1 . GLN A 1 105 ? 9.527 86.697 62.541 1.00 58.63 ? 471 GLN A OE1 1 ATOM 710 N NE2 . GLN A 1 105 ? 10.241 88.805 62.834 1.00 45.89 ? 471 GLN A NE2 1 ATOM 711 N N . SER A 1 106 ? 12.175 85.821 67.634 1.00 52.17 ? 472 SER A N 1 ATOM 712 C CA . SER A 1 106 ? 11.905 85.459 69.019 1.00 57.14 ? 472 SER A CA 1 ATOM 713 C C . SER A 1 106 ? 10.659 84.583 69.147 1.00 60.98 ? 472 SER A C 1 ATOM 714 O O . SER A 1 106 ? 9.745 84.657 68.325 1.00 54.12 ? 472 SER A O 1 ATOM 715 C CB . SER A 1 106 ? 11.747 86.722 69.871 1.00 58.84 ? 472 SER A CB 1 ATOM 716 O OG . SER A 1 106 ? 11.548 86.405 71.237 1.00 65.17 ? 472 SER A OG 1 ATOM 717 N N . PHE A 1 107 ? 10.639 83.751 70.183 1.00 70.16 ? 473 PHE A N 1 ATOM 718 C CA . PHE A 1 107 ? 9.508 82.874 70.452 1.00 72.44 ? 473 PHE A CA 1 ATOM 719 C C . PHE A 1 107 ? 8.626 83.437 71.556 1.00 70.47 ? 473 PHE A C 1 ATOM 720 O O . PHE A 1 107 ? 7.401 83.391 71.470 1.00 70.75 ? 473 PHE A O 1 ATOM 721 C CB . PHE A 1 107 ? 9.993 81.477 70.844 1.00 82.85 ? 473 PHE A CB 1 ATOM 722 C CG . PHE A 1 107 ? 10.682 80.743 69.735 1.00 91.44 ? 473 PHE A CG 1 ATOM 723 C CD1 . PHE A 1 107 ? 9.972 79.887 68.911 1.00 93.78 ? 473 PHE A CD1 1 ATOM 724 C CD2 . PHE A 1 107 ? 12.040 80.909 69.514 1.00 95.81 ? 473 PHE A CD2 1 ATOM 725 C CE1 . PHE A 1 107 ? 10.601 79.207 67.886 1.00 93.91 ? 473 PHE A CE1 1 ATOM 726 C CE2 . PHE A 1 107 ? 12.676 80.232 68.489 1.00 94.79 ? 473 PHE A CE2 1 ATOM 727 C CZ . PHE A 1 107 ? 11.953 79.380 67.674 1.00 93.32 ? 473 PHE A CZ 1 ATOM 728 N N . SER A 1 108 ? 9.264 83.972 72.592 1.00 68.25 ? 474 SER A N 1 ATOM 729 C CA . SER A 1 108 ? 8.558 84.454 73.773 1.00 67.33 ? 474 SER A CA 1 ATOM 730 C C . SER A 1 108 ? 8.111 85.907 73.635 1.00 63.16 ? 474 SER A C 1 ATOM 731 O O . SER A 1 108 ? 7.652 86.516 74.600 1.00 69.94 ? 474 SER A O 1 ATOM 732 C CB . SER A 1 108 ? 9.442 84.300 75.011 1.00 69.35 ? 474 SER A CB 1 ATOM 733 O OG . SER A 1 108 ? 10.658 85.010 74.851 1.00 70.45 ? 474 SER A OG 1 ATOM 734 N N . ASN A 1 109 ? 8.247 86.463 72.436 1.00 54.05 ? 475 ASN A N 1 ATOM 735 C CA . ASN A 1 109 ? 7.786 87.822 72.178 1.00 49.16 ? 475 ASN A CA 1 ATOM 736 C C . ASN A 1 109 ? 6.959 87.903 70.902 1.00 49.08 ? 475 ASN A C 1 ATOM 737 O O . ASN A 1 109 ? 7.233 87.187 69.937 1.00 51.71 ? 475 ASN A O 1 ATOM 738 C CB . ASN A 1 109 ? 8.969 88.789 72.088 1.00 48.43 ? 475 ASN A CB 1 ATOM 739 C CG . ASN A 1 109 ? 9.704 88.938 73.405 1.00 57.00 ? 475 ASN A CG 1 ATOM 740 O OD1 . ASN A 1 109 ? 9.349 89.772 74.239 1.00 60.33 ? 475 ASN A OD1 1 ATOM 741 N ND2 . ASN A 1 109 ? 10.741 88.132 73.596 1.00 62.97 ? 475 ASN A ND2 1 ATOM 742 N N . PRO A 1 110 ? 5.940 88.777 70.896 1.00 43.17 ? 476 PRO A N 1 ATOM 743 C CA . PRO A 1 110 ? 5.133 89.022 69.697 1.00 44.59 ? 476 PRO A CA 1 ATOM 744 C C . PRO A 1 110 ? 6.003 89.469 68.529 1.00 44.25 ? 476 PRO A C 1 ATOM 745 O O . PRO A 1 110 ? 6.838 90.358 68.695 1.00 42.81 ? 476 PRO A O 1 ATOM 746 C CB . PRO A 1 110 ? 4.182 90.143 70.129 1.00 44.71 ? 476 PRO A CB 1 ATOM 747 C CG . PRO A 1 110 ? 4.130 90.049 71.606 1.00 46.57 ? 476 PRO A CG 1 ATOM 748 C CD . PRO A 1 110 ? 5.487 89.587 72.038 1.00 40.81 ? 476 PRO A CD 1 ATOM 749 N N . THR A 1 111 ? 5.813 88.851 67.369 1.00 42.76 ? 477 THR A N 1 ATOM 750 C CA . THR A 1 111 ? 6.614 89.171 66.197 1.00 38.07 ? 477 THR A CA 1 ATOM 751 C C . THR A 1 111 ? 5.750 89.396 64.964 1.00 39.54 ? 477 THR A C 1 ATOM 752 O O . THR A 1 111 ? 4.628 88.907 64.879 1.00 44.70 ? 477 THR A O 1 ATOM 753 C CB . THR A 1 111 ? 7.631 88.055 65.887 1.00 36.73 ? 477 THR A CB 1 ATOM 754 O OG1 . THR A 1 111 ? 6.956 86.792 65.844 1.00 43.87 ? 477 THR A OG1 1 ATOM 755 C CG2 . THR A 1 111 ? 8.714 88.007 66.950 1.00 39.90 ? 477 THR A CG2 1 ATOM 756 N N . CYS A 1 112 ? 6.285 90.145 64.010 1.00 45.11 ? 478 CYS A N 1 ATOM 757 C CA . CYS A 1 112 ? 5.650 90.294 62.709 1.00 50.51 ? 478 CYS A CA 1 ATOM 758 C C . CYS A 1 112 ? 6.673 90.131 61.594 1.00 51.25 ? 478 CYS A C 1 ATOM 759 O O . CYS A 1 112 ? 7.863 90.387 61.786 1.00 47.55 ? 478 CYS A O 1 ATOM 760 C CB . CYS A 1 112 ? 4.953 91.649 62.591 1.00 52.75 ? 478 CYS A CB 1 ATOM 761 S SG . CYS A 1 112 ? 3.318 91.694 63.346 1.00 70.09 ? 478 CYS A SG 1 ATOM 762 N N . LEU A 1 113 ? 6.202 89.694 60.431 1.00 48.50 ? 479 LEU A N 1 ATOM 763 C CA . LEU A 1 113 ? 7.072 89.508 59.280 1.00 45.63 ? 479 LEU A CA 1 ATOM 764 C C . LEU A 1 113 ? 6.457 90.133 58.036 1.00 43.44 ? 479 LEU A C 1 ATOM 765 O O . LEU A 1 113 ? 5.351 89.778 57.632 1.00 48.15 ? 479 LEU A O 1 ATOM 766 C CB . LEU A 1 113 ? 7.343 88.024 59.046 1.00 47.76 ? 479 LEU A CB 1 ATOM 767 C CG . LEU A 1 113 ? 8.324 87.706 57.919 1.00 61.14 ? 479 LEU A CG 1 ATOM 768 C CD1 . LEU A 1 113 ? 9.734 88.152 58.284 1.00 62.05 ? 479 LEU A CD1 1 ATOM 769 C CD2 . LEU A 1 113 ? 8.286 86.224 57.597 1.00 71.14 ? 479 LEU A CD2 1 ATOM 770 N N . ILE A 1 114 ? 7.184 91.066 57.434 1.00 42.04 ? 480 ILE A N 1 ATOM 771 C CA . ILE A 1 114 ? 6.695 91.782 56.263 1.00 38.73 ? 480 ILE A CA 1 ATOM 772 C C . ILE A 1 114 ? 7.572 91.531 55.043 1.00 41.40 ? 480 ILE A C 1 ATOM 773 O O . ILE A 1 114 ? 8.795 91.665 55.102 1.00 35.07 ? 480 ILE A O 1 ATOM 774 C CB . ILE A 1 114 ? 6.625 93.299 56.525 1.00 38.40 ? 480 ILE A CB 1 ATOM 775 C CG1 . ILE A 1 114 ? 5.778 93.582 57.767 1.00 34.39 ? 480 ILE A CG1 1 ATOM 776 C CG2 . ILE A 1 114 ? 6.071 94.028 55.309 1.00 38.71 ? 480 ILE A CG2 1 ATOM 777 C CD1 . ILE A 1 114 ? 5.537 95.052 58.018 1.00 37.74 ? 480 ILE A CD1 1 ATOM 778 N N . LEU A 1 115 ? 6.934 91.151 53.941 1.00 45.50 ? 481 LEU A N 1 ATOM 779 C CA . LEU A 1 115 ? 7.621 90.989 52.668 1.00 43.71 ? 481 LEU A CA 1 ATOM 780 C C . LEU A 1 115 ? 7.187 92.113 51.737 1.00 46.32 ? 481 LEU A C 1 ATOM 781 O O . LEU A 1 115 ? 6.009 92.223 51.389 1.00 49.47 ? 481 LEU A O 1 ATOM 782 C CB . LEU A 1 115 ? 7.320 89.620 52.055 1.00 43.50 ? 481 LEU A CB 1 ATOM 783 C CG . LEU A 1 115 ? 8.298 88.475 52.339 1.00 50.86 ? 481 LEU A CG 1 ATOM 784 C CD1 . LEU A 1 115 ? 8.637 88.380 53.816 1.00 56.77 ? 481 LEU A CD1 1 ATOM 785 C CD2 . LEU A 1 115 ? 7.730 87.153 51.844 1.00 51.57 ? 481 LEU A CD2 1 ATOM 786 N N . ALA A 1 116 ? 8.134 92.957 51.346 1.00 39.12 ? 482 ALA A N 1 ATOM 787 C CA . ALA A 1 116 ? 7.806 94.124 50.540 1.00 36.03 ? 482 ALA A CA 1 ATOM 788 C C . ALA A 1 116 ? 8.724 94.261 49.336 1.00 44.02 ? 482 ALA A C 1 ATOM 789 O O . ALA A 1 116 ? 9.824 93.708 49.305 1.00 48.47 ? 482 ALA A O 1 ATOM 790 C CB . ALA A 1 116 ? 7.863 95.380 51.388 1.00 35.98 ? 482 ALA A CB 1 ATOM 791 N N . THR A 1 117 ? 8.255 95.009 48.344 1.00 46.91 ? 483 THR A N 1 ATOM 792 C CA . THR A 1 117 ? 9.029 95.280 47.143 1.00 45.36 ? 483 THR A CA 1 ATOM 793 C C . THR A 1 117 ? 9.269 96.781 47.014 1.00 47.19 ? 483 THR A C 1 ATOM 794 O O . THR A 1 117 ? 8.352 97.584 47.193 1.00 45.56 ? 483 THR A O 1 ATOM 795 C CB . THR A 1 117 ? 8.317 94.753 45.881 1.00 47.24 ? 483 THR A CB 1 ATOM 796 O OG1 . THR A 1 117 ? 8.021 93.360 46.042 1.00 48.83 ? 483 THR A OG1 1 ATOM 797 C CG2 . THR A 1 117 ? 9.194 94.937 44.658 1.00 50.31 ? 483 THR A CG2 1 ATOM 798 N N . VAL A 1 118 ? 10.510 97.151 46.722 1.00 48.15 ? 484 VAL A N 1 ATOM 799 C CA . VAL A 1 118 ? 10.874 98.550 46.550 1.00 48.49 ? 484 VAL A CA 1 ATOM 800 C C . VAL A 1 118 ? 10.360 99.084 45.217 1.00 49.65 ? 484 VAL A C 1 ATOM 801 O O . VAL A 1 118 ? 10.692 98.547 44.163 1.00 53.48 ? 484 VAL A O 1 ATOM 802 C CB . VAL A 1 118 ? 12.402 98.743 46.623 1.00 52.44 ? 484 VAL A CB 1 ATOM 803 C CG1 . VAL A 1 118 ? 12.772 100.194 46.354 1.00 50.26 ? 484 VAL A CG1 1 ATOM 804 C CG2 . VAL A 1 118 ? 12.931 98.286 47.974 1.00 52.64 ? 484 VAL A CG2 1 ATOM 805 N N . PRO A 1 119 ? 9.529 100.135 45.260 1.00 52.30 ? 485 PRO A N 1 ATOM 806 C CA . PRO A 1 119 ? 9.063 100.769 44.024 1.00 56.02 ? 485 PRO A CA 1 ATOM 807 C C . PRO A 1 119 ? 10.170 101.584 43.367 1.00 64.72 ? 485 PRO A C 1 ATOM 808 O O . PRO A 1 119 ? 11.158 101.920 44.021 1.00 65.64 ? 485 PRO A O 1 ATOM 809 C CB . PRO A 1 119 ? 7.920 101.669 44.498 1.00 55.18 ? 485 PRO A CB 1 ATOM 810 C CG . PRO A 1 119 ? 8.245 101.966 45.914 1.00 52.16 ? 485 PRO A CG 1 ATOM 811 C CD . PRO A 1 119 ? 8.910 100.734 46.456 1.00 48.91 ? 485 PRO A CD 1 ATOM 812 N N . HIS A 1 120 ? 10.002 101.897 42.087 1.00 73.65 ? 486 HIS A N 1 ATOM 813 C CA . HIS A 1 120 ? 11.034 102.591 41.327 1.00 80.94 ? 486 HIS A CA 1 ATOM 814 C C . HIS A 1 120 ? 11.284 104.015 41.816 1.00 86.35 ? 486 HIS A C 1 ATOM 815 O O . HIS A 1 120 ? 12.371 104.557 41.611 1.00 89.83 ? 486 HIS A O 1 ATOM 816 C CB . HIS A 1 120 ? 10.670 102.615 39.841 1.00 86.90 ? 486 HIS A CB 1 ATOM 817 C CG . HIS A 1 120 ? 10.984 101.339 39.123 1.00 93.64 ? 486 HIS A CG 1 ATOM 818 N ND1 . HIS A 1 120 ? 10.135 100.254 39.126 1.00 94.41 ? 486 HIS A ND1 1 ATOM 819 C CD2 . HIS A 1 120 ? 12.060 100.973 38.385 1.00 97.24 ? 486 HIS A CD2 1 ATOM 820 C CE1 . HIS A 1 120 ? 10.671 99.276 38.417 1.00 96.00 ? 486 HIS A CE1 1 ATOM 821 N NE2 . HIS A 1 120 ? 11.839 99.687 37.957 1.00 97.44 ? 486 HIS A NE2 1 ATOM 822 N N . ASN A 1 121 ? 10.293 104.621 42.463 1.00 87.34 ? 487 ASN A N 1 ATOM 823 C CA . ASN A 1 121 ? 10.441 106.003 42.906 1.00 88.94 ? 487 ASN A CA 1 ATOM 824 C C . ASN A 1 121 ? 11.163 106.119 44.248 1.00 78.76 ? 487 ASN A C 1 ATOM 825 O O . ASN A 1 121 ? 11.293 107.209 44.802 1.00 80.96 ? 487 ASN A O 1 ATOM 826 C CB . ASN A 1 121 ? 9.075 106.700 42.971 1.00 98.25 ? 487 ASN A CB 1 ATOM 827 C CG . ASN A 1 121 ? 8.113 106.049 43.952 1.00 103.80 ? 487 ASN A CG 1 ATOM 828 O OD1 . ASN A 1 121 ? 8.456 105.099 44.655 1.00 97.33 ? 487 ASN A OD1 1 ATOM 829 N ND2 . ASN A 1 121 ? 6.892 106.573 44.000 1.00 120.14 ? 487 ASN A ND2 1 ATOM 830 N N . LEU A 1 122 ? 11.636 104.988 44.762 1.00 71.76 ? 488 LEU A N 1 ATOM 831 C CA . LEU A 1 122 ? 12.449 104.973 45.973 1.00 65.45 ? 488 LEU A CA 1 ATOM 832 C C . LEU A 1 122 ? 13.885 104.604 45.606 1.00 70.06 ? 488 LEU A C 1 ATOM 833 O O . LEU A 1 122 ? 14.365 103.515 45.921 1.00 70.81 ? 488 LEU A O 1 ATOM 834 C CB . LEU A 1 122 ? 11.877 103.993 46.999 1.00 58.47 ? 488 LEU A CB 1 ATOM 835 C CG . LEU A 1 122 ? 12.445 104.056 48.419 1.00 57.61 ? 488 LEU A CG 1 ATOM 836 C CD1 . LEU A 1 122 ? 12.353 105.467 48.976 1.00 59.92 ? 488 LEU A CD1 1 ATOM 837 C CD2 . LEU A 1 122 ? 11.718 103.072 49.322 1.00 55.08 ? 488 LEU A CD2 1 ATOM 838 N N . THR A 1 123 ? 14.562 105.527 44.932 1.00 72.53 ? 489 THR A N 1 ATOM 839 C CA . THR A 1 123 ? 15.880 105.261 44.370 1.00 73.39 ? 489 THR A CA 1 ATOM 840 C C . THR A 1 123 ? 16.990 105.245 45.418 1.00 70.17 ? 489 THR A C 1 ATOM 841 O O . THR A 1 123 ? 18.089 104.755 45.154 1.00 66.77 ? 489 THR A O 1 ATOM 842 C CB . THR A 1 123 ? 16.233 106.300 43.292 1.00 77.05 ? 489 THR A CB 1 ATOM 843 O OG1 . THR A 1 123 ? 16.223 107.610 43.871 1.00 76.13 ? 489 THR A OG1 1 ATOM 844 C CG2 . THR A 1 123 ? 15.222 106.247 42.159 1.00 78.91 ? 489 THR A CG2 1 ATOM 845 N N . THR A 1 124 ? 16.703 105.773 46.605 1.00 67.27 ? 490 THR A N 1 ATOM 846 C CA . THR A 1 124 ? 17.703 105.844 47.666 1.00 64.21 ? 490 THR A CA 1 ATOM 847 C C . THR A 1 124 ? 18.129 104.455 48.144 1.00 61.14 ? 490 THR A C 1 ATOM 848 O O . THR A 1 124 ? 19.241 104.277 48.643 1.00 61.67 ? 490 THR A O 1 ATOM 849 C CB . THR A 1 124 ? 17.190 106.656 48.868 1.00 63.46 ? 490 THR A CB 1 ATOM 850 O OG1 . THR A 1 124 ? 15.954 106.101 49.329 1.00 63.27 ? 490 THR A OG1 1 ATOM 851 C CG2 . THR A 1 124 ? 16.969 108.107 48.473 1.00 68.27 ? 490 THR A CG2 1 ATOM 852 N N . ILE A 1 125 ? 17.243 103.475 47.991 1.00 55.69 ? 491 ILE A N 1 ATOM 853 C CA . ILE A 1 125 ? 17.568 102.092 48.317 1.00 51.96 ? 491 ILE A CA 1 ATOM 854 C C . ILE A 1 125 ? 18.157 101.393 47.097 1.00 56.22 ? 491 ILE A C 1 ATOM 855 O O . ILE A 1 125 ? 17.471 101.183 46.098 1.00 58.63 ? 491 ILE A O 1 ATOM 856 C CB . ILE A 1 125 ? 16.332 101.316 48.809 1.00 51.45 ? 491 ILE A CB 1 ATOM 857 C CG1 . ILE A 1 125 ? 15.786 101.941 50.095 1.00 49.77 ? 491 ILE A CG1 1 ATOM 858 C CG2 . ILE A 1 125 ? 16.674 99.849 49.034 1.00 46.16 ? 491 ILE A CG2 1 ATOM 859 C CD1 . ILE A 1 125 ? 14.612 101.197 50.701 1.00 42.46 ? 491 ILE A CD1 1 ATOM 860 N N . THR A 1 126 ? 19.435 101.041 47.181 1.00 58.74 ? 492 THR A N 1 ATOM 861 C CA . THR A 1 126 ? 20.138 100.443 46.052 1.00 58.44 ? 492 THR A CA 1 ATOM 862 C C . THR A 1 126 ? 20.113 98.920 46.111 1.00 54.98 ? 492 THR A C 1 ATOM 863 O O . THR A 1 126 ? 20.013 98.330 47.185 1.00 55.09 ? 492 THR A O 1 ATOM 864 C CB . THR A 1 126 ? 21.598 100.920 45.992 1.00 57.06 ? 492 THR A CB 1 ATOM 865 O OG1 . THR A 1 126 ? 22.278 100.525 47.189 1.00 58.14 ? 492 THR A OG1 1 ATOM 866 C CG2 . THR A 1 126 ? 21.654 102.433 45.861 1.00 55.45 ? 492 THR A CG2 1 ATOM 867 N N . LYS A 1 127 ? 20.207 98.290 44.945 1.00 57.23 ? 493 LYS A N 1 ATOM 868 C CA . LYS A 1 127 ? 20.126 96.836 44.848 1.00 57.08 ? 493 LYS A CA 1 ATOM 869 C C . LYS A 1 127 ? 21.487 96.172 45.028 1.00 52.59 ? 493 LYS A C 1 ATOM 870 O O . LYS A 1 127 ? 22.501 96.683 44.553 1.00 53.18 ? 493 LYS A O 1 ATOM 871 C CB . LYS A 1 127 ? 19.528 96.429 43.498 1.00 61.11 ? 493 LYS A CB 1 ATOM 872 C CG . LYS A 1 127 ? 18.134 96.981 43.251 1.00 66.03 ? 493 LYS A CG 1 ATOM 873 C CD . LYS A 1 127 ? 17.762 96.907 41.779 1.00 66.26 ? 493 LYS A CD 1 ATOM 874 C CE . LYS A 1 127 ? 17.762 95.476 41.280 1.00 67.87 ? 493 LYS A CE 1 ATOM 875 N NZ . LYS A 1 127 ? 17.460 95.400 39.823 1.00 73.46 ? 493 LYS A NZ 1 ATOM 876 N N . PRO A 1 128 ? 21.514 95.030 45.729 1.00 49.14 ? 494 PRO A N 1 ATOM 877 C CA . PRO A 1 128 ? 22.729 94.215 45.788 1.00 49.85 ? 494 PRO A CA 1 ATOM 878 C C . PRO A 1 128 ? 22.929 93.457 44.482 1.00 56.89 ? 494 PRO A C 1 ATOM 879 O O . PRO A 1 128 ? 22.032 93.457 43.636 1.00 62.53 ? 494 PRO A O 1 ATOM 880 C CB . PRO A 1 128 ? 22.458 93.260 46.951 1.00 44.76 ? 494 PRO A CB 1 ATOM 881 C CG . PRO A 1 128 ? 20.982 93.143 46.995 1.00 44.64 ? 494 PRO A CG 1 ATOM 882 C CD . PRO A 1 128 ? 20.441 94.485 46.577 1.00 45.31 ? 494 PRO A CD 1 ATOM 883 N N . LEU A 1 129 ? 24.086 92.823 44.321 1.00 58.30 ? 495 LEU A N 1 ATOM 884 C CA . LEU A 1 129 ? 24.407 92.114 43.089 1.00 60.49 ? 495 LEU A CA 1 ATOM 885 C C . LEU A 1 129 ? 23.419 90.981 42.834 1.00 56.03 ? 495 LEU A C 1 ATOM 886 O O . LEU A 1 129 ? 23.082 90.674 41.691 1.00 54.30 ? 495 LEU A O 1 ATOM 887 C CB . LEU A 1 129 ? 25.833 91.563 43.150 1.00 64.97 ? 495 LEU A CB 1 ATOM 888 C CG . LEU A 1 129 ? 26.533 91.328 41.814 1.00 68.69 ? 495 LEU A CG 1 ATOM 889 C CD1 . LEU A 1 129 ? 26.706 92.647 41.077 1.00 71.00 ? 495 LEU A CD1 1 ATOM 890 C CD2 . LEU A 1 129 ? 27.876 90.642 42.021 1.00 70.45 ? 495 LEU A CD2 1 ATOM 891 N N . LYS A 1 130 ? 22.952 90.378 43.921 1.00 52.75 ? 496 LYS A N 1 ATOM 892 C CA . LYS A 1 130 ? 22.063 89.230 43.863 1.00 43.45 ? 496 LYS A CA 1 ATOM 893 C C . LYS A 1 130 ? 21.535 88.946 45.257 1.00 43.27 ? 496 LYS A C 1 ATOM 894 O O . LYS A 1 130 ? 21.954 89.582 46.224 1.00 50.14 ? 496 LYS A O 1 ATOM 895 C CB . LYS A 1 130 ? 22.798 88.003 43.327 1.00 41.43 ? 496 LYS A CB 1 ATOM 896 C CG . LYS A 1 130 ? 23.803 87.444 44.320 1.00 40.27 ? 496 LYS A CG 1 ATOM 897 C CD . LYS A 1 130 ? 24.760 86.469 43.675 1.00 48.84 ? 496 LYS A CD 1 ATOM 898 C CE . LYS A 1 130 ? 25.674 87.167 42.681 1.00 51.90 ? 496 LYS A CE 1 ATOM 899 N NZ . LYS A 1 130 ? 26.594 86.196 42.030 1.00 55.53 ? 496 LYS A NZ 1 ATOM 900 N N . TYR A 1 131 ? 20.618 87.991 45.358 1.00 39.17 ? 497 TYR A N 1 ATOM 901 C CA . TYR A 1 131 ? 20.216 87.464 46.654 1.00 37.90 ? 497 TYR A CA 1 ATOM 902 C C . TYR A 1 131 ? 21.143 86.315 47.005 1.00 39.69 ? 497 TYR A C 1 ATOM 903 O O . TYR A 1 131 ? 21.618 85.606 46.116 1.00 32.49 ? 497 TYR A O 1 ATOM 904 C CB . TYR A 1 131 ? 18.760 86.978 46.644 1.00 38.46 ? 497 TYR A CB 1 ATOM 905 C CG . TYR A 1 131 ? 17.742 88.026 46.265 1.00 34.88 ? 497 TYR A CG 1 ATOM 906 C CD1 . TYR A 1 131 ? 17.338 88.990 47.176 1.00 34.95 ? 497 TYR A CD1 1 ATOM 907 C CD2 . TYR A 1 131 ? 17.166 88.035 45.001 1.00 35.97 ? 497 TYR A CD2 1 ATOM 908 C CE1 . TYR A 1 131 ? 16.400 89.945 46.836 1.00 38.02 ? 497 TYR A CE1 1 ATOM 909 C CE2 . TYR A 1 131 ? 16.224 88.986 44.651 1.00 42.10 ? 497 TYR A CE2 1 ATOM 910 C CZ . TYR A 1 131 ? 15.846 89.939 45.573 1.00 36.92 ? 497 TYR A CZ 1 ATOM 911 O OH . TYR A 1 131 ? 14.913 90.887 45.228 1.00 39.43 ? 497 TYR A OH 1 ATOM 912 N N . SER A 1 132 ? 21.400 86.123 48.293 1.00 34.59 ? 498 SER A N 1 ATOM 913 C CA . SER A 1 132 ? 22.189 84.976 48.723 1.00 39.63 ? 498 SER A CA 1 ATOM 914 C C . SER A 1 132 ? 21.916 84.645 50.180 1.00 38.65 ? 498 SER A C 1 ATOM 915 O O . SER A 1 132 ? 21.639 85.530 50.984 1.00 42.64 ? 498 SER A O 1 ATOM 916 C CB . SER A 1 132 ? 23.687 85.228 48.501 1.00 41.02 ? 498 SER A CB 1 ATOM 917 O OG . SER A 1 132 ? 24.095 86.449 49.087 1.00 50.38 ? 498 SER A OG 1 ATOM 918 N N . TYR A 1 133 ? 21.991 83.362 50.508 1.00 35.76 ? 499 TYR A N 1 ATOM 919 C CA . TYR A 1 133 ? 21.761 82.915 51.873 1.00 37.17 ? 499 TYR A CA 1 ATOM 920 C C . TYR A 1 133 ? 22.680 81.757 52.238 1.00 36.38 ? 499 TYR A C 1 ATOM 921 O O . TYR A 1 133 ? 23.261 81.111 51.367 1.00 33.35 ? 499 TYR A O 1 ATOM 922 C CB . TYR A 1 133 ? 20.295 82.505 52.070 1.00 33.89 ? 499 TYR A CB 1 ATOM 923 C CG . TYR A 1 133 ? 19.827 81.353 51.197 1.00 36.11 ? 499 TYR A CG 1 ATOM 924 C CD1 . TYR A 1 133 ? 19.931 80.037 51.631 1.00 39.53 ? 499 TYR A CD1 1 ATOM 925 C CD2 . TYR A 1 133 ? 19.261 81.585 49.948 1.00 36.17 ? 499 TYR A CD2 1 ATOM 926 C CE1 . TYR A 1 133 ? 19.494 78.981 50.841 1.00 39.24 ? 499 TYR A CE1 1 ATOM 927 C CE2 . TYR A 1 133 ? 18.821 80.538 49.153 1.00 41.12 ? 499 TYR A CE2 1 ATOM 928 C CZ . TYR A 1 133 ? 18.938 79.239 49.605 1.00 41.71 ? 499 TYR A CZ 1 ATOM 929 O OH . TYR A 1 133 ? 18.507 78.194 48.816 1.00 37.39 ? 499 TYR A OH 1 ATOM 930 N N . ILE A 1 134 ? 22.804 81.510 53.537 1.00 36.50 ? 500 ILE A N 1 ATOM 931 C CA . ILE A 1 134 ? 23.564 80.379 54.046 1.00 34.17 ? 500 ILE A CA 1 ATOM 932 C C . ILE A 1 134 ? 22.751 79.096 53.931 1.00 40.30 ? 500 ILE A C 1 ATOM 933 O O . ILE A 1 134 ? 21.672 78.982 54.515 1.00 48.84 ? 500 ILE A O 1 ATOM 934 C CB . ILE A 1 134 ? 23.969 80.593 55.515 1.00 35.81 ? 500 ILE A CB 1 ATOM 935 C CG1 . ILE A 1 134 ? 24.839 81.846 55.650 1.00 32.33 ? 500 ILE A CG1 1 ATOM 936 C CG2 . ILE A 1 134 ? 24.680 79.363 56.062 1.00 33.67 ? 500 ILE A CG2 1 ATOM 937 C CD1 . ILE A 1 134 ? 25.270 82.132 57.069 1.00 38.45 ? 500 ILE A CD1 1 ATOM 938 N N . ASN A 1 135 ? 23.269 78.134 53.178 1.00 41.86 ? 501 ASN A N 1 ATOM 939 C CA . ASN A 1 135 ? 22.580 76.866 52.972 1.00 48.32 ? 501 ASN A CA 1 ATOM 940 C C . ASN A 1 135 ? 23.020 75.803 53.977 1.00 44.62 ? 501 ASN A C 1 ATOM 941 O O . ASN A 1 135 ? 22.217 74.988 54.431 1.00 45.37 ? 501 ASN A O 1 ATOM 942 C CB . ASN A 1 135 ? 22.812 76.372 51.543 1.00 57.64 ? 501 ASN A CB 1 ATOM 943 C CG . ASN A 1 135 ? 22.128 75.051 51.265 1.00 67.03 ? 501 ASN A CG 1 ATOM 944 O OD1 . ASN A 1 135 ? 22.770 74.001 51.243 1.00 74.81 ? 501 ASN A OD1 1 ATOM 945 N ND2 . ASN A 1 135 ? 20.817 75.095 51.054 1.00 66.72 ? 501 ASN A ND2 1 ATOM 946 N N . LYS A 1 136 ? 24.303 75.825 54.319 1.00 46.32 ? 502 LYS A N 1 ATOM 947 C CA . LYS A 1 136 ? 24.874 74.896 55.289 1.00 48.61 ? 502 LYS A CA 1 ATOM 948 C C . LYS A 1 136 ? 25.764 75.640 56.274 1.00 48.68 ? 502 LYS A C 1 ATOM 949 O O . LYS A 1 136 ? 26.468 76.575 55.894 1.00 52.38 ? 502 LYS A O 1 ATOM 950 C CB . LYS A 1 136 ? 25.688 73.806 54.587 1.00 50.59 ? 502 LYS A CB 1 ATOM 951 C CG . LYS A 1 136 ? 24.885 72.876 53.694 1.00 53.35 ? 502 LYS A CG 1 ATOM 952 C CD . LYS A 1 136 ? 24.307 71.718 54.486 1.00 54.04 ? 502 LYS A CD 1 ATOM 953 C CE . LYS A 1 136 ? 23.805 70.618 53.566 1.00 57.30 ? 502 LYS A CE 1 ATOM 954 N NZ . LYS A 1 136 ? 23.551 69.351 54.310 1.00 60.87 ? 502 LYS A NZ 1 ATOM 955 N N . CYS A 1 137 ? 25.738 75.225 57.535 1.00 46.68 ? 503 CYS A N 1 ATOM 956 C CA . CYS A 1 137 ? 26.622 75.805 58.543 1.00 40.74 ? 503 CYS A CA 1 ATOM 957 C C . CYS A 1 137 ? 26.912 74.787 59.634 1.00 40.17 ? 503 CYS A C 1 ATOM 958 O O . CYS A 1 137 ? 26.023 74.422 60.409 1.00 38.78 ? 503 CYS A O 1 ATOM 959 C CB . CYS A 1 137 ? 26.009 77.067 59.149 1.00 40.51 ? 503 CYS A CB 1 ATOM 960 S SG . CYS A 1 137 ? 27.024 77.833 60.436 1.00 46.97 ? 503 CYS A SG 1 ATOM 961 N N . SER A 1 138 ? 28.159 74.331 59.696 1.00 39.32 ? 504 SER A N 1 ATOM 962 C CA . SER A 1 138 ? 28.519 73.261 60.613 1.00 44.58 ? 504 SER A CA 1 ATOM 963 C C . SER A 1 138 ? 29.938 73.388 61.147 1.00 48.96 ? 504 SER A C 1 ATOM 964 O O . SER A 1 138 ? 30.798 74.032 60.541 1.00 46.09 ? 504 SER A O 1 ATOM 965 C CB . SER A 1 138 ? 28.360 71.902 59.928 1.00 43.70 ? 504 SER A CB 1 ATOM 966 O OG . SER A 1 138 ? 27.024 71.685 59.517 1.00 50.75 ? 504 SER A OG 1 ATOM 967 N N . ARG A 1 139 ? 30.168 72.766 62.297 1.00 53.89 ? 505 ARG A N 1 ATOM 968 C CA . ARG A 1 139 ? 31.512 72.605 62.826 1.00 54.26 ? 505 ARG A CA 1 ATOM 969 C C . ARG A 1 139 ? 32.026 71.217 62.474 1.00 57.94 ? 505 ARG A C 1 ATOM 970 O O . ARG A 1 139 ? 31.377 70.209 62.769 1.00 58.23 ? 505 ARG A O 1 ATOM 971 C CB . ARG A 1 139 ? 31.536 72.814 64.341 1.00 56.06 ? 505 ARG A CB 1 ATOM 972 C CG . ARG A 1 139 ? 31.853 74.235 64.767 1.00 56.76 ? 505 ARG A CG 1 ATOM 973 C CD . ARG A 1 139 ? 31.996 74.330 66.274 1.00 61.59 ? 505 ARG A CD 1 ATOM 974 N NE . ARG A 1 139 ? 32.656 75.567 66.682 1.00 71.74 ? 505 ARG A NE 1 ATOM 975 C CZ . ARG A 1 139 ? 32.850 75.929 67.946 1.00 79.14 ? 505 ARG A CZ 1 ATOM 976 N NH1 . ARG A 1 139 ? 32.427 75.150 68.933 1.00 85.88 ? 505 ARG A NH1 1 ATOM 977 N NH2 . ARG A 1 139 ? 33.462 77.073 68.225 1.00 76.50 ? 505 ARG A NH2 1 ATOM 978 N N . PHE A 1 140 ? 33.181 71.170 61.822 1.00 57.51 ? 506 PHE A N 1 ATOM 979 C CA . PHE A 1 140 ? 33.825 69.903 61.516 1.00 56.11 ? 506 PHE A CA 1 ATOM 980 C C . PHE A 1 140 ? 34.922 69.663 62.543 1.00 59.04 ? 506 PHE A C 1 ATOM 981 O O . PHE A 1 140 ? 35.959 70.331 62.526 1.00 54.03 ? 506 PHE A O 1 ATOM 982 C CB . PHE A 1 140 ? 34.387 69.903 60.095 1.00 55.48 ? 506 PHE A CB 1 ATOM 983 C CG . PHE A 1 140 ? 34.793 68.543 59.604 1.00 56.68 ? 506 PHE A CG 1 ATOM 984 C CD1 . PHE A 1 140 ? 33.862 67.521 59.511 1.00 57.81 ? 506 PHE A CD1 1 ATOM 985 C CD2 . PHE A 1 140 ? 36.101 68.289 59.221 1.00 55.80 ? 506 PHE A CD2 1 ATOM 986 C CE1 . PHE A 1 140 ? 34.230 66.267 59.056 1.00 57.67 ? 506 PHE A CE1 1 ATOM 987 C CE2 . PHE A 1 140 ? 36.474 67.038 58.765 1.00 54.09 ? 506 PHE A CE2 1 ATOM 988 C CZ . PHE A 1 140 ? 35.537 66.027 58.681 1.00 54.58 ? 506 PHE A CZ 1 ATOM 989 N N . LEU A 1 141 ? 34.679 68.715 63.443 1.00 59.45 ? 507 LEU A N 1 ATOM 990 C CA . LEU A 1 141 ? 35.560 68.484 64.584 1.00 55.61 ? 507 LEU A CA 1 ATOM 991 C C . LEU A 1 141 ? 36.941 67.975 64.174 1.00 52.38 ? 507 LEU A C 1 ATOM 992 O O . LEU A 1 141 ? 37.153 67.558 63.036 1.00 50.77 ? 507 LEU A O 1 ATOM 993 C CB . LEU A 1 141 ? 34.907 67.502 65.560 1.00 54.45 ? 507 LEU A CB 1 ATOM 994 C CG . LEU A 1 141 ? 34.098 68.113 66.709 1.00 51.53 ? 507 LEU A CG 1 ATOM 995 C CD1 . LEU A 1 141 ? 32.984 69.008 66.193 1.00 47.15 ? 507 LEU A CD1 1 ATOM 996 C CD2 . LEU A 1 141 ? 33.538 67.025 67.610 1.00 56.71 ? 507 LEU A CD2 1 ATOM 997 N N . SER A 1 142 ? 37.873 68.007 65.120 1.00 52.33 ? 508 SER A N 1 ATOM 998 C CA . SER A 1 142 ? 39.267 67.665 64.853 1.00 53.89 ? 508 SER A CA 1 ATOM 999 C C . SER A 1 142 ? 39.503 66.164 64.676 1.00 57.18 ? 508 SER A C 1 ATOM 1000 O O . SER A 1 142 ? 40.629 65.735 64.430 1.00 56.20 ? 508 SER A O 1 ATOM 1001 C CB . SER A 1 142 ? 40.156 68.197 65.977 1.00 50.67 ? 508 SER A CB 1 ATOM 1002 O OG . SER A 1 142 ? 39.685 67.768 67.241 1.00 51.77 ? 508 SER A OG 1 ATOM 1003 N N . ASP A 1 143 ? 38.444 65.369 64.800 1.00 61.72 ? 509 ASP A N 1 ATOM 1004 C CA . ASP A 1 143 ? 38.551 63.930 64.589 1.00 66.09 ? 509 ASP A CA 1 ATOM 1005 C C . ASP A 1 143 ? 38.352 63.567 63.118 1.00 69.65 ? 509 ASP A C 1 ATOM 1006 O O . ASP A 1 143 ? 38.418 62.394 62.749 1.00 73.77 ? 509 ASP A O 1 ATOM 1007 C CB . ASP A 1 143 ? 37.540 63.179 65.462 1.00 71.85 ? 509 ASP A CB 1 ATOM 1008 C CG . ASP A 1 143 ? 36.121 63.708 65.319 1.00 75.14 ? 509 ASP A CG 1 ATOM 1009 O OD1 . ASP A 1 143 ? 35.318 63.498 66.252 1.00 79.43 ? 509 ASP A OD1 1 ATOM 1010 O OD2 . ASP A 1 143 ? 35.804 64.330 64.283 1.00 73.54 ? 509 ASP A OD2 1 ATOM 1011 N N . ASP A 1 144 ? 38.105 64.584 62.295 1.00 69.01 ? 510 ASP A N 1 ATOM 1012 C CA . ASP A 1 144 ? 37.876 64.419 60.859 1.00 70.45 ? 510 ASP A CA 1 ATOM 1013 C C . ASP A 1 144 ? 36.725 63.464 60.543 1.00 71.91 ? 510 ASP A C 1 ATOM 1014 O O . ASP A 1 144 ? 36.737 62.789 59.513 1.00 77.10 ? 510 ASP A O 1 ATOM 1015 C CB . ASP A 1 144 ? 39.152 63.936 60.159 1.00 72.31 ? 510 ASP A CB 1 ATOM 1016 C CG . ASP A 1 144 ? 40.081 65.076 59.783 1.00 73.41 ? 510 ASP A CG 1 ATOM 1017 O OD1 . ASP A 1 144 ? 41.313 64.902 59.891 1.00 76.76 ? 510 ASP A OD1 1 ATOM 1018 O OD2 . ASP A 1 144 ? 39.579 66.144 59.373 1.00 72.11 ? 510 ASP A OD2 1 ATOM 1019 N N . ARG A 1 145 ? 35.731 63.415 61.424 1.00 71.61 ? 511 ARG A N 1 ATOM 1020 C CA . ARG A 1 145 ? 34.568 62.557 61.212 1.00 72.65 ? 511 ARG A CA 1 ATOM 1021 C C . ARG A 1 145 ? 33.262 63.266 61.553 1.00 71.13 ? 511 ARG A C 1 ATOM 1022 O O . ARG A 1 145 ? 32.440 63.537 60.678 1.00 71.72 ? 511 ARG A O 1 ATOM 1023 C CB . ARG A 1 145 ? 34.682 61.276 62.042 1.00 76.11 ? 511 ARG A CB 1 ATOM 1024 C CG . ARG A 1 145 ? 35.704 60.274 61.533 1.00 81.09 ? 511 ARG A CG 1 ATOM 1025 C CD . ARG A 1 145 ? 35.680 58.989 62.353 1.00 88.28 ? 511 ARG A CD 1 ATOM 1026 N NE . ARG A 1 145 ? 36.090 59.206 63.738 1.00 94.21 ? 511 ARG A NE 1 ATOM 1027 C CZ . ARG A 1 145 ? 35.251 59.307 64.765 1.00 99.20 ? 511 ARG A CZ 1 ATOM 1028 N NH1 . ARG A 1 145 ? 33.943 59.208 64.570 1.00 103.40 ? 511 ARG A NH1 1 ATOM 1029 N NH2 . ARG A 1 145 ? 35.720 59.504 65.990 1.00 98.77 ? 511 ARG A NH2 1 ATOM 1030 N N . THR A 1 146 ? 33.081 63.560 62.835 1.00 66.29 ? 512 THR A N 1 ATOM 1031 C CA . THR A 1 146 ? 31.819 64.089 63.333 1.00 68.30 ? 512 THR A CA 1 ATOM 1032 C C . THR A 1 146 ? 31.546 65.516 62.867 1.00 64.13 ? 512 THR A C 1 ATOM 1033 O O . THR A 1 146 ? 32.379 66.408 63.027 1.00 60.28 ? 512 THR A O 1 ATOM 1034 C CB . THR A 1 146 ? 31.776 64.050 64.869 1.00 72.82 ? 512 THR A CB 1 ATOM 1035 O OG1 . THR A 1 146 ? 32.894 64.774 65.394 1.00 75.33 ? 512 THR A OG1 1 ATOM 1036 C CG2 . THR A 1 146 ? 31.837 62.613 65.363 1.00 75.14 ? 512 THR A CG2 1 ATOM 1037 N N . GLU A 1 147 ? 30.366 65.718 62.289 1.00 63.08 ? 513 GLU A N 1 ATOM 1038 C CA . GLU A 1 147 ? 29.933 67.035 61.842 1.00 56.77 ? 513 GLU A CA 1 ATOM 1039 C C . GLU A 1 147 ? 28.831 67.581 62.744 1.00 56.88 ? 513 GLU A C 1 ATOM 1040 O O . GLU A 1 147 ? 27.840 66.903 63.007 1.00 61.91 ? 513 GLU A O 1 ATOM 1041 C CB . GLU A 1 147 ? 29.440 66.979 60.397 1.00 52.91 ? 513 GLU A CB 1 ATOM 1042 C CG . GLU A 1 147 ? 28.811 68.272 59.916 1.00 51.68 ? 513 GLU A CG 1 ATOM 1043 C CD . GLU A 1 147 ? 28.035 68.100 58.627 1.00 56.67 ? 513 GLU A CD 1 ATOM 1044 O OE1 . GLU A 1 147 ? 27.284 69.026 58.257 1.00 54.51 ? 513 GLU A OE1 1 ATOM 1045 O OE2 . GLU A 1 147 ? 28.175 67.037 57.986 1.00 63.54 ? 513 GLU A OE2 1 ATOM 1046 N N . VAL A 1 148 ? 29.005 68.811 63.211 1.00 54.07 ? 514 VAL A N 1 ATOM 1047 C CA . VAL A 1 148 ? 28.033 69.422 64.104 1.00 52.11 ? 514 VAL A CA 1 ATOM 1048 C C . VAL A 1 148 ? 27.397 70.653 63.472 1.00 50.84 ? 514 VAL A C 1 ATOM 1049 O O . VAL A 1 148 ? 28.030 71.703 63.382 1.00 54.80 ? 514 VAL A O 1 ATOM 1050 C CB . VAL A 1 148 ? 28.676 69.815 65.448 1.00 49.42 ? 514 VAL A CB 1 ATOM 1051 C CG1 . VAL A 1 148 ? 27.637 70.425 66.375 1.00 47.99 ? 514 VAL A CG1 1 ATOM 1052 C CG2 . VAL A 1 148 ? 29.327 68.601 66.091 1.00 48.39 ? 514 VAL A CG2 1 ATOM 1053 N N . PRO A 1 149 ? 26.143 70.517 63.015 1.00 50.00 ? 515 PRO A N 1 ATOM 1054 C CA . PRO A 1 149 ? 25.386 71.637 62.448 1.00 48.48 ? 515 PRO A CA 1 ATOM 1055 C C . PRO A 1 149 ? 25.151 72.733 63.478 1.00 47.32 ? 515 PRO A C 1 ATOM 1056 O O . PRO A 1 149 ? 24.745 72.451 64.604 1.00 45.79 ? 515 PRO A O 1 ATOM 1057 C CB . PRO A 1 149 ? 24.064 70.990 62.019 1.00 49.22 ? 515 PRO A CB 1 ATOM 1058 C CG . PRO A 1 149 ? 24.394 69.548 61.836 1.00 49.71 ? 515 PRO A CG 1 ATOM 1059 C CD . PRO A 1 149 ? 25.410 69.246 62.896 1.00 49.91 ? 515 PRO A CD 1 ATOM 1060 N N . GLN A 1 150 ? 25.415 73.973 63.086 1.00 46.62 ? 516 GLN A N 1 ATOM 1061 C CA . GLN A 1 150 ? 25.288 75.107 63.989 1.00 46.32 ? 516 GLN A CA 1 ATOM 1062 C C . GLN A 1 150 ? 24.006 75.879 63.703 1.00 49.91 ? 516 GLN A C 1 ATOM 1063 O O . GLN A 1 150 ? 23.991 76.801 62.889 1.00 56.00 ? 516 GLN A O 1 ATOM 1064 C CB . GLN A 1 150 ? 26.508 76.024 63.867 1.00 45.84 ? 516 GLN A CB 1 ATOM 1065 C CG . GLN A 1 150 ? 27.834 75.339 64.179 1.00 43.04 ? 516 GLN A CG 1 ATOM 1066 C CD . GLN A 1 150 ? 27.928 74.880 65.623 1.00 49.81 ? 516 GLN A CD 1 ATOM 1067 O OE1 . GLN A 1 150 ? 28.254 73.726 65.901 1.00 49.73 ? 516 GLN A OE1 1 ATOM 1068 N NE2 . GLN A 1 150 ? 27.644 75.786 66.552 1.00 55.81 ? 516 GLN A NE2 1 ATOM 1069 N N . LEU A 1 151 ? 22.929 75.489 64.374 1.00 54.30 ? 517 LEU A N 1 ATOM 1070 C CA . LEU A 1 151 ? 21.635 76.127 64.174 1.00 59.94 ? 517 LEU A CA 1 ATOM 1071 C C . LEU A 1 151 ? 21.613 77.523 64.783 1.00 58.73 ? 517 LEU A C 1 ATOM 1072 O O . LEU A 1 151 ? 22.017 77.716 65.930 1.00 60.04 ? 517 LEU A O 1 ATOM 1073 C CB . LEU A 1 151 ? 20.517 75.270 64.772 1.00 65.52 ? 517 LEU A CB 1 ATOM 1074 C CG . LEU A 1 151 ? 20.407 73.852 64.206 1.00 66.77 ? 517 LEU A CG 1 ATOM 1075 C CD1 . LEU A 1 151 ? 19.238 73.104 64.829 1.00 64.85 ? 517 LEU A CD1 1 ATOM 1076 C CD2 . LEU A 1 151 ? 20.278 73.893 62.692 1.00 67.62 ? 517 LEU A CD2 1 ATOM 1077 N N . VAL A 1 152 ? 21.143 78.494 64.007 1.00 57.23 ? 518 VAL A N 1 ATOM 1078 C CA . VAL A 1 152 ? 21.079 79.874 64.468 1.00 59.48 ? 518 VAL A CA 1 ATOM 1079 C C . VAL A 1 152 ? 20.062 80.008 65.602 1.00 61.79 ? 518 VAL A C 1 ATOM 1080 O O . VAL A 1 152 ? 19.032 79.332 65.615 1.00 61.95 ? 518 VAL A O 1 ATOM 1081 C CB . VAL A 1 152 ? 20.724 80.845 63.310 1.00 50.27 ? 518 VAL A CB 1 ATOM 1082 C CG1 . VAL A 1 152 ? 19.275 80.669 62.868 1.00 43.96 ? 518 VAL A CG1 1 ATOM 1083 C CG2 . VAL A 1 152 ? 20.997 82.287 63.710 1.00 42.92 ? 518 VAL A CG2 1 ATOM 1084 N N . ASN A 1 153 ? 20.376 80.861 66.571 1.00 62.44 ? 519 ASN A N 1 ATOM 1085 C CA . ASN A 1 153 ? 19.467 81.128 67.677 1.00 61.26 ? 519 ASN A CA 1 ATOM 1086 C C . ASN A 1 153 ? 18.635 82.370 67.408 1.00 58.00 ? 519 ASN A C 1 ATOM 1087 O O . ASN A 1 153 ? 18.938 83.144 66.503 1.00 58.27 ? 519 ASN A O 1 ATOM 1088 C CB . ASN A 1 153 ? 20.238 81.296 68.988 1.00 65.11 ? 519 ASN A CB 1 ATOM 1089 C CG . ASN A 1 153 ? 21.033 80.062 69.361 1.00 70.82 ? 519 ASN A CG 1 ATOM 1090 O OD1 . ASN A 1 153 ? 20.516 79.145 70.000 1.00 74.98 ? 519 ASN A OD1 1 ATOM 1091 N ND2 . ASN A 1 153 ? 22.301 80.035 68.970 1.00 74.67 ? 519 ASN A ND2 1 ATOM 1092 N N . ALA A 1 154 ? 17.586 82.556 68.198 1.00 63.16 ? 520 ALA A N 1 ATOM 1093 C CA . ALA A 1 154 ? 16.747 83.741 68.085 1.00 63.06 ? 520 ALA A CA 1 ATOM 1094 C C . ALA A 1 154 ? 17.546 84.997 68.415 1.00 63.59 ? 520 ALA A C 1 ATOM 1095 O O . ALA A 1 154 ? 18.386 84.984 69.316 1.00 67.99 ? 520 ALA A O 1 ATOM 1096 C CB . ALA A 1 154 ? 15.538 83.628 68.999 1.00 63.33 ? 520 ALA A CB 1 ATOM 1097 N N . ASN A 1 155 ? 17.288 86.069 67.669 1.00 63.02 ? 521 ASN A N 1 ATOM 1098 C CA . ASN A 1 155 ? 17.936 87.361 67.891 1.00 67.38 ? 521 ASN A CA 1 ATOM 1099 C C . ASN A 1 155 ? 19.456 87.290 67.795 1.00 70.75 ? 521 ASN A C 1 ATOM 1100 O O . ASN A 1 155 ? 20.163 88.073 68.429 1.00 79.18 ? 521 ASN A O 1 ATOM 1101 C CB . ASN A 1 155 ? 17.538 87.933 69.256 1.00 71.11 ? 521 ASN A CB 1 ATOM 1102 C CG . ASN A 1 155 ? 16.038 88.043 69.426 1.00 75.90 ? 521 ASN A CG 1 ATOM 1103 O OD1 . ASN A 1 155 ? 15.302 88.197 68.451 1.00 78.99 ? 521 ASN A OD1 1 ATOM 1104 N ND2 . ASN A 1 155 ? 15.576 87.967 70.668 1.00 78.59 ? 521 ASN A ND2 1 ATOM 1105 N N . GLN A 1 156 ? 19.956 86.345 67.005 1.00 66.18 ? 522 GLN A N 1 ATOM 1106 C CA . GLN A 1 156 ? 21.393 86.149 66.870 1.00 64.12 ? 522 GLN A CA 1 ATOM 1107 C C . GLN A 1 156 ? 21.784 85.883 65.420 1.00 62.15 ? 522 GLN A C 1 ATOM 1108 O O . GLN A 1 156 ? 20.955 85.485 64.602 1.00 63.08 ? 522 GLN A O 1 ATOM 1109 C CB . GLN A 1 156 ? 21.864 84.993 67.758 1.00 69.42 ? 522 GLN A CB 1 ATOM 1110 C CG . GLN A 1 156 ? 21.690 85.227 69.252 1.00 75.43 ? 522 GLN A CG 1 ATOM 1111 C CD . GLN A 1 156 ? 22.293 84.114 70.087 1.00 77.64 ? 522 GLN A CD 1 ATOM 1112 O OE1 . GLN A 1 156 ? 22.923 83.199 69.558 1.00 76.56 ? 522 GLN A OE1 1 ATOM 1113 N NE2 . GLN A 1 156 ? 22.104 84.189 71.400 1.00 80.65 ? 522 GLN A NE2 1 ATOM 1114 N N . TYR A 1 157 ? 23.055 86.110 65.107 1.00 56.82 ? 523 TYR A N 1 ATOM 1115 C CA . TYR A 1 157 ? 23.573 85.813 63.781 1.00 49.10 ? 523 TYR A CA 1 ATOM 1116 C C . TYR A 1 157 ? 24.124 84.397 63.733 1.00 46.73 ? 523 TYR A C 1 ATOM 1117 O O . TYR A 1 157 ? 24.399 83.792 64.766 1.00 47.99 ? 523 TYR A O 1 ATOM 1118 C CB . TYR A 1 157 ? 24.662 86.811 63.384 1.00 45.43 ? 523 TYR A CB 1 ATOM 1119 C CG . TYR A 1 157 ? 24.164 88.228 63.252 1.00 44.76 ? 523 TYR A CG 1 ATOM 1120 C CD1 . TYR A 1 157 ? 23.536 88.656 62.091 1.00 43.31 ? 523 TYR A CD1 1 ATOM 1121 C CD2 . TYR A 1 157 ? 24.319 89.137 64.288 1.00 52.12 ? 523 TYR A CD2 1 ATOM 1122 C CE1 . TYR A 1 157 ? 23.076 89.951 61.965 1.00 51.12 ? 523 TYR A CE1 1 ATOM 1123 C CE2 . TYR A 1 157 ? 23.863 90.435 64.172 1.00 59.01 ? 523 TYR A CE2 1 ATOM 1124 C CZ . TYR A 1 157 ? 23.242 90.837 63.008 1.00 59.30 ? 523 TYR A CZ 1 ATOM 1125 O OH . TYR A 1 157 ? 22.785 92.128 62.885 1.00 67.22 ? 523 TYR A OH 1 ATOM 1126 N N . SER A 1 158 ? 24.271 83.872 62.523 1.00 46.18 ? 524 SER A N 1 ATOM 1127 C CA . SER A 1 158 ? 24.914 82.584 62.320 1.00 47.28 ? 524 SER A CA 1 ATOM 1128 C C . SER A 1 158 ? 26.368 82.640 62.765 1.00 52.27 ? 524 SER A C 1 ATOM 1129 O O . SER A 1 158 ? 27.025 83.670 62.615 1.00 56.18 ? 524 SER A O 1 ATOM 1130 C CB . SER A 1 158 ? 24.839 82.176 60.850 1.00 50.71 ? 524 SER A CB 1 ATOM 1131 O OG . SER A 1 158 ? 25.575 80.990 60.607 1.00 57.35 ? 524 SER A OG 1 ATOM 1132 N N . PRO A 1 159 ? 26.879 81.535 63.322 1.00 49.84 ? 525 PRO A N 1 ATOM 1133 C CA . PRO A 1 159 ? 28.309 81.475 63.636 1.00 46.02 ? 525 PRO A CA 1 ATOM 1134 C C . PRO A 1 159 ? 29.163 81.555 62.372 1.00 46.15 ? 525 PRO A C 1 ATOM 1135 O O . PRO A 1 159 ? 30.342 81.908 62.443 1.00 47.36 ? 525 PRO A O 1 ATOM 1136 C CB . PRO A 1 159 ? 28.463 80.112 64.319 1.00 44.93 ? 525 PRO A CB 1 ATOM 1137 C CG . PRO A 1 159 ? 27.098 79.784 64.829 1.00 48.93 ? 525 PRO A CG 1 ATOM 1138 C CD . PRO A 1 159 ? 26.154 80.352 63.812 1.00 50.19 ? 525 PRO A CD 1 ATOM 1139 N N . CYS A 1 160 ? 28.561 81.244 61.226 1.00 41.03 ? 526 CYS A N 1 ATOM 1140 C CA . CYS A 1 160 ? 29.287 81.198 59.963 1.00 38.21 ? 526 CYS A CA 1 ATOM 1141 C C . CYS A 1 160 ? 29.293 82.531 59.218 1.00 42.07 ? 526 CYS A C 1 ATOM 1142 O O . CYS A 1 160 ? 29.768 82.602 58.084 1.00 45.78 ? 526 CYS A O 1 ATOM 1143 C CB . CYS A 1 160 ? 28.701 80.115 59.054 1.00 35.70 ? 526 CYS A CB 1 ATOM 1144 S SG . CYS A 1 160 ? 28.824 78.436 59.708 1.00 50.04 ? 526 CYS A SG 1 ATOM 1145 N N . VAL A 1 161 ? 28.781 83.588 59.843 1.00 40.41 ? 527 VAL A N 1 ATOM 1146 C CA . VAL A 1 161 ? 28.803 84.901 59.200 1.00 41.58 ? 527 VAL A CA 1 ATOM 1147 C C . VAL A 1 161 ? 30.233 85.433 59.103 1.00 47.28 ? 527 VAL A C 1 ATOM 1148 O O . VAL A 1 161 ? 30.501 86.382 58.367 1.00 50.94 ? 527 VAL A O 1 ATOM 1149 C CB . VAL A 1 161 ? 27.930 85.937 59.942 1.00 38.10 ? 527 VAL A CB 1 ATOM 1150 C CG1 . VAL A 1 161 ? 26.485 85.469 60.015 1.00 39.59 ? 527 VAL A CG1 1 ATOM 1151 C CG2 . VAL A 1 161 ? 28.480 86.214 61.329 1.00 39.12 ? 527 VAL A CG2 1 ATOM 1152 N N . SER A 1 162 ? 31.150 84.816 59.843 1.00 46.59 ? 528 SER A N 1 ATOM 1153 C CA . SER A 1 162 ? 32.547 85.237 59.814 1.00 49.42 ? 528 SER A CA 1 ATOM 1154 C C . SER A 1 162 ? 33.294 84.645 58.621 1.00 49.07 ? 528 SER A C 1 ATOM 1155 O O . SER A 1 162 ? 34.331 85.165 58.216 1.00 51.51 ? 528 SER A O 1 ATOM 1156 C CB . SER A 1 162 ? 33.254 84.854 61.117 1.00 46.67 ? 528 SER A CB 1 ATOM 1157 O OG . SER A 1 162 ? 33.327 83.448 61.272 1.00 49.27 ? 528 SER A OG 1 ATOM 1158 N N . ILE A 1 163 ? 32.765 83.566 58.050 1.00 45.83 ? 529 ILE A N 1 ATOM 1159 C CA . ILE A 1 163 ? 33.425 82.926 56.914 1.00 44.61 ? 529 ILE A CA 1 ATOM 1160 C C . ILE A 1 163 ? 32.605 83.037 55.633 1.00 46.91 ? 529 ILE A C 1 ATOM 1161 O O . ILE A 1 163 ? 33.108 82.777 54.539 1.00 48.82 ? 529 ILE A O 1 ATOM 1162 C CB . ILE A 1 163 ? 33.720 81.440 57.193 1.00 41.07 ? 529 ILE A CB 1 ATOM 1163 C CG1 . ILE A 1 163 ? 32.424 80.645 57.312 1.00 35.57 ? 529 ILE A CG1 1 ATOM 1164 C CG2 . ILE A 1 163 ? 34.539 81.299 58.457 1.00 47.98 ? 529 ILE A CG2 1 ATOM 1165 C CD1 . ILE A 1 163 ? 32.656 79.175 57.590 1.00 35.71 ? 529 ILE A CD1 1 ATOM 1166 N N . VAL A 1 164 ? 31.341 83.420 55.770 1.00 51.39 ? 530 VAL A N 1 ATOM 1167 C CA . VAL A 1 164 ? 30.492 83.650 54.609 1.00 45.79 ? 530 VAL A CA 1 ATOM 1168 C C . VAL A 1 164 ? 30.536 85.126 54.230 1.00 44.22 ? 530 VAL A C 1 ATOM 1169 O O . VAL A 1 164 ? 30.296 85.991 55.072 1.00 47.30 ? 530 VAL A O 1 ATOM 1170 C CB . VAL A 1 164 ? 29.038 83.220 54.873 1.00 48.11 ? 530 VAL A CB 1 ATOM 1171 C CG1 . VAL A 1 164 ? 28.135 83.637 53.717 1.00 49.24 ? 530 VAL A CG1 1 ATOM 1172 C CG2 . VAL A 1 164 ? 28.960 81.716 55.100 1.00 44.60 ? 530 VAL A CG2 1 ATOM 1173 N N . PRO A 1 165 ? 30.861 85.420 52.961 1.00 43.95 ? 531 PRO A N 1 ATOM 1174 C CA . PRO A 1 165 ? 30.936 86.806 52.482 1.00 40.33 ? 531 PRO A CA 1 ATOM 1175 C C . PRO A 1 165 ? 29.560 87.464 52.438 1.00 37.89 ? 531 PRO A C 1 ATOM 1176 O O . PRO A 1 165 ? 28.553 86.762 52.473 1.00 36.31 ? 531 PRO A O 1 ATOM 1177 C CB . PRO A 1 165 ? 31.529 86.661 51.078 1.00 37.29 ? 531 PRO A CB 1 ATOM 1178 C CG . PRO A 1 165 ? 31.152 85.283 50.652 1.00 38.04 ? 531 PRO A CG 1 ATOM 1179 C CD . PRO A 1 165 ? 31.172 84.448 51.898 1.00 40.97 ? 531 PRO A CD 1 ATOM 1180 N N . SER A 1 166 ? 29.521 88.790 52.364 1.00 42.14 ? 532 SER A N 1 ATOM 1181 C CA . SER A 1 166 ? 28.255 89.515 52.424 1.00 43.46 ? 532 SER A CA 1 ATOM 1182 C C . SER A 1 166 ? 27.399 89.220 51.199 1.00 44.88 ? 532 SER A C 1 ATOM 1183 O O . SER A 1 166 ? 26.177 89.358 51.233 1.00 47.49 ? 532 SER A O 1 ATOM 1184 C CB . SER A 1 166 ? 28.498 91.020 52.557 1.00 41.96 ? 532 SER A CB 1 ATOM 1185 O OG . SER A 1 166 ? 29.029 91.564 51.367 1.00 45.66 ? 532 SER A OG 1 ATOM 1186 N N . THR A 1 167 ? 28.053 88.815 50.117 1.00 45.00 ? 533 THR A N 1 ATOM 1187 C CA . THR A 1 167 ? 27.361 88.397 48.907 1.00 47.67 ? 533 THR A CA 1 ATOM 1188 C C . THR A 1 167 ? 28.083 87.200 48.302 1.00 43.11 ? 533 THR A C 1 ATOM 1189 O O . THR A 1 167 ? 29.258 87.289 47.950 1.00 39.86 ? 533 THR A O 1 ATOM 1190 C CB . THR A 1 167 ? 27.274 89.535 47.872 1.00 53.13 ? 533 THR A CB 1 ATOM 1191 O OG1 . THR A 1 167 ? 26.464 90.596 48.394 1.00 61.84 ? 533 THR A OG1 1 ATOM 1192 C CG2 . THR A 1 167 ? 26.659 89.032 46.578 1.00 48.48 ? 533 THR A CG2 1 ATOM 1193 N N . VAL A 1 168 ? 27.379 86.078 48.201 1.00 40.63 ? 534 VAL A N 1 ATOM 1194 C CA . VAL A 1 168 ? 27.962 84.855 47.665 1.00 39.11 ? 534 VAL A CA 1 ATOM 1195 C C . VAL A 1 168 ? 28.255 85.005 46.172 1.00 42.14 ? 534 VAL A C 1 ATOM 1196 O O . VAL A 1 168 ? 27.412 85.483 45.411 1.00 42.38 ? 534 VAL A O 1 ATOM 1197 C CB . VAL A 1 168 ? 27.036 83.647 47.903 1.00 36.73 ? 534 VAL A CB 1 ATOM 1198 C CG1 . VAL A 1 168 ? 27.625 82.389 47.287 1.00 34.05 ? 534 VAL A CG1 1 ATOM 1199 C CG2 . VAL A 1 168 ? 26.800 83.450 49.397 1.00 31.04 ? 534 VAL A CG2 1 ATOM 1200 N N . TRP A 1 169 ? 29.459 84.600 45.770 1.00 42.54 ? 535 TRP A N 1 ATOM 1201 C CA . TRP A 1 169 ? 29.922 84.747 44.393 1.00 40.64 ? 535 TRP A CA 1 ATOM 1202 C C . TRP A 1 169 ? 29.238 83.771 43.436 1.00 43.83 ? 535 TRP A C 1 ATOM 1203 O O . TRP A 1 169 ? 28.642 84.181 42.442 1.00 47.36 ? 535 TRP A O 1 ATOM 1204 C CB . TRP A 1 169 ? 31.440 84.562 44.335 1.00 39.22 ? 535 TRP A CB 1 ATOM 1205 C CG . TRP A 1 169 ? 32.041 84.841 42.988 1.00 40.32 ? 535 TRP A CG 1 ATOM 1206 C CD1 . TRP A 1 169 ? 32.540 83.928 42.109 1.00 42.93 ? 535 TRP A CD1 1 ATOM 1207 C CD2 . TRP A 1 169 ? 32.205 86.122 42.371 1.00 46.56 ? 535 TRP A CD2 1 ATOM 1208 N NE1 . TRP A 1 169 ? 33.006 84.558 40.982 1.00 45.89 ? 535 TRP A NE1 1 ATOM 1209 C CE2 . TRP A 1 169 ? 32.812 85.906 41.118 1.00 50.34 ? 535 TRP A CE2 1 ATOM 1210 C CE3 . TRP A 1 169 ? 31.900 87.430 42.757 1.00 54.90 ? 535 TRP A CE3 1 ATOM 1211 C CZ2 . TRP A 1 169 ? 33.119 86.951 40.248 1.00 54.27 ? 535 TRP A CZ2 1 ATOM 1212 C CZ3 . TRP A 1 169 ? 32.205 88.468 41.891 1.00 55.00 ? 535 TRP A CZ3 1 ATOM 1213 C CH2 . TRP A 1 169 ? 32.808 88.221 40.651 1.00 54.60 ? 535 TRP A CH2 1 ATOM 1214 N N . GLU A 1 170 ? 29.333 82.478 43.734 1.00 45.42 ? 536 GLU A N 1 ATOM 1215 C CA . GLU A 1 170 ? 28.673 81.456 42.924 1.00 46.31 ? 536 GLU A CA 1 ATOM 1216 C C . GLU A 1 170 ? 27.789 80.563 43.780 1.00 45.00 ? 536 GLU A C 1 ATOM 1217 O O . GLU A 1 170 ? 28.079 80.324 44.953 1.00 45.44 ? 536 GLU A O 1 ATOM 1218 C CB . GLU A 1 170 ? 29.697 80.593 42.182 1.00 50.30 ? 536 GLU A CB 1 ATOM 1219 C CG . GLU A 1 170 ? 30.573 81.337 41.191 1.00 57.10 ? 536 GLU A CG 1 ATOM 1220 C CD . GLU A 1 170 ? 29.971 81.414 39.803 1.00 68.63 ? 536 GLU A CD 1 ATOM 1221 O OE1 . GLU A 1 170 ? 28.727 81.472 39.687 1.00 75.57 ? 536 GLU A OE1 1 ATOM 1222 O OE2 . GLU A 1 170 ? 30.748 81.411 38.825 1.00 71.46 ? 536 GLU A OE2 1 ATOM 1223 N N . ASP A 1 171 ? 26.715 80.059 43.184 1.00 42.53 ? 537 ASP A N 1 ATOM 1224 C CA . ASP A 1 171 ? 25.796 79.180 43.890 1.00 39.80 ? 537 ASP A CA 1 ATOM 1225 C C . ASP A 1 171 ? 26.476 77.890 44.351 1.00 36.00 ? 537 ASP A C 1 ATOM 1226 O O . ASP A 1 171 ? 27.161 77.228 43.578 1.00 35.47 ? 537 ASP A O 1 ATOM 1227 C CB . ASP A 1 171 ? 24.598 78.848 43.002 1.00 41.25 ? 537 ASP A CB 1 ATOM 1228 C CG . ASP A 1 171 ? 23.568 78.000 43.714 1.00 44.87 ? 537 ASP A CG 1 ATOM 1229 O OD1 . ASP A 1 171 ? 23.275 78.286 44.892 1.00 48.19 ? 537 ASP A OD1 1 ATOM 1230 O OD2 . ASP A 1 171 ? 23.059 77.041 43.100 1.00 51.20 ? 537 ASP A OD2 1 ATOM 1231 N N . GLY A 1 172 ? 26.278 77.544 45.619 1.00 33.60 ? 538 GLY A N 1 ATOM 1232 C CA . GLY A 1 172 ? 26.840 76.331 46.180 1.00 33.79 ? 538 GLY A CA 1 ATOM 1233 C C . GLY A 1 172 ? 28.289 76.478 46.614 1.00 46.68 ? 538 GLY A C 1 ATOM 1234 O O . GLY A 1 172 ? 28.981 75.478 46.826 1.00 42.60 ? 538 GLY A O 1 ATOM 1235 N N . ASP A 1 173 ? 28.747 77.721 46.752 1.00 38.30 ? 539 ASP A N 1 ATOM 1236 C CA . ASP A 1 173 ? 30.131 77.990 47.129 1.00 35.26 ? 539 ASP A CA 1 ATOM 1237 C C . ASP A 1 173 ? 30.473 77.419 48.496 1.00 43.31 ? 539 ASP A C 1 ATOM 1238 O O . ASP A 1 173 ? 29.623 77.318 49.377 1.00 48.35 ? 539 ASP A O 1 ATOM 1239 C CB . ASP A 1 173 ? 30.412 79.492 47.107 1.00 35.99 ? 539 ASP A CB 1 ATOM 1240 C CG . ASP A 1 173 ? 30.914 79.970 45.759 1.00 38.30 ? 539 ASP A CG 1 ATOM 1241 O OD1 . ASP A 1 173 ? 30.869 79.174 44.798 1.00 40.97 ? 539 ASP A OD1 1 ATOM 1242 O OD2 . ASP A 1 173 ? 31.341 81.140 45.657 1.00 39.16 ? 539 ASP A OD2 1 ATOM 1243 N N . TYR A 1 174 ? 31.740 77.057 48.659 1.00 48.96 ? 540 TYR A N 1 ATOM 1244 C CA . TYR A 1 174 ? 32.217 76.389 49.860 1.00 45.25 ? 540 TYR A CA 1 ATOM 1245 C C . TYR A 1 174 ? 33.109 77.306 50.689 1.00 42.74 ? 540 TYR A C 1 ATOM 1246 O O . TYR A 1 174 ? 33.976 77.991 50.151 1.00 41.14 ? 540 TYR A O 1 ATOM 1247 C CB . TYR A 1 174 ? 32.977 75.120 49.476 1.00 48.34 ? 540 TYR A CB 1 ATOM 1248 C CG . TYR A 1 174 ? 33.496 74.315 50.637 1.00 45.96 ? 540 TYR A CG 1 ATOM 1249 C CD1 . TYR A 1 174 ? 32.656 73.931 51.671 1.00 41.59 ? 540 TYR A CD1 1 ATOM 1250 C CD2 . TYR A 1 174 ? 34.826 73.918 50.687 1.00 44.60 ? 540 TYR A CD2 1 ATOM 1251 C CE1 . TYR A 1 174 ? 33.132 73.186 52.733 1.00 40.97 ? 540 TYR A CE1 1 ATOM 1252 C CE2 . TYR A 1 174 ? 35.309 73.175 51.739 1.00 42.00 ? 540 TYR A CE2 1 ATOM 1253 C CZ . TYR A 1 174 ? 34.460 72.811 52.760 1.00 42.68 ? 540 TYR A CZ 1 ATOM 1254 O OH . TYR A 1 174 ? 34.943 72.067 53.810 1.00 46.51 ? 540 TYR A OH 1 ATOM 1255 N N . TYR A 1 175 ? 32.889 77.318 51.999 1.00 37.40 ? 541 TYR A N 1 ATOM 1256 C CA . TYR A 1 175 ? 33.697 78.137 52.892 1.00 38.86 ? 541 TYR A CA 1 ATOM 1257 C C . TYR A 1 175 ? 34.231 77.302 54.044 1.00 39.78 ? 541 TYR A C 1 ATOM 1258 O O . TYR A 1 175 ? 33.502 76.530 54.666 1.00 40.02 ? 541 TYR A O 1 ATOM 1259 C CB . TYR A 1 175 ? 32.890 79.319 53.419 1.00 37.65 ? 541 TYR A CB 1 ATOM 1260 C CG . TYR A 1 175 ? 32.152 80.060 52.331 1.00 40.14 ? 541 TYR A CG 1 ATOM 1261 C CD1 . TYR A 1 175 ? 32.841 80.794 51.376 1.00 34.91 ? 541 TYR A CD1 1 ATOM 1262 C CD2 . TYR A 1 175 ? 30.762 80.029 52.260 1.00 37.02 ? 541 TYR A CD2 1 ATOM 1263 C CE1 . TYR A 1 175 ? 32.168 81.475 50.378 1.00 38.07 ? 541 TYR A CE1 1 ATOM 1264 C CE2 . TYR A 1 175 ? 30.082 80.709 51.269 1.00 36.11 ? 541 TYR A CE2 1 ATOM 1265 C CZ . TYR A 1 175 ? 30.789 81.431 50.330 1.00 39.03 ? 541 TYR A CZ 1 ATOM 1266 O OH . TYR A 1 175 ? 30.113 82.110 49.340 1.00 41.17 ? 541 TYR A OH 1 ATOM 1267 N N . ARG A 1 176 ? 35.516 77.465 54.322 1.00 43.36 ? 542 ARG A N 1 ATOM 1268 C CA . ARG A 1 176 ? 36.194 76.616 55.286 1.00 48.11 ? 542 ARG A CA 1 ATOM 1269 C C . ARG A 1 176 ? 37.261 77.396 56.043 1.00 45.46 ? 542 ARG A C 1 ATOM 1270 O O . ARG A 1 176 ? 38.119 78.041 55.441 1.00 48.32 ? 542 ARG A O 1 ATOM 1271 C CB . ARG A 1 176 ? 36.800 75.405 54.569 1.00 56.04 ? 542 ARG A CB 1 ATOM 1272 C CG . ARG A 1 176 ? 37.930 74.729 55.303 1.00 64.05 ? 542 ARG A CG 1 ATOM 1273 C CD . ARG A 1 176 ? 39.250 74.953 54.580 1.00 64.80 ? 542 ARG A CD 1 ATOM 1274 N NE . ARG A 1 176 ? 39.280 74.313 53.268 1.00 57.03 ? 542 ARG A NE 1 ATOM 1275 C CZ . ARG A 1 176 ? 40.300 74.409 52.423 1.00 58.24 ? 542 ARG A CZ 1 ATOM 1276 N NH1 . ARG A 1 176 ? 41.366 75.123 52.752 1.00 56.78 ? 542 ARG A NH1 1 ATOM 1277 N NH2 . ARG A 1 176 ? 40.255 73.798 51.248 1.00 66.59 ? 542 ARG A NH2 1 ATOM 1278 N N . LYS A 1 177 ? 37.189 77.344 57.367 1.00 43.85 ? 543 LYS A N 1 ATOM 1279 C CA . LYS A 1 177 ? 38.140 78.049 58.218 1.00 43.18 ? 543 LYS A CA 1 ATOM 1280 C C . LYS A 1 177 ? 38.611 77.149 59.352 1.00 43.60 ? 543 LYS A C 1 ATOM 1281 O O . LYS A 1 177 ? 37.800 76.546 60.052 1.00 45.93 ? 543 LYS A O 1 ATOM 1282 C CB . LYS A 1 177 ? 37.509 79.322 58.779 1.00 48.16 ? 543 LYS A CB 1 ATOM 1283 C CG . LYS A 1 177 ? 38.311 80.001 59.878 1.00 51.83 ? 543 LYS A CG 1 ATOM 1284 C CD . LYS A 1 177 ? 37.507 81.144 60.481 1.00 56.96 ? 543 LYS A CD 1 ATOM 1285 C CE . LYS A 1 177 ? 38.225 81.794 61.652 1.00 63.86 ? 543 LYS A CE 1 ATOM 1286 N NZ . LYS A 1 177 ? 37.412 82.897 62.240 1.00 66.07 ? 543 LYS A NZ 1 ATOM 1287 N N . GLN A 1 178 ? 39.925 77.059 59.527 1.00 47.53 ? 544 GLN A N 1 ATOM 1288 C CA . GLN A 1 178 ? 40.494 76.212 60.567 1.00 49.57 ? 544 GLN A CA 1 ATOM 1289 C C . GLN A 1 178 ? 40.456 76.914 61.921 1.00 47.24 ? 544 GLN A C 1 ATOM 1290 O O . GLN A 1 178 ? 40.826 78.078 62.037 1.00 47.74 ? 544 GLN A O 1 ATOM 1291 C CB . GLN A 1 178 ? 41.928 75.818 60.210 1.00 53.81 ? 544 GLN A CB 1 ATOM 1292 C CG . GLN A 1 178 ? 42.524 74.771 61.130 1.00 60.94 ? 544 GLN A CG 1 ATOM 1293 C CD . GLN A 1 178 ? 43.868 74.272 60.645 1.00 73.15 ? 544 GLN A CD 1 ATOM 1294 O OE1 . GLN A 1 178 ? 44.245 74.489 59.493 1.00 77.83 ? 544 GLN A OE1 1 ATOM 1295 N NE2 . GLN A 1 178 ? 44.603 73.601 61.526 1.00 78.77 ? 544 GLN A NE2 1 ATOM 1296 N N . LEU A 1 179 ? 40.008 76.197 62.945 1.00 47.26 ? 545 LEU A N 1 ATOM 1297 C CA . LEU A 1 179 ? 39.838 76.788 64.267 1.00 50.14 ? 545 LEU A CA 1 ATOM 1298 C C . LEU A 1 179 ? 41.008 76.469 65.196 1.00 48.33 ? 545 LEU A C 1 ATOM 1299 O O . LEU A 1 179 ? 41.550 75.364 65.174 1.00 47.88 ? 545 LEU A O 1 ATOM 1300 C CB . LEU A 1 179 ? 38.526 76.313 64.895 1.00 52.77 ? 545 LEU A CB 1 ATOM 1301 C CG . LEU A 1 179 ? 37.250 76.608 64.101 1.00 46.29 ? 545 LEU A CG 1 ATOM 1302 C CD1 . LEU A 1 179 ? 36.023 76.132 64.863 1.00 43.88 ? 545 LEU A CD1 1 ATOM 1303 C CD2 . LEU A 1 179 ? 37.140 78.089 63.774 1.00 43.54 ? 545 LEU A CD2 1 ATOM 1304 N N . SER A 1 180 ? 41.395 77.448 66.008 1.00 40.56 ? 546 SER A N 1 ATOM 1305 C CA . SER A 1 180 ? 42.457 77.258 66.986 1.00 41.35 ? 546 SER A CA 1 ATOM 1306 C C . SER A 1 180 ? 41.953 76.377 68.129 1.00 46.54 ? 546 SER A C 1 ATOM 1307 O O . SER A 1 180 ? 40.743 76.265 68.330 1.00 50.18 ? 546 SER A O 1 ATOM 1308 C CB . SER A 1 180 ? 42.950 78.609 67.517 1.00 42.97 ? 546 SER A CB 1 ATOM 1309 O OG . SER A 1 180 ? 41.940 79.272 68.260 1.00 45.94 ? 546 SER A OG 1 ATOM 1310 N N . PRO A 1 181 ? 42.876 75.731 68.866 1.00 46.48 ? 547 PRO A N 1 ATOM 1311 C CA . PRO A 1 181 ? 42.501 74.919 70.031 1.00 51.40 ? 547 PRO A CA 1 ATOM 1312 C C . PRO A 1 181 ? 41.621 75.681 71.018 1.00 56.29 ? 547 PRO A C 1 ATOM 1313 O O . PRO A 1 181 ? 40.697 75.106 71.594 1.00 57.09 ? 547 PRO A O 1 ATOM 1314 C CB . PRO A 1 181 ? 43.852 74.576 70.662 1.00 51.89 ? 547 PRO A CB 1 ATOM 1315 C CG . PRO A 1 181 ? 44.794 74.564 69.517 1.00 49.61 ? 547 PRO A CG 1 ATOM 1316 C CD . PRO A 1 181 ? 44.318 75.635 68.575 1.00 46.89 ? 547 PRO A CD 1 ATOM 1317 N N . LEU A 1 182 ? 41.909 76.967 71.195 1.00 59.24 ? 548 LEU A N 1 ATOM 1318 C CA . LEU A 1 182 ? 41.130 77.829 72.078 1.00 54.37 ? 548 LEU A CA 1 ATOM 1319 C C . LEU A 1 182 ? 39.688 77.956 71.588 1.00 49.66 ? 548 LEU A C 1 ATOM 1320 O O . LEU A 1 182 ? 38.760 78.057 72.387 1.00 48.87 ? 548 LEU A O 1 ATOM 1321 C CB . LEU A 1 182 ? 41.788 79.210 72.179 1.00 53.54 ? 548 LEU A CB 1 ATOM 1322 C CG . LEU A 1 182 ? 41.343 80.215 73.249 1.00 53.99 ? 548 LEU A CG 1 ATOM 1323 C CD1 . LEU A 1 182 ? 40.240 81.128 72.733 1.00 57.09 ? 548 LEU A CD1 1 ATOM 1324 C CD2 . LEU A 1 182 ? 40.907 79.510 74.527 1.00 53.15 ? 548 LEU A CD2 1 ATOM 1325 N N . GLU A 1 183 ? 39.507 77.944 70.270 1.00 46.69 ? 549 GLU A N 1 ATOM 1326 C CA . GLU A 1 183 ? 38.175 78.045 69.684 1.00 47.97 ? 549 GLU A CA 1 ATOM 1327 C C . GLU A 1 183 ? 37.607 76.667 69.359 1.00 51.20 ? 549 GLU A C 1 ATOM 1328 O O . GLU A 1 183 ? 36.825 76.511 68.423 1.00 56.14 ? 549 GLU A O 1 ATOM 1329 C CB . GLU A 1 183 ? 38.201 78.916 68.427 1.00 48.56 ? 549 GLU A CB 1 ATOM 1330 C CG . GLU A 1 183 ? 38.421 80.398 68.707 1.00 54.03 ? 549 GLU A CG 1 ATOM 1331 C CD . GLU A 1 183 ? 38.326 81.251 67.456 1.00 55.29 ? 549 GLU A CD 1 ATOM 1332 O OE1 . GLU A 1 183 ? 38.141 82.481 67.585 1.00 52.69 ? 549 GLU A OE1 1 ATOM 1333 O OE2 . GLU A 1 183 ? 38.438 80.692 66.345 1.00 57.85 ? 549 GLU A OE2 1 ATOM 1334 N N . GLY A 1 184 ? 38.010 75.670 70.139 1.00 52.14 ? 550 GLY A N 1 ATOM 1335 C CA . GLY A 1 184 ? 37.463 74.334 70.011 1.00 53.19 ? 550 GLY A CA 1 ATOM 1336 C C . GLY A 1 184 ? 38.147 73.468 68.972 1.00 58.41 ? 550 GLY A C 1 ATOM 1337 O O . GLY A 1 184 ? 37.808 72.297 68.818 1.00 67.91 ? 550 GLY A O 1 ATOM 1338 N N . GLY A 1 185 ? 39.108 74.040 68.254 1.00 57.03 ? 551 GLY A N 1 ATOM 1339 C CA . GLY A 1 185 ? 39.839 73.300 67.241 1.00 51.21 ? 551 GLY A CA 1 ATOM 1340 C C . GLY A 1 185 ? 38.962 72.862 66.084 1.00 52.04 ? 551 GLY A C 1 ATOM 1341 O O . GLY A 1 185 ? 37.799 73.252 65.990 1.00 51.46 ? 551 GLY A O 1 ATOM 1342 N N . GLY A 1 186 ? 39.522 72.047 65.196 1.00 49.56 ? 552 GLY A N 1 ATOM 1343 C CA . GLY A 1 186 ? 38.789 71.563 64.042 1.00 43.32 ? 552 GLY A CA 1 ATOM 1344 C C . GLY A 1 186 ? 38.564 72.634 62.989 1.00 44.58 ? 552 GLY A C 1 ATOM 1345 O O . GLY A 1 186 ? 39.455 73.436 62.703 1.00 45.24 ? 552 GLY A O 1 ATOM 1346 N N . TRP A 1 187 ? 37.365 72.646 62.413 1.00 43.32 ? 553 TRP A N 1 ATOM 1347 C CA . TRP A 1 187 ? 37.037 73.573 61.335 1.00 43.69 ? 553 TRP A CA 1 ATOM 1348 C C . TRP A 1 187 ? 35.664 74.214 61.508 1.00 44.58 ? 553 TRP A C 1 ATOM 1349 O O . TRP A 1 187 ? 34.753 73.615 62.080 1.00 37.52 ? 553 TRP A O 1 ATOM 1350 C CB . TRP A 1 187 ? 37.075 72.858 59.981 1.00 45.66 ? 553 TRP A CB 1 ATOM 1351 C CG . TRP A 1 187 ? 38.350 72.130 59.689 1.00 45.90 ? 553 TRP A CG 1 ATOM 1352 C CD1 . TRP A 1 187 ? 38.707 70.891 60.134 1.00 47.31 ? 553 TRP A CD1 1 ATOM 1353 C CD2 . TRP A 1 187 ? 39.428 72.587 58.868 1.00 45.12 ? 553 TRP A CD2 1 ATOM 1354 N NE1 . TRP A 1 187 ? 39.944 70.553 59.649 1.00 48.58 ? 553 TRP A NE1 1 ATOM 1355 C CE2 . TRP A 1 187 ? 40.409 71.578 58.868 1.00 48.62 ? 553 TRP A CE2 1 ATOM 1356 C CE3 . TRP A 1 187 ? 39.660 73.755 58.136 1.00 49.14 ? 553 TRP A CE3 1 ATOM 1357 C CZ2 . TRP A 1 187 ? 41.606 71.701 58.165 1.00 54.97 ? 553 TRP A CZ2 1 ATOM 1358 C CZ3 . TRP A 1 187 ? 40.852 73.876 57.436 1.00 54.64 ? 553 TRP A CZ3 1 ATOM 1359 C CH2 . TRP A 1 187 ? 41.808 72.855 57.457 1.00 54.49 ? 553 TRP A CH2 1 ATOM 1360 N N . LEU A 1 188 ? 35.527 75.438 61.009 1.00 47.65 ? 554 LEU A N 1 ATOM 1361 C CA . LEU A 1 188 ? 34.216 76.042 60.817 1.00 45.35 ? 554 LEU A CA 1 ATOM 1362 C C . LEU A 1 188 ? 33.901 75.994 59.326 1.00 49.85 ? 554 LEU A C 1 ATOM 1363 O O . LEU A 1 188 ? 34.640 76.541 58.504 1.00 52.01 ? 554 LEU A O 1 ATOM 1364 C CB . LEU A 1 188 ? 34.170 77.477 61.341 1.00 42.68 ? 554 LEU A CB 1 ATOM 1365 C CG . LEU A 1 188 ? 32.801 78.161 61.258 1.00 41.58 ? 554 LEU A CG 1 ATOM 1366 C CD1 . LEU A 1 188 ? 31.762 77.388 62.060 1.00 40.47 ? 554 LEU A CD1 1 ATOM 1367 C CD2 . LEU A 1 188 ? 32.878 79.608 61.728 1.00 41.40 ? 554 LEU A CD2 1 ATOM 1368 N N . VAL A 1 189 ? 32.807 75.325 58.981 1.00 47.18 ? 555 VAL A N 1 ATOM 1369 C CA . VAL A 1 189 ? 32.501 75.028 57.589 1.00 47.94 ? 555 VAL A CA 1 ATOM 1370 C C . VAL A 1 189 ? 31.092 75.492 57.220 1.00 45.86 ? 555 VAL A C 1 ATOM 1371 O O . VAL A 1 189 ? 30.144 75.268 57.970 1.00 47.99 ? 555 VAL A O 1 ATOM 1372 C CB . VAL A 1 189 ? 32.654 73.516 57.322 1.00 55.40 ? 555 VAL A CB 1 ATOM 1373 C CG1 . VAL A 1 189 ? 32.080 73.144 55.985 1.00 62.17 ? 555 VAL A CG1 1 ATOM 1374 C CG2 . VAL A 1 189 ? 34.120 73.112 57.397 1.00 52.39 ? 555 VAL A CG2 1 ATOM 1375 N N . ALA A 1 190 ? 30.958 76.151 56.071 1.00 42.40 ? 556 ALA A N 1 ATOM 1376 C CA . ALA A 1 190 ? 29.657 76.645 55.625 1.00 39.04 ? 556 ALA A CA 1 ATOM 1377 C C . ALA A 1 190 ? 29.495 76.578 54.110 1.00 40.70 ? 556 ALA A C 1 ATOM 1378 O O . ALA A 1 190 ? 30.476 76.518 53.369 1.00 41.61 ? 556 ALA A O 1 ATOM 1379 C CB . ALA A 1 190 ? 29.443 78.068 56.102 1.00 32.90 ? 556 ALA A CB 1 ATOM 1380 N N . SER A 1 191 ? 28.244 76.589 53.659 1.00 44.80 ? 557 SER A N 1 ATOM 1381 C CA . SER A 1 191 ? 27.925 76.615 52.233 1.00 41.18 ? 557 SER A CA 1 ATOM 1382 C C . SER A 1 191 ? 26.845 77.657 51.953 1.00 40.75 ? 557 SER A C 1 ATOM 1383 O O . SER A 1 191 ? 25.932 77.847 52.761 1.00 36.59 ? 557 SER A O 1 ATOM 1384 C CB . SER A 1 191 ? 27.470 75.236 51.754 1.00 37.49 ? 557 SER A CB 1 ATOM 1385 O OG . SER A 1 191 ? 27.161 75.253 50.372 1.00 41.13 ? 557 SER A OG 1 ATOM 1386 N N . GLY A 1 192 ? 26.948 78.329 50.810 1.00 38.68 ? 558 GLY A N 1 ATOM 1387 C CA . GLY A 1 192 ? 26.009 79.385 50.470 1.00 36.01 ? 558 GLY A CA 1 ATOM 1388 C C . GLY A 1 192 ? 25.302 79.182 49.144 1.00 36.99 ? 558 GLY A C 1 ATOM 1389 O O . GLY A 1 192 ? 25.870 78.632 48.203 1.00 39.61 ? 558 GLY A O 1 ATOM 1390 N N . SER A 1 193 ? 24.049 79.627 49.076 1.00 35.66 ? 559 SER A N 1 ATOM 1391 C CA . SER A 1 193 ? 23.265 79.569 47.846 1.00 40.48 ? 559 SER A CA 1 ATOM 1392 C C . SER A 1 193 ? 23.025 80.967 47.300 1.00 41.49 ? 559 SER A C 1 ATOM 1393 O O . SER A 1 193 ? 23.101 81.943 48.039 1.00 43.19 ? 559 SER A O 1 ATOM 1394 C CB . SER A 1 193 ? 21.920 78.877 48.086 1.00 41.26 ? 559 SER A CB 1 ATOM 1395 O OG . SER A 1 193 ? 22.088 77.567 48.599 1.00 42.42 ? 559 SER A OG 1 ATOM 1396 N N . THR A 1 194 ? 22.727 81.062 46.008 1.00 44.45 ? 560 THR A N 1 ATOM 1397 C CA . THR A 1 194 ? 22.385 82.348 45.407 1.00 43.23 ? 560 THR A CA 1 ATOM 1398 C C . THR A 1 194 ? 21.014 82.309 44.738 1.00 40.73 ? 560 THR A C 1 ATOM 1399 O O . THR A 1 194 ? 20.560 81.265 44.276 1.00 41.78 ? 560 THR A O 1 ATOM 1400 C CB . THR A 1 194 ? 23.428 82.794 44.360 1.00 45.23 ? 560 THR A CB 1 ATOM 1401 O OG1 . THR A 1 194 ? 23.358 81.939 43.213 1.00 50.76 ? 560 THR A OG1 1 ATOM 1402 C CG2 . THR A 1 194 ? 24.829 82.750 44.939 1.00 51.79 ? 560 THR A CG2 1 ATOM 1403 N N . VAL A 1 195 ? 20.357 83.461 44.708 1.00 39.54 ? 561 VAL A N 1 ATOM 1404 C CA . VAL A 1 195 ? 19.116 83.631 43.967 1.00 43.47 ? 561 VAL A CA 1 ATOM 1405 C C . VAL A 1 195 ? 19.264 84.849 43.070 1.00 43.42 ? 561 VAL A C 1 ATOM 1406 O O . VAL A 1 195 ? 19.695 85.907 43.528 1.00 42.42 ? 561 VAL A O 1 ATOM 1407 C CB . VAL A 1 195 ? 17.896 83.812 44.899 1.00 45.78 ? 561 VAL A CB 1 ATOM 1408 C CG1 . VAL A 1 195 ? 16.625 83.962 44.081 1.00 34.63 ? 561 VAL A CG1 1 ATOM 1409 C CG2 . VAL A 1 195 ? 17.776 82.642 45.858 1.00 32.85 ? 561 VAL A CG2 1 ATOM 1410 N N . ALA A 1 196 ? 18.926 84.696 41.793 1.00 37.10 ? 562 ALA A N 1 ATOM 1411 C CA . ALA A 1 196 ? 19.064 85.785 40.831 1.00 47.46 ? 562 ALA A CA 1 ATOM 1412 C C . ALA A 1 196 ? 18.272 87.010 41.278 1.00 46.00 ? 562 ALA A C 1 ATOM 1413 O O . ALA A 1 196 ? 17.193 86.884 41.857 1.00 48.16 ? 562 ALA A O 1 ATOM 1414 C CB . ALA A 1 196 ? 18.615 85.338 39.449 1.00 40.59 ? 562 ALA A CB 1 ATOM 1415 N N . MET A 1 197 ? 18.817 88.194 41.015 1.00 46.71 ? 563 MET A N 1 ATOM 1416 C CA . MET A 1 197 ? 18.178 89.435 41.436 1.00 45.66 ? 563 MET A CA 1 ATOM 1417 C C . MET A 1 197 ? 16.924 89.722 40.619 1.00 46.59 ? 563 MET A C 1 ATOM 1418 O O . MET A 1 197 ? 16.921 89.610 39.393 1.00 50.66 ? 563 MET A O 1 ATOM 1419 C CB . MET A 1 197 ? 19.161 90.607 41.330 1.00 41.19 ? 563 MET A CB 1 ATOM 1420 C CG . MET A 1 197 ? 18.578 91.962 41.717 1.00 39.39 ? 563 MET A CG 1 ATOM 1421 S SD . MET A 1 197 ? 17.778 91.973 43.341 1.00 43.54 ? 563 MET A SD 1 ATOM 1422 C CE . MET A 1 197 ? 19.119 91.453 44.399 1.00 46.39 ? 563 MET A CE 1 ATOM 1423 N N . THR A 1 198 ? 15.854 90.085 41.313 1.00 45.80 ? 564 THR A N 1 ATOM 1424 C CA . THR A 1 198 ? 14.600 90.439 40.665 1.00 50.49 ? 564 THR A CA 1 ATOM 1425 C C . THR A 1 198 ? 14.704 91.821 40.029 1.00 55.32 ? 564 THR A C 1 ATOM 1426 O O . THR A 1 198 ? 15.635 92.573 40.321 1.00 60.43 ? 564 THR A O 1 ATOM 1427 C CB . THR A 1 198 ? 13.438 90.411 41.664 1.00 47.74 ? 564 THR A CB 1 ATOM 1428 O OG1 . THR A 1 198 ? 13.805 91.153 42.834 1.00 44.35 ? 564 THR A OG1 1 ATOM 1429 C CG2 . THR A 1 198 ? 13.128 88.978 42.065 1.00 46.11 ? 564 THR A CG2 1 ATOM 1430 N N . GLU A 1 199 ? 13.754 92.148 39.157 1.00 53.47 ? 565 GLU A N 1 ATOM 1431 C CA . GLU A 1 199 ? 13.753 93.437 38.471 1.00 58.07 ? 565 GLU A CA 1 ATOM 1432 C C . GLU A 1 199 ? 13.640 94.583 39.469 1.00 59.66 ? 565 GLU A C 1 ATOM 1433 O O . GLU A 1 199 ? 14.342 95.589 39.359 1.00 60.98 ? 565 GLU A O 1 ATOM 1434 C CB . GLU A 1 199 ? 12.615 93.505 37.454 1.00 64.99 ? 565 GLU A CB 1 ATOM 1435 C CG . GLU A 1 199 ? 12.451 94.868 36.805 1.00 74.82 ? 565 GLU A CG 1 ATOM 1436 C CD . GLU A 1 199 ? 11.523 94.832 35.608 1.00 84.10 ? 565 GLU A CD 1 ATOM 1437 O OE1 . GLU A 1 199 ? 10.673 95.740 35.485 1.00 89.29 ? 565 GLU A OE1 1 ATOM 1438 O OE2 . GLU A 1 199 ? 11.648 93.898 34.787 1.00 85.57 ? 565 GLU A OE2 1 ATOM 1439 N N . GLN A 1 200 ? 12.751 94.424 40.443 1.00 56.31 ? 566 GLN A N 1 ATOM 1440 C CA . GLN A 1 200 ? 12.663 95.359 41.555 1.00 54.81 ? 566 GLN A CA 1 ATOM 1441 C C . GLN A 1 200 ? 13.167 94.684 42.824 1.00 48.60 ? 566 GLN A C 1 ATOM 1442 O O . GLN A 1 200 ? 12.907 93.503 43.049 1.00 46.12 ? 566 GLN A O 1 ATOM 1443 C CB . GLN A 1 200 ? 11.228 95.851 41.744 1.00 58.44 ? 566 GLN A CB 1 ATOM 1444 C CG . GLN A 1 200 ? 10.610 96.446 40.493 1.00 63.52 ? 566 GLN A CG 1 ATOM 1445 C CD . GLN A 1 200 ? 9.228 97.007 40.741 1.00 67.04 ? 566 GLN A CD 1 ATOM 1446 O OE1 . GLN A 1 200 ? 8.810 97.174 41.887 1.00 63.70 ? 566 GLN A OE1 1 ATOM 1447 N NE2 . GLN A 1 200 ? 8.508 97.302 39.667 1.00 76.91 ? 566 GLN A NE2 1 ATOM 1448 N N . LEU A 1 201 ? 13.894 95.433 43.648 1.00 49.11 ? 567 LEU A N 1 ATOM 1449 C CA . LEU A 1 201 ? 14.453 94.873 44.872 1.00 41.72 ? 567 LEU A CA 1 ATOM 1450 C C . LEU A 1 201 ? 13.352 94.444 45.833 1.00 48.36 ? 567 LEU A C 1 ATOM 1451 O O . LEU A 1 201 ? 12.399 95.186 46.092 1.00 47.63 ? 567 LEU A O 1 ATOM 1452 C CB . LEU A 1 201 ? 15.379 95.874 45.557 1.00 38.95 ? 567 LEU A CB 1 ATOM 1453 C CG . LEU A 1 201 ? 15.992 95.385 46.873 1.00 45.25 ? 567 LEU A CG 1 ATOM 1454 C CD1 . LEU A 1 201 ? 16.840 94.137 46.652 1.00 38.85 ? 567 LEU A CD1 1 ATOM 1455 C CD2 . LEU A 1 201 ? 16.807 96.484 47.532 1.00 52.62 ? 567 LEU A CD2 1 ATOM 1456 N N . GLN A 1 202 ? 13.489 93.230 46.351 1.00 47.41 ? 568 GLN A N 1 ATOM 1457 C CA . GLN A 1 202 ? 12.521 92.676 47.280 1.00 40.19 ? 568 GLN A CA 1 ATOM 1458 C C . GLN A 1 202 ? 13.187 92.475 48.637 1.00 41.77 ? 568 GLN A C 1 ATOM 1459 O O . GLN A 1 202 ? 14.337 92.037 48.718 1.00 42.07 ? 568 GLN A O 1 ATOM 1460 C CB . GLN A 1 202 ? 11.950 91.367 46.727 1.00 36.83 ? 568 GLN A CB 1 ATOM 1461 C CG . GLN A 1 202 ? 11.137 91.572 45.448 1.00 41.21 ? 568 GLN A CG 1 ATOM 1462 C CD . GLN A 1 202 ? 10.882 90.287 44.686 1.00 45.12 ? 568 GLN A CD 1 ATOM 1463 O OE1 . GLN A 1 202 ? 11.308 89.209 45.099 1.00 49.82 ? 568 GLN A OE1 1 ATOM 1464 N NE2 . GLN A 1 202 ? 10.188 90.398 43.561 1.00 45.00 ? 568 GLN A NE2 1 ATOM 1465 N N . MET A 1 203 ? 12.470 92.820 49.701 1.00 41.42 ? 569 MET A N 1 ATOM 1466 C CA . MET A 1 203 ? 13.043 92.792 51.040 1.00 40.92 ? 569 MET A CA 1 ATOM 1467 C C . MET A 1 203 ? 12.148 92.080 52.041 1.00 46.90 ? 569 MET A C 1 ATOM 1468 O O . MET A 1 203 ? 10.972 91.815 51.777 1.00 47.54 ? 569 MET A O 1 ATOM 1469 C CB . MET A 1 203 ? 13.311 94.211 51.536 1.00 41.37 ? 569 MET A CB 1 ATOM 1470 C CG . MET A 1 203 ? 14.179 95.053 50.623 1.00 45.16 ? 569 MET A CG 1 ATOM 1471 S SD . MET A 1 203 ? 14.360 96.723 51.260 1.00 53.49 ? 569 MET A SD 1 ATOM 1472 C CE . MET A 1 203 ? 15.056 96.378 52.876 1.00 43.67 ? 569 MET A CE 1 ATOM 1473 N N . GLY A 1 204 ? 12.724 91.778 53.198 1.00 41.44 ? 570 GLY A N 1 ATOM 1474 C CA . GLY A 1 204 ? 11.979 91.207 54.299 1.00 36.09 ? 570 GLY A CA 1 ATOM 1475 C C . GLY A 1 204 ? 12.174 92.078 55.521 1.00 38.51 ? 570 GLY A C 1 ATOM 1476 O O . GLY A 1 204 ? 13.246 92.654 55.717 1.00 43.37 ? 570 GLY A O 1 ATOM 1477 N N . PHE A 1 205 ? 11.132 92.187 56.335 1.00 36.71 ? 571 PHE A N 1 ATOM 1478 C CA . PHE A 1 205 ? 11.196 92.969 57.559 1.00 35.07 ? 571 PHE A CA 1 ATOM 1479 C C . PHE A 1 205 ? 10.746 92.129 58.740 1.00 38.86 ? 571 PHE A C 1 ATOM 1480 O O . PHE A 1 205 ? 9.654 91.558 58.728 1.00 44.64 ? 571 PHE A O 1 ATOM 1481 C CB . PHE A 1 205 ? 10.331 94.225 57.450 1.00 39.10 ? 571 PHE A CB 1 ATOM 1482 C CG . PHE A 1 205 ? 10.696 95.115 56.297 1.00 46.73 ? 571 PHE A CG 1 ATOM 1483 C CD1 . PHE A 1 205 ? 11.685 96.072 56.430 1.00 48.94 ? 571 PHE A CD1 1 ATOM 1484 C CD2 . PHE A 1 205 ? 10.043 95.001 55.082 1.00 50.57 ? 571 PHE A CD2 1 ATOM 1485 C CE1 . PHE A 1 205 ? 12.019 96.895 55.373 1.00 48.19 ? 571 PHE A CE1 1 ATOM 1486 C CE2 . PHE A 1 205 ? 10.374 95.823 54.019 1.00 47.50 ? 571 PHE A CE2 1 ATOM 1487 C CZ . PHE A 1 205 ? 11.361 96.769 54.164 1.00 44.91 ? 571 PHE A CZ 1 ATOM 1488 N N . GLY A 1 206 ? 11.593 92.048 59.757 1.00 38.30 ? 572 GLY A N 1 ATOM 1489 C CA . GLY A 1 206 ? 11.256 91.323 60.966 1.00 37.35 ? 572 GLY A CA 1 ATOM 1490 C C . GLY A 1 206 ? 11.064 92.287 62.118 1.00 43.11 ? 572 GLY A C 1 ATOM 1491 O O . GLY A 1 206 ? 12.003 92.981 62.518 1.00 42.66 ? 572 GLY A O 1 ATOM 1492 N N . ILE A 1 207 ? 9.842 92.344 62.642 1.00 39.45 ? 573 ILE A N 1 ATOM 1493 C CA . ILE A 1 207 ? 9.544 93.205 63.778 1.00 39.60 ? 573 ILE A CA 1 ATOM 1494 C C . ILE A 1 207 ? 9.335 92.382 65.042 1.00 44.65 ? 573 ILE A C 1 ATOM 1495 O O . ILE A 1 207 ? 8.642 91.367 65.025 1.00 46.09 ? 573 ILE A O 1 ATOM 1496 C CB . ILE A 1 207 ? 8.289 94.068 63.530 1.00 43.31 ? 573 ILE A CB 1 ATOM 1497 C CG1 . ILE A 1 207 ? 8.441 94.889 62.249 1.00 45.32 ? 573 ILE A CG1 1 ATOM 1498 C CG2 . ILE A 1 207 ? 8.037 94.994 64.708 1.00 41.14 ? 573 ILE A CG2 1 ATOM 1499 C CD1 . ILE A 1 207 ? 7.237 95.757 61.943 1.00 48.70 ? 573 ILE A CD1 1 ATOM 1500 N N . THR A 1 208 ? 9.945 92.825 66.136 1.00 47.66 ? 574 THR A N 1 ATOM 1501 C CA . THR A 1 208 ? 9.734 92.200 67.433 1.00 44.95 ? 574 THR A CA 1 ATOM 1502 C C . THR A 1 208 ? 9.481 93.273 68.481 1.00 44.22 ? 574 THR A C 1 ATOM 1503 O O . THR A 1 208 ? 10.247 94.231 68.599 1.00 45.40 ? 574 THR A O 1 ATOM 1504 C CB . THR A 1 208 ? 10.936 91.338 67.859 1.00 44.26 ? 574 THR A CB 1 ATOM 1505 O OG1 . THR A 1 208 ? 11.249 90.404 66.818 1.00 47.02 ? 574 THR A OG1 1 ATOM 1506 C CG2 . THR A 1 208 ? 10.627 90.583 69.143 1.00 39.27 ? 574 THR A CG2 1 ATOM 1507 N N . VAL A 1 209 ? 8.394 93.117 69.230 1.00 39.06 ? 575 VAL A N 1 ATOM 1508 C CA . VAL A 1 209 ? 8.065 94.054 70.294 1.00 40.91 ? 575 VAL A CA 1 ATOM 1509 C C . VAL A 1 209 ? 8.125 93.367 71.649 1.00 42.70 ? 575 VAL A C 1 ATOM 1510 O O . VAL A 1 209 ? 7.952 92.153 71.757 1.00 45.34 ? 575 VAL A O 1 ATOM 1511 C CB . VAL A 1 209 ? 6.665 94.675 70.107 1.00 54.33 ? 575 VAL A CB 1 ATOM 1512 C CG1 . VAL A 1 209 ? 6.613 95.497 68.827 1.00 40.04 ? 575 VAL A CG1 1 ATOM 1513 C CG2 . VAL A 1 209 ? 5.594 93.589 70.108 1.00 41.75 ? 575 VAL A CG2 1 ATOM 1514 N N . GLN A 1 210 ? 8.374 94.157 72.684 1.00 49.20 ? 576 GLN A N 1 ATOM 1515 C CA . GLN A 1 210 ? 8.440 93.637 74.037 1.00 54.55 ? 576 GLN A CA 1 ATOM 1516 C C . GLN A 1 210 ? 7.718 94.582 74.985 1.00 56.03 ? 576 GLN A C 1 ATOM 1517 O O . GLN A 1 210 ? 8.067 95.755 75.086 1.00 66.58 ? 576 GLN A O 1 ATOM 1518 C CB . GLN A 1 210 ? 9.896 93.443 74.462 1.00 62.16 ? 576 GLN A CB 1 ATOM 1519 C CG . GLN A 1 210 ? 10.080 92.763 75.804 1.00 72.27 ? 576 GLN A CG 1 ATOM 1520 C CD . GLN A 1 210 ? 11.529 92.400 76.067 1.00 77.49 ? 576 GLN A CD 1 ATOM 1521 O OE1 . GLN A 1 210 ? 12.355 92.395 75.152 1.00 72.43 ? 576 GLN A OE1 1 ATOM 1522 N NE2 . GLN A 1 210 ? 11.846 92.096 77.321 1.00 83.04 ? 576 GLN A NE2 1 ATOM 1523 N N . TYR A 1 211 ? 6.698 94.072 75.665 1.00 52.05 ? 577 TYR A N 1 ATOM 1524 C CA . TYR A 1 211 ? 5.945 94.877 76.619 1.00 57.21 ? 577 TYR A CA 1 ATOM 1525 C C . TYR A 1 211 ? 6.641 94.914 77.974 1.00 59.57 ? 577 TYR A C 1 ATOM 1526 O O . TYR A 1 211 ? 7.347 93.978 78.345 1.00 60.25 ? 577 TYR A O 1 ATOM 1527 C CB . TYR A 1 211 ? 4.523 94.338 76.781 1.00 54.14 ? 577 TYR A CB 1 ATOM 1528 C CG . TYR A 1 211 ? 3.635 94.516 75.570 1.00 52.31 ? 577 TYR A CG 1 ATOM 1529 C CD1 . TYR A 1 211 ? 3.589 93.554 74.569 1.00 50.29 ? 577 TYR A CD1 1 ATOM 1530 C CD2 . TYR A 1 211 ? 2.830 95.640 75.434 1.00 52.83 ? 577 TYR A CD2 1 ATOM 1531 C CE1 . TYR A 1 211 ? 2.768 93.707 73.464 1.00 51.54 ? 577 TYR A CE1 1 ATOM 1532 C CE2 . TYR A 1 211 ? 2.007 95.804 74.334 1.00 51.33 ? 577 TYR A CE2 1 ATOM 1533 C CZ . TYR A 1 211 ? 1.980 94.834 73.351 1.00 56.07 ? 577 TYR A CZ 1 ATOM 1534 O OH . TYR A 1 211 ? 1.163 94.993 72.255 1.00 55.39 ? 577 TYR A OH 1 ATOM 1535 N N . GLY A 1 212 ? 6.435 96.000 78.710 1.00 63.94 ? 578 GLY A N 1 ATOM 1536 C CA . GLY A 1 212 ? 6.990 96.134 80.043 1.00 70.64 ? 578 GLY A CA 1 ATOM 1537 C C . GLY A 1 212 ? 5.918 96.435 81.071 1.00 81.08 ? 578 GLY A C 1 ATOM 1538 O O . GLY A 1 212 ? 4.796 95.932 80.980 1.00 80.94 ? 578 GLY A O 1 ATOM 1539 N N . THR A 1 213 ? 6.262 97.264 82.051 1.00 89.75 ? 579 THR A N 1 ATOM 1540 C CA . THR A 1 213 ? 5.320 97.647 83.095 1.00 96.44 ? 579 THR A CA 1 ATOM 1541 C C . THR A 1 213 ? 5.075 99.155 83.082 1.00 101.20 ? 579 THR A C 1 ATOM 1542 O O . THR A 1 213 ? 3.935 99.606 82.958 1.00 104.04 ? 579 THR A O 1 ATOM 1543 C CB . THR A 1 213 ? 5.821 97.224 84.488 1.00 100.89 ? 579 THR A CB 1 ATOM 1544 O OG1 . THR A 1 213 ? 6.272 95.865 84.445 1.00 99.18 ? 579 THR A OG1 1 ATOM 1545 C CG2 . THR A 1 213 ? 4.709 97.353 85.521 1.00 106.62 ? 579 THR A CG2 1 ATOM 1546 N N . ASP A 1 214 ? 6.149 99.929 83.213 1.00 103.88 ? 580 ASP A N 1 ATOM 1547 C CA . ASP A 1 214 ? 6.057 101.387 83.207 1.00 106.44 ? 580 ASP A CA 1 ATOM 1548 C C . ASP A 1 214 ? 6.812 101.995 82.028 1.00 102.40 ? 580 ASP A C 1 ATOM 1549 O O . ASP A 1 214 ? 6.562 103.135 81.640 1.00 103.30 ? 580 ASP A O 1 ATOM 1550 C CB . ASP A 1 214 ? 6.604 101.969 84.515 1.00 113.09 ? 580 ASP A CB 1 ATOM 1551 C CG . ASP A 1 214 ? 5.745 101.625 85.717 1.00 118.88 ? 580 ASP A CG 1 ATOM 1552 O OD1 . ASP A 1 214 ? 5.181 100.513 85.753 1.00 117.86 ? 580 ASP A OD1 1 ATOM 1553 O OD2 . ASP A 1 214 ? 5.638 102.470 86.632 1.00 124.05 ? 580 ASP A OD2 1 ATOM 1554 N N . THR A 1 215 ? 7.735 101.226 81.463 1.00 98.53 ? 581 THR A N 1 ATOM 1555 C CA . THR A 1 215 ? 8.640 101.741 80.442 1.00 95.68 ? 581 THR A CA 1 ATOM 1556 C C . THR A 1 215 ? 8.099 101.599 79.020 1.00 89.93 ? 581 THR A C 1 ATOM 1557 O O . THR A 1 215 ? 8.870 101.594 78.060 1.00 86.00 ? 581 THR A O 1 ATOM 1558 C CB . THR A 1 215 ? 10.010 101.039 80.514 1.00 95.64 ? 581 THR A CB 1 ATOM 1559 O OG1 . THR A 1 215 ? 9.824 99.619 80.456 1.00 93.73 ? 581 THR A OG1 1 ATOM 1560 C CG2 . THR A 1 215 ? 10.720 101.394 81.810 1.00 100.63 ? 581 THR A CG2 1 ATOM 1561 N N . ASN A 1 216 ? 6.779 101.493 78.884 1.00 85.22 ? 582 ASN A N 1 ATOM 1562 C CA . ASN A 1 216 ? 6.162 101.369 77.565 1.00 73.84 ? 582 ASN A CA 1 ATOM 1563 C C . ASN A 1 216 ? 6.088 102.709 76.838 1.00 65.88 ? 582 ASN A C 1 ATOM 1564 O O . ASN A 1 216 ? 5.029 103.331 76.773 1.00 65.88 ? 582 ASN A O 1 ATOM 1565 C CB . ASN A 1 216 ? 4.763 100.763 77.684 1.00 66.57 ? 582 ASN A CB 1 ATOM 1566 C CG . ASN A 1 216 ? 4.791 99.314 78.130 1.00 62.62 ? 582 ASN A CG 1 ATOM 1567 O OD1 . ASN A 1 216 ? 5.750 98.591 77.866 1.00 61.56 ? 582 ASN A OD1 1 ATOM 1568 N ND2 . ASN A 1 216 ? 3.735 98.883 78.810 1.00 65.24 ? 582 ASN A ND2 1 ATOM 1569 N N . SER A 1 217 ? 7.216 103.141 76.282 1.00 59.52 ? 583 SER A N 1 ATOM 1570 C CA . SER A 1 217 ? 7.321 104.480 75.707 1.00 61.04 ? 583 SER A CA 1 ATOM 1571 C C . SER A 1 217 ? 7.419 104.491 74.183 1.00 58.45 ? 583 SER A C 1 ATOM 1572 O O . SER A 1 217 ? 7.500 105.556 73.573 1.00 61.72 ? 583 SER A O 1 ATOM 1573 C CB . SER A 1 217 ? 8.530 105.206 76.299 1.00 66.57 ? 583 SER A CB 1 ATOM 1574 O OG . SER A 1 217 ? 8.380 105.388 77.697 1.00 73.76 ? 583 SER A OG 1 ATOM 1575 N N . VAL A 1 218 ? 7.417 103.314 73.570 1.00 52.68 ? 584 VAL A N 1 ATOM 1576 C CA . VAL A 1 218 ? 7.427 103.228 72.115 1.00 50.15 ? 584 VAL A CA 1 ATOM 1577 C C . VAL A 1 218 ? 5.994 103.174 71.601 1.00 49.50 ? 584 VAL A C 1 ATOM 1578 O O . VAL A 1 218 ? 5.437 102.101 71.388 1.00 48.28 ? 584 VAL A O 1 ATOM 1579 C CB . VAL A 1 218 ? 8.211 102.003 71.617 1.00 48.00 ? 584 VAL A CB 1 ATOM 1580 C CG1 . VAL A 1 218 ? 8.420 102.089 70.113 1.00 45.83 ? 584 VAL A CG1 1 ATOM 1581 C CG2 . VAL A 1 218 ? 9.546 101.909 72.332 1.00 48.90 ? 584 VAL A CG2 1 ATOM 1582 N N . CYS A 1 219 ? 5.408 104.350 71.407 1.00 55.89 ? 585 CYS A N 1 ATOM 1583 C CA . CYS A 1 219 ? 3.982 104.469 71.122 1.00 50.52 ? 585 CYS A CA 1 ATOM 1584 C C . CYS A 1 219 ? 3.708 104.935 69.698 1.00 48.98 ? 585 CYS A C 1 ATOM 1585 O O . CYS A 1 219 ? 4.542 105.600 69.090 1.00 58.89 ? 585 CYS A O 1 ATOM 1586 C CB . CYS A 1 219 ? 3.336 105.431 72.123 1.00 53.30 ? 585 CYS A CB 1 ATOM 1587 S SG . CYS A 1 219 ? 3.381 104.835 73.821 1.00 60.95 ? 585 CYS A SG 1 ATOM 1588 N N . PRO A 1 220 ? 2.533 104.578 69.155 1.00 54.08 ? 586 PRO A N 1 ATOM 1589 C CA . PRO A 1 220 ? 2.170 105.029 67.809 1.00 54.74 ? 586 PRO A CA 1 ATOM 1590 C C . PRO A 1 220 ? 1.951 106.535 67.754 1.00 58.47 ? 586 PRO A C 1 ATOM 1591 O O . PRO A 1 220 ? 1.352 107.107 68.663 1.00 62.21 ? 586 PRO A O 1 ATOM 1592 C CB . PRO A 1 220 ? 0.867 104.276 67.525 1.00 50.73 ? 586 PRO A CB 1 ATOM 1593 C CG . PRO A 1 220 ? 0.299 104.000 68.872 1.00 49.60 ? 586 PRO A CG 1 ATOM 1594 C CD . PRO A 1 220 ? 1.483 103.732 69.750 1.00 53.67 ? 586 PRO A CD 1 ATOM 1595 N N . LYS A 1 221 ? 2.442 107.165 66.694 1.00 60.60 ? 587 LYS A N 1 ATOM 1596 C CA . LYS A 1 221 ? 2.283 108.600 66.509 1.00 61.45 ? 587 LYS A CA 1 ATOM 1597 C C . LYS A 1 221 ? 0.814 108.952 66.288 1.00 59.50 ? 587 LYS A C 1 ATOM 1598 O O . LYS A 1 221 ? 0.228 108.590 65.268 1.00 56.91 ? 587 LYS A O 1 ATOM 1599 C CB . LYS A 1 221 ? 3.131 109.079 65.329 1.00 65.32 ? 587 LYS A CB 1 ATOM 1600 C CG . LYS A 1 221 ? 3.173 110.582 65.151 1.00 77.96 ? 587 LYS A CG 1 ATOM 1601 C CD . LYS A 1 221 ? 3.974 110.963 63.915 1.00 83.93 ? 587 LYS A CD 1 ATOM 1602 C CE . LYS A 1 221 ? 3.946 112.465 63.681 1.00 91.18 ? 587 LYS A CE 1 ATOM 1603 N NZ . LYS A 1 221 ? 4.646 112.842 62.423 1.00 95.03 ? 587 LYS A NZ 1 ATOM 1604 N N . LEU A 1 222 ? 0.219 109.646 67.255 1.00 60.11 ? 588 LEU A N 1 ATOM 1605 C CA . LEU A 1 222 ? -1.178 110.057 67.155 1.00 64.97 ? 588 LEU A CA 1 ATOM 1606 C C . LEU A 1 222 ? -1.313 111.308 66.294 1.00 71.26 ? 588 LEU A C 1 ATOM 1607 O O . LEU A 1 222 ? -0.350 112.055 66.117 1.00 74.32 ? 588 LEU A O 1 ATOM 1608 C CB . LEU A 1 222 ? -1.769 110.305 68.545 1.00 66.22 ? 588 LEU A CB 1 ATOM 1609 C CG . LEU A 1 222 ? -1.681 109.144 69.538 1.00 65.35 ? 588 LEU A CG 1 ATOM 1610 C CD1 . LEU A 1 222 ? -2.306 109.531 70.871 1.00 63.32 ? 588 LEU A CD1 1 ATOM 1611 C CD2 . LEU A 1 222 ? -2.337 107.893 68.971 1.00 64.98 ? 588 LEU A CD2 1 ATOM 1612 N N . GLU A 1 223 ? -2.509 111.537 65.763 1.00 73.54 ? 589 GLU A N 1 ATOM 1613 C CA . GLU A 1 223 ? -2.723 112.642 64.838 1.00 76.79 ? 589 GLU A CA 1 ATOM 1614 C C . GLU A 1 223 ? -3.554 113.750 65.474 1.00 73.96 ? 589 GLU A C 1 ATOM 1615 O O . GLU A 1 223 ? -4.560 113.485 66.127 1.00 74.26 ? 589 GLU A O 1 ATOM 1616 C CB . GLU A 1 223 ? -3.393 112.138 63.559 1.00 84.85 ? 589 GLU A CB 1 ATOM 1617 C CG . GLU A 1 223 ? -3.269 113.090 62.382 1.00 95.27 ? 589 GLU A CG 1 ATOM 1618 C CD . GLU A 1 223 ? -3.318 112.374 61.046 1.00 97.41 ? 589 GLU A CD 1 ATOM 1619 O OE1 . GLU A 1 223 ? -3.579 111.151 61.033 1.00 95.53 ? 589 GLU A OE1 1 ATOM 1620 O OE2 . GLU A 1 223 ? -3.090 113.034 60.009 1.00 100.06 ? 589 GLU A OE2 1 ATOM 1621 N N . PHE A 1 224 ? -3.123 114.992 65.276 1.00 71.77 ? 590 PHE A N 1 ATOM 1622 C CA . PHE A 1 224 ? -3.769 116.141 65.902 1.00 71.63 ? 590 PHE A CA 1 ATOM 1623 C C . PHE A 1 224 ? -4.214 117.170 64.867 1.00 74.30 ? 590 PHE A C 1 ATOM 1624 O O . PHE A 1 224 ? -3.887 117.058 63.687 1.00 79.38 ? 590 PHE A O 1 ATOM 1625 C CB . PHE A 1 224 ? -2.826 116.798 66.915 1.00 70.48 ? 590 PHE A CB 1 ATOM 1626 C CG . PHE A 1 224 ? -2.431 115.899 68.055 1.00 67.47 ? 590 PHE A CG 1 ATOM 1627 C CD1 . PHE A 1 224 ? -3.124 115.933 69.253 1.00 65.11 ? 590 PHE A CD1 1 ATOM 1628 C CD2 . PHE A 1 224 ? -1.360 115.025 67.930 1.00 67.51 ? 590 PHE A CD2 1 ATOM 1629 C CE1 . PHE A 1 224 ? -2.761 115.111 70.303 1.00 65.19 ? 590 PHE A CE1 1 ATOM 1630 C CE2 . PHE A 1 224 ? -0.994 114.199 68.977 1.00 61.48 ? 590 PHE A CE2 1 ATOM 1631 C CZ . PHE A 1 224 ? -1.696 114.244 70.165 1.00 63.36 ? 590 PHE A CZ 1 ATOM 1632 N N . ALA A 1 225 ? -4.956 118.176 65.319 1.00 75.92 ? 591 ALA A N 1 ATOM 1633 C CA . ALA A 1 225 ? -5.439 119.229 64.434 1.00 77.71 ? 591 ALA A CA 1 ATOM 1634 C C . ALA A 1 225 ? -4.294 120.122 63.967 1.00 82.87 ? 591 ALA A C 1 ATOM 1635 O O . ALA A 1 225 ? -4.482 121.315 63.723 1.00 87.13 ? 591 ALA A O 1 ATOM 1636 C CB . ALA A 1 225 ? -6.506 120.059 65.131 1.00 78.63 ? 591 ALA A CB 1 ATOM 1637 N N . GLN B 2 1 ? 50.388 64.351 54.027 1.00 113.27 ? 1 GLN H N 1 ATOM 1638 C CA . GLN B 2 1 ? 50.680 63.856 52.688 1.00 107.33 ? 1 GLN H CA 1 ATOM 1639 C C . GLN B 2 1 ? 49.703 62.759 52.277 1.00 98.02 ? 1 GLN H C 1 ATOM 1640 O O . GLN B 2 1 ? 50.087 61.603 52.099 1.00 96.28 ? 1 GLN H O 1 ATOM 1641 C CB . GLN B 2 1 ? 52.120 63.339 52.607 1.00 111.68 ? 1 GLN H CB 1 ATOM 1642 C CG . GLN B 2 1 ? 53.174 64.433 52.709 1.00 122.12 ? 1 GLN H CG 1 ATOM 1643 C CD . GLN B 2 1 ? 54.593 63.896 52.658 1.00 127.51 ? 1 GLN H CD 1 ATOM 1644 O OE1 . GLN B 2 1 ? 54.821 62.693 52.794 1.00 129.37 ? 1 GLN H OE1 1 ATOM 1645 N NE2 . GLN B 2 1 ? 55.558 64.789 52.460 1.00 129.61 ? 1 GLN H NE2 1 ATOM 1646 N N . VAL B 2 2 ? 48.436 63.132 52.132 1.00 90.31 ? 2 VAL H N 1 ATOM 1647 C CA . VAL B 2 2 ? 47.414 62.207 51.663 1.00 73.71 ? 2 VAL H CA 1 ATOM 1648 C C . VAL B 2 2 ? 47.597 61.947 50.171 1.00 60.97 ? 2 VAL H C 1 ATOM 1649 O O . VAL B 2 2 ? 48.035 62.827 49.430 1.00 56.13 ? 2 VAL H O 1 ATOM 1650 C CB . VAL B 2 2 ? 45.996 62.754 51.929 1.00 72.83 ? 2 VAL H CB 1 ATOM 1651 C CG1 . VAL B 2 2 ? 44.953 61.674 51.696 1.00 69.69 ? 2 VAL H CG1 1 ATOM 1652 C CG2 . VAL B 2 2 ? 45.893 63.290 53.349 1.00 79.89 ? 2 VAL H CG2 1 ATOM 1653 N N . GLN B 2 3 ? 47.276 60.731 49.737 1.00 56.58 ? 3 GLN H N 1 ATOM 1654 C CA . GLN B 2 3 ? 47.361 60.371 48.326 1.00 50.06 ? 3 GLN H CA 1 ATOM 1655 C C . GLN B 2 3 ? 45.974 60.132 47.740 1.00 43.02 ? 3 GLN H C 1 ATOM 1656 O O . GLN B 2 3 ? 45.026 59.827 48.463 1.00 43.53 ? 3 GLN H O 1 ATOM 1657 C CB . GLN B 2 3 ? 48.225 59.123 48.135 1.00 52.48 ? 3 GLN H CB 1 ATOM 1658 C CG . GLN B 2 3 ? 49.579 59.178 48.815 1.00 63.98 ? 3 GLN H CG 1 ATOM 1659 C CD . GLN B 2 3 ? 50.334 57.869 48.691 1.00 72.96 ? 3 GLN H CD 1 ATOM 1660 O OE1 . GLN B 2 3 ? 50.937 57.392 49.653 1.00 79.51 ? 3 GLN H OE1 1 ATOM 1661 N NE2 . GLN B 2 3 ? 50.303 57.278 47.501 1.00 72.91 ? 3 GLN H NE2 1 ATOM 1662 N N . LEU B 2 4 ? 45.866 60.272 46.424 1.00 39.20 ? 4 LEU H N 1 ATOM 1663 C CA . LEU B 2 4 ? 44.610 60.043 45.721 1.00 39.73 ? 4 LEU H CA 1 ATOM 1664 C C . LEU B 2 4 ? 44.746 58.861 44.769 1.00 42.57 ? 4 LEU H C 1 ATOM 1665 O O . LEU B 2 4 ? 45.465 58.938 43.775 1.00 48.41 ? 4 LEU H O 1 ATOM 1666 C CB . LEU B 2 4 ? 44.188 61.300 44.956 1.00 36.75 ? 4 LEU H CB 1 ATOM 1667 C CG . LEU B 2 4 ? 43.124 62.209 45.583 1.00 40.43 ? 4 LEU H CG 1 ATOM 1668 C CD1 . LEU B 2 4 ? 43.304 62.346 47.087 1.00 42.34 ? 4 LEU H CD1 1 ATOM 1669 C CD2 . LEU B 2 4 ? 43.116 63.578 44.907 1.00 39.10 ? 4 LEU H CD2 1 ATOM 1670 N N . VAL B 2 5 ? 44.060 57.766 45.077 1.00 39.42 ? 5 VAL H N 1 ATOM 1671 C CA . VAL B 2 5 ? 44.159 56.558 44.267 1.00 43.59 ? 5 VAL H CA 1 ATOM 1672 C C . VAL B 2 5 ? 42.896 56.331 43.441 1.00 44.78 ? 5 VAL H C 1 ATOM 1673 O O . VAL B 2 5 ? 41.805 56.197 43.989 1.00 50.48 ? 5 VAL H O 1 ATOM 1674 C CB . VAL B 2 5 ? 44.425 55.322 45.143 1.00 43.64 ? 5 VAL H CB 1 ATOM 1675 C CG1 . VAL B 2 5 ? 44.471 54.064 44.291 1.00 46.37 ? 5 VAL H CG1 1 ATOM 1676 C CG2 . VAL B 2 5 ? 45.720 55.495 45.915 1.00 36.52 ? 5 VAL H CG2 1 ATOM 1677 N N . GLN B 2 6 ? 43.054 56.289 42.120 1.00 43.67 ? 6 GLN H N 1 ATOM 1678 C CA . GLN B 2 6 ? 41.922 56.135 41.210 1.00 43.61 ? 6 GLN H CA 1 ATOM 1679 C C . GLN B 2 6 ? 41.780 54.702 40.706 1.00 42.72 ? 6 GLN H C 1 ATOM 1680 O O . GLN B 2 6 ? 42.731 53.922 40.744 1.00 41.26 ? 6 GLN H O 1 ATOM 1681 C CB . GLN B 2 6 ? 42.056 57.087 40.015 1.00 36.84 ? 6 GLN H CB 1 ATOM 1682 C CG . GLN B 2 6 ? 42.265 58.544 40.394 1.00 34.52 ? 6 GLN H CG 1 ATOM 1683 C CD . GLN B 2 6 ? 42.268 59.467 39.190 1.00 36.21 ? 6 GLN H CD 1 ATOM 1684 O OE1 . GLN B 2 6 ? 42.945 60.494 39.182 1.00 35.75 ? 6 GLN H OE1 1 ATOM 1685 N NE2 . GLN B 2 6 ? 41.500 59.108 38.167 1.00 38.70 ? 6 GLN H NE2 1 ATOM 1686 N N . SER B 2 7 ? 40.586 54.368 40.226 1.00 41.10 ? 7 SER H N 1 ATOM 1687 C CA . SER B 2 7 ? 40.310 53.042 39.678 1.00 40.01 ? 7 SER H CA 1 ATOM 1688 C C . SER B 2 7 ? 41.017 52.829 38.338 1.00 36.67 ? 7 SER H C 1 ATOM 1689 O O . SER B 2 7 ? 41.462 53.783 37.703 1.00 32.80 ? 7 SER H O 1 ATOM 1690 C CB . SER B 2 7 ? 38.800 52.834 39.519 1.00 39.90 ? 7 SER H CB 1 ATOM 1691 O OG . SER B 2 7 ? 38.251 53.756 38.594 1.00 41.80 ? 7 SER H OG 1 ATOM 1692 N N . GLY B 2 8 ? 41.102 51.571 37.911 1.00 41.97 ? 8 GLY H N 1 ATOM 1693 C CA . GLY B 2 8 ? 41.842 51.203 36.714 1.00 39.33 ? 8 GLY H CA 1 ATOM 1694 C C . GLY B 2 8 ? 41.243 51.690 35.407 1.00 39.16 ? 8 GLY H C 1 ATOM 1695 O O . GLY B 2 8 ? 40.187 52.316 35.394 1.00 41.87 ? 8 GLY H O 1 ATOM 1696 N N . ALA B 2 9 ? 41.926 51.390 34.304 1.00 40.62 ? 9 ALA H N 1 ATOM 1697 C CA . ALA B 2 9 ? 41.514 51.841 32.975 1.00 39.55 ? 9 ALA H CA 1 ATOM 1698 C C . ALA B 2 9 ? 40.156 51.272 32.571 1.00 44.95 ? 9 ALA H C 1 ATOM 1699 O O . ALA B 2 9 ? 39.730 50.236 33.079 1.00 47.34 ? 9 ALA H O 1 ATOM 1700 C CB . ALA B 2 9 ? 42.566 51.469 31.942 1.00 34.98 ? 9 ALA H CB 1 ATOM 1701 N N . GLU B 2 10 ? 39.487 51.958 31.647 1.00 44.56 ? 10 GLU H N 1 ATOM 1702 C CA . GLU B 2 10 ? 38.138 51.585 31.231 1.00 45.72 ? 10 GLU H CA 1 ATOM 1703 C C . GLU B 2 10 ? 37.983 51.541 29.715 1.00 47.08 ? 10 GLU H C 1 ATOM 1704 O O . GLU B 2 10 ? 38.417 52.451 29.010 1.00 48.07 ? 10 GLU H O 1 ATOM 1705 C CB . GLU B 2 10 ? 37.118 52.563 31.817 1.00 40.55 ? 10 GLU H CB 1 ATOM 1706 C CG . GLU B 2 10 ? 37.014 52.519 33.325 1.00 40.75 ? 10 GLU H CG 1 ATOM 1707 C CD . GLU B 2 10 ? 36.177 51.359 33.815 1.00 44.05 ? 10 GLU H CD 1 ATOM 1708 O OE1 . GLU B 2 10 ? 35.692 50.575 32.973 1.00 53.88 ? 10 GLU H OE1 1 ATOM 1709 O OE2 . GLU B 2 10 ? 35.999 51.234 35.042 1.00 45.70 ? 10 GLU H OE2 1 ATOM 1710 N N . VAL B 2 11 ? 37.352 50.481 29.219 1.00 42.68 ? 11 VAL H N 1 ATOM 1711 C CA . VAL B 2 11 ? 37.078 50.356 27.794 1.00 43.82 ? 11 VAL H CA 1 ATOM 1712 C C . VAL B 2 11 ? 35.571 50.259 27.574 1.00 47.94 ? 11 VAL H C 1 ATOM 1713 O O . VAL B 2 11 ? 34.929 49.308 28.022 1.00 54.08 ? 11 VAL H O 1 ATOM 1714 C CB . VAL B 2 11 ? 37.781 49.128 27.184 1.00 43.51 ? 11 VAL H CB 1 ATOM 1715 C CG1 . VAL B 2 11 ? 37.789 49.222 25.670 1.00 42.05 ? 11 VAL H CG1 1 ATOM 1716 C CG2 . VAL B 2 11 ? 39.200 49.020 27.713 1.00 45.58 ? 11 VAL H CG2 1 ATOM 1717 N N . LYS B 2 12 ? 35.007 51.247 26.888 1.00 46.06 ? 12 LYS H N 1 ATOM 1718 C CA . LYS B 2 12 ? 33.557 51.344 26.768 1.00 48.82 ? 12 LYS H CA 1 ATOM 1719 C C . LYS B 2 12 ? 33.081 51.487 25.326 1.00 50.21 ? 12 LYS H C 1 ATOM 1720 O O . LYS B 2 12 ? 33.787 52.032 24.477 1.00 50.84 ? 12 LYS H O 1 ATOM 1721 C CB . LYS B 2 12 ? 33.048 52.526 27.597 1.00 46.99 ? 12 LYS H CB 1 ATOM 1722 C CG . LYS B 2 12 ? 33.259 52.378 29.097 1.00 44.57 ? 12 LYS H CG 1 ATOM 1723 C CD . LYS B 2 12 ? 32.374 51.284 29.673 1.00 48.25 ? 12 LYS H CD 1 ATOM 1724 C CE . LYS B 2 12 ? 32.547 51.178 31.177 1.00 50.24 ? 12 LYS H CE 1 ATOM 1725 N NZ . LYS B 2 12 ? 31.719 50.083 31.753 1.00 52.44 ? 12 LYS H NZ 1 ATOM 1726 N N . LYS B 2 13 ? 31.876 50.989 25.059 1.00 51.39 ? 13 LYS H N 1 ATOM 1727 C CA . LYS B 2 13 ? 31.251 51.153 23.755 1.00 51.66 ? 13 LYS H CA 1 ATOM 1728 C C . LYS B 2 13 ? 30.576 52.518 23.682 1.00 48.26 ? 13 LYS H C 1 ATOM 1729 O O . LYS B 2 13 ? 30.189 53.074 24.710 1.00 49.06 ? 13 LYS H O 1 ATOM 1730 C CB . LYS B 2 13 ? 30.235 50.038 23.496 1.00 60.85 ? 13 LYS H CB 1 ATOM 1731 C CG . LYS B 2 13 ? 30.817 48.635 23.539 1.00 66.74 ? 13 LYS H CG 1 ATOM 1732 C CD . LYS B 2 13 ? 31.922 48.455 22.511 1.00 68.22 ? 13 LYS H CD 1 ATOM 1733 C CE . LYS B 2 13 ? 32.518 47.058 22.589 1.00 70.84 ? 13 LYS H CE 1 ATOM 1734 N NZ . LYS B 2 13 ? 33.718 46.915 21.722 1.00 74.49 ? 13 LYS H NZ 1 ATOM 1735 N N . PRO B 2 14 ? 30.444 53.072 22.468 1.00 48.25 ? 14 PRO H N 1 ATOM 1736 C CA . PRO B 2 14 ? 29.780 54.369 22.299 1.00 50.88 ? 14 PRO H CA 1 ATOM 1737 C C . PRO B 2 14 ? 28.337 54.338 22.789 1.00 55.02 ? 14 PRO H C 1 ATOM 1738 O O . PRO B 2 14 ? 27.576 53.468 22.372 1.00 50.49 ? 14 PRO H O 1 ATOM 1739 C CB . PRO B 2 14 ? 29.834 54.599 20.786 1.00 48.70 ? 14 PRO H CB 1 ATOM 1740 C CG . PRO B 2 14 ? 30.979 53.768 20.317 1.00 49.03 ? 14 PRO H CG 1 ATOM 1741 C CD . PRO B 2 14 ? 30.978 52.557 21.195 1.00 48.53 ? 14 PRO H CD 1 ATOM 1742 N N . GLY B 2 15 ? 27.976 55.267 23.670 1.00 53.64 ? 15 GLY H N 1 ATOM 1743 C CA . GLY B 2 15 ? 26.617 55.356 24.175 1.00 51.78 ? 15 GLY H CA 1 ATOM 1744 C C . GLY B 2 15 ? 26.458 54.811 25.581 1.00 52.25 ? 15 GLY H C 1 ATOM 1745 O O . GLY B 2 15 ? 25.421 55.002 26.216 1.00 51.22 ? 15 GLY H O 1 ATOM 1746 N N . SER B 2 16 ? 27.490 54.128 26.068 1.00 51.70 ? 16 SER H N 1 ATOM 1747 C CA . SER B 2 16 ? 27.463 53.548 27.406 1.00 53.98 ? 16 SER H CA 1 ATOM 1748 C C . SER B 2 16 ? 27.932 54.559 28.451 1.00 54.77 ? 16 SER H C 1 ATOM 1749 O O . SER B 2 16 ? 28.120 55.736 28.146 1.00 42.26 ? 16 SER H O 1 ATOM 1750 C CB . SER B 2 16 ? 28.330 52.289 27.466 1.00 45.71 ? 16 SER H CB 1 ATOM 1751 O OG . SER B 2 16 ? 29.695 52.603 27.250 1.00 55.01 ? 16 SER H OG 1 ATOM 1752 N N . SER B 2 17 ? 28.115 54.094 29.683 1.00 43.28 ? 17 SER H N 1 ATOM 1753 C CA . SER B 2 17 ? 28.539 54.965 30.770 1.00 44.53 ? 17 SER H CA 1 ATOM 1754 C C . SER B 2 17 ? 29.739 54.389 31.520 1.00 50.39 ? 17 SER H C 1 ATOM 1755 O O . SER B 2 17 ? 29.997 53.185 31.474 1.00 54.78 ? 17 SER H O 1 ATOM 1756 C CB . SER B 2 17 ? 27.383 55.208 31.742 1.00 45.05 ? 17 SER H CB 1 ATOM 1757 O OG . SER B 2 17 ? 27.020 54.013 32.407 1.00 52.13 ? 17 SER H OG 1 ATOM 1758 N N . VAL B 2 18 ? 30.468 55.262 32.208 1.00 48.76 ? 18 VAL H N 1 ATOM 1759 C CA . VAL B 2 18 ? 31.636 54.861 32.982 1.00 46.73 ? 18 VAL H CA 1 ATOM 1760 C C . VAL B 2 18 ? 31.611 55.555 34.345 1.00 47.50 ? 18 VAL H C 1 ATOM 1761 O O . VAL B 2 18 ? 31.106 56.670 34.471 1.00 48.76 ? 18 VAL H O 1 ATOM 1762 C CB . VAL B 2 18 ? 32.955 55.194 32.229 1.00 43.66 ? 18 VAL H CB 1 ATOM 1763 C CG1 . VAL B 2 18 ? 33.117 56.701 32.057 1.00 32.37 ? 18 VAL H CG1 1 ATOM 1764 C CG2 . VAL B 2 18 ? 34.159 54.600 32.942 1.00 35.87 ? 18 VAL H CG2 1 ATOM 1765 N N . LYS B 2 19 ? 32.135 54.885 35.367 1.00 46.14 ? 19 LYS H N 1 ATOM 1766 C CA . LYS B 2 19 ? 32.196 55.465 36.704 1.00 44.25 ? 19 LYS H CA 1 ATOM 1767 C C . LYS B 2 19 ? 33.569 55.248 37.329 1.00 42.65 ? 19 LYS H C 1 ATOM 1768 O O . LYS B 2 19 ? 33.945 54.121 37.653 1.00 44.87 ? 19 LYS H O 1 ATOM 1769 C CB . LYS B 2 19 ? 31.101 54.873 37.595 1.00 46.08 ? 19 LYS H CB 1 ATOM 1770 C CG . LYS B 2 19 ? 30.918 55.583 38.926 1.00 45.64 ? 19 LYS H CG 1 ATOM 1771 C CD . LYS B 2 19 ? 29.754 54.984 39.703 1.00 52.13 ? 19 LYS H CD 1 ATOM 1772 C CE . LYS B 2 19 ? 29.479 55.747 40.985 1.00 55.27 ? 19 LYS H CE 1 ATOM 1773 N NZ . LYS B 2 19 ? 28.337 55.158 41.734 1.00 61.73 ? 19 LYS H NZ 1 ATOM 1774 N N . VAL B 2 20 ? 34.311 56.339 37.488 1.00 44.39 ? 20 VAL H N 1 ATOM 1775 C CA . VAL B 2 20 ? 35.670 56.299 38.019 1.00 40.75 ? 20 VAL H CA 1 ATOM 1776 C C . VAL B 2 20 ? 35.686 56.652 39.503 1.00 44.17 ? 20 VAL H C 1 ATOM 1777 O O . VAL B 2 20 ? 35.028 57.603 39.922 1.00 48.08 ? 20 VAL H O 1 ATOM 1778 C CB . VAL B 2 20 ? 36.591 57.273 37.256 1.00 41.65 ? 20 VAL H CB 1 ATOM 1779 C CG1 . VAL B 2 20 ? 38.013 57.202 37.788 1.00 42.65 ? 20 VAL H CG1 1 ATOM 1780 C CG2 . VAL B 2 20 ? 36.556 56.983 35.761 1.00 41.51 ? 20 VAL H CG2 1 ATOM 1781 N N . SER B 2 21 ? 36.432 55.890 40.298 1.00 45.92 ? 21 SER H N 1 ATOM 1782 C CA . SER B 2 21 ? 36.540 56.169 41.729 1.00 46.66 ? 21 SER H CA 1 ATOM 1783 C C . SER B 2 21 ? 37.836 56.910 42.056 1.00 46.97 ? 21 SER H C 1 ATOM 1784 O O . SER B 2 21 ? 38.811 56.841 41.309 1.00 45.12 ? 21 SER H O 1 ATOM 1785 C CB . SER B 2 21 ? 36.453 54.878 42.546 1.00 50.79 ? 21 SER H CB 1 ATOM 1786 O OG . SER B 2 21 ? 37.529 54.008 42.251 1.00 55.57 ? 21 SER H OG 1 ATOM 1787 N N . CYS B 2 22 ? 37.821 57.623 43.178 1.00 48.51 ? 22 CYS H N 1 ATOM 1788 C CA . CYS B 2 22 ? 38.955 58.417 43.641 1.00 44.99 ? 22 CYS H CA 1 ATOM 1789 C C . CYS B 2 22 ? 39.012 58.347 45.164 1.00 49.46 ? 22 CYS H C 1 ATOM 1790 O O . CYS B 2 22 ? 38.296 59.075 45.850 1.00 53.25 ? 22 CYS H O 1 ATOM 1791 C CB . CYS B 2 22 ? 38.827 59.869 43.162 1.00 49.34 ? 22 CYS H CB 1 ATOM 1792 S SG . CYS B 2 22 ? 40.049 61.039 43.828 1.00 39.42 ? 22 CYS H SG 1 ATOM 1793 N N . LYS B 2 23 ? 39.846 57.457 45.693 1.00 48.29 ? 23 LYS H N 1 ATOM 1794 C CA . LYS B 2 23 ? 39.874 57.224 47.134 1.00 53.77 ? 23 LYS H CA 1 ATOM 1795 C C . LYS B 2 23 ? 41.085 57.867 47.799 1.00 53.44 ? 23 LYS H C 1 ATOM 1796 O O . LYS B 2 23 ? 42.199 57.813 47.277 1.00 46.47 ? 23 LYS H O 1 ATOM 1797 C CB . LYS B 2 23 ? 39.852 55.721 47.436 1.00 55.76 ? 23 LYS H CB 1 ATOM 1798 C CG . LYS B 2 23 ? 39.697 55.392 48.915 1.00 61.95 ? 23 LYS H CG 1 ATOM 1799 C CD . LYS B 2 23 ? 39.427 53.914 49.139 1.00 63.45 ? 23 LYS H CD 1 ATOM 1800 C CE . LYS B 2 23 ? 39.189 53.615 50.611 1.00 63.41 ? 23 LYS H CE 1 ATOM 1801 N NZ . LYS B 2 23 ? 38.872 52.179 50.835 1.00 66.31 ? 23 LYS H NZ 1 ATOM 1802 N N . ALA B 2 24 ? 40.856 58.481 48.955 1.00 56.72 ? 24 ALA H N 1 ATOM 1803 C CA . ALA B 2 24 ? 41.941 59.044 49.743 1.00 54.93 ? 24 ALA H CA 1 ATOM 1804 C C . ALA B 2 24 ? 42.746 57.920 50.383 1.00 61.35 ? 24 ALA H C 1 ATOM 1805 O O . ALA B 2 24 ? 42.192 57.067 51.074 1.00 65.54 ? 24 ALA H O 1 ATOM 1806 C CB . ALA B 2 24 ? 41.401 59.988 50.801 1.00 51.31 ? 24 ALA H CB 1 ATOM 1807 N N . SER B 2 25 ? 44.053 57.916 50.140 1.00 64.85 ? 25 SER H N 1 ATOM 1808 C CA . SER B 2 25 ? 44.931 56.890 50.691 1.00 67.16 ? 25 SER H CA 1 ATOM 1809 C C . SER B 2 25 ? 45.949 57.494 51.649 1.00 68.90 ? 25 SER H C 1 ATOM 1810 O O . SER B 2 25 ? 46.582 58.503 51.338 1.00 67.61 ? 25 SER H O 1 ATOM 1811 C CB . SER B 2 25 ? 45.651 56.138 49.571 1.00 68.71 ? 25 SER H CB 1 ATOM 1812 O OG . SER B 2 25 ? 46.520 55.152 50.102 1.00 75.77 ? 25 SER H OG 1 ATOM 1813 N N . GLY B 2 26 ? 46.106 56.870 52.811 1.00 71.86 ? 26 GLY H N 1 ATOM 1814 C CA . GLY B 2 26 ? 47.014 57.371 53.826 1.00 72.67 ? 26 GLY H CA 1 ATOM 1815 C C . GLY B 2 26 ? 46.566 58.719 54.354 1.00 72.26 ? 26 GLY H C 1 ATOM 1816 O O . GLY B 2 26 ? 47.386 59.597 54.622 1.00 72.21 ? 26 GLY H O 1 ATOM 1817 N N . GLY B 2 27 ? 45.255 58.885 54.497 1.00 68.21 ? 27 GLY H N 1 ATOM 1818 C CA . GLY B 2 27 ? 44.695 60.127 54.994 1.00 66.99 ? 27 GLY H CA 1 ATOM 1819 C C . GLY B 2 27 ? 43.193 60.206 54.803 1.00 67.03 ? 27 GLY H C 1 ATOM 1820 O O . GLY B 2 27 ? 42.514 59.185 54.689 1.00 68.96 ? 27 GLY H O 1 ATOM 1821 N N . THR B 2 28 ? 42.672 61.426 54.766 1.00 63.73 ? 28 THR H N 1 ATOM 1822 C CA . THR B 2 28 ? 41.239 61.636 54.616 1.00 63.38 ? 28 THR H CA 1 ATOM 1823 C C . THR B 2 28 ? 40.957 62.867 53.766 1.00 57.00 ? 28 THR H C 1 ATOM 1824 O O . THR B 2 28 ? 41.857 63.662 53.493 1.00 50.28 ? 28 THR H O 1 ATOM 1825 C CB . THR B 2 28 ? 40.548 61.788 55.987 1.00 68.07 ? 28 THR H CB 1 ATOM 1826 O OG1 . THR B 2 28 ? 39.172 62.136 55.798 1.00 71.31 ? 28 THR H OG1 1 ATOM 1827 C CG2 . THR B 2 28 ? 41.228 62.870 56.814 1.00 68.26 ? 28 THR H CG2 1 ATOM 1828 N N . PHE B 2 29 ? 39.705 63.016 53.343 1.00 56.58 ? 29 PHE H N 1 ATOM 1829 C CA . PHE B 2 29 ? 39.294 64.189 52.580 1.00 51.32 ? 29 PHE H CA 1 ATOM 1830 C C . PHE B 2 29 ? 39.284 65.435 53.460 1.00 49.25 ? 29 PHE H C 1 ATOM 1831 O O . PHE B 2 29 ? 39.435 66.550 52.966 1.00 44.95 ? 29 PHE H O 1 ATOM 1832 C CB . PHE B 2 29 ? 37.912 63.976 51.956 1.00 49.89 ? 29 PHE H CB 1 ATOM 1833 C CG . PHE B 2 29 ? 37.932 63.157 50.694 1.00 49.67 ? 29 PHE H CG 1 ATOM 1834 C CD1 . PHE B 2 29 ? 39.119 62.931 50.015 1.00 49.48 ? 29 PHE H CD1 1 ATOM 1835 C CD2 . PHE B 2 29 ? 36.762 62.619 50.183 1.00 50.95 ? 29 PHE H CD2 1 ATOM 1836 C CE1 . PHE B 2 29 ? 39.139 62.180 48.852 1.00 46.91 ? 29 PHE H CE1 1 ATOM 1837 C CE2 . PHE B 2 29 ? 36.774 61.869 49.021 1.00 51.04 ? 29 PHE H CE2 1 ATOM 1838 C CZ . PHE B 2 29 ? 37.966 61.647 48.355 1.00 48.34 ? 29 PHE H CZ 1 ATOM 1839 N N . SER B 2 30 ? 39.112 65.227 54.763 1.00 60.51 ? 30 SER H N 1 ATOM 1840 C CA . SER B 2 30 ? 39.019 66.313 55.736 1.00 63.26 ? 30 SER H CA 1 ATOM 1841 C C . SER B 2 30 ? 37.940 67.319 55.335 1.00 60.08 ? 30 SER H C 1 ATOM 1842 O O . SER B 2 30 ? 36.789 66.947 55.108 1.00 60.21 ? 30 SER H O 1 ATOM 1843 C CB . SER B 2 30 ? 40.371 67.015 55.895 1.00 64.86 ? 30 SER H CB 1 ATOM 1844 O OG . SER B 2 30 ? 40.339 67.949 56.960 1.00 71.29 ? 30 SER H OG 1 ATOM 1845 N N . SER B 2 31 ? 38.319 68.589 55.237 1.00 54.60 ? 31 SER H N 1 ATOM 1846 C CA . SER B 2 31 ? 37.380 69.638 54.853 1.00 53.74 ? 31 SER H CA 1 ATOM 1847 C C . SER B 2 31 ? 37.667 70.164 53.449 1.00 45.28 ? 31 SER H C 1 ATOM 1848 O O . SER B 2 31 ? 37.345 71.307 53.130 1.00 43.89 ? 31 SER H O 1 ATOM 1849 C CB . SER B 2 31 ? 37.425 70.790 55.862 1.00 62.31 ? 31 SER H CB 1 ATOM 1850 O OG . SER B 2 31 ? 38.697 71.416 55.868 1.00 67.09 ? 31 SER H OG 1 ATOM 1851 N N . TYR B 2 32 ? 38.262 69.321 52.611 1.00 39.93 ? 32 TYR H N 1 ATOM 1852 C CA . TYR B 2 32 ? 38.689 69.735 51.280 1.00 39.62 ? 32 TYR H CA 1 ATOM 1853 C C . TYR B 2 32 ? 37.757 69.249 50.171 1.00 38.30 ? 32 TYR H C 1 ATOM 1854 O O . TYR B 2 32 ? 37.205 68.152 50.241 1.00 40.53 ? 32 TYR H O 1 ATOM 1855 C CB . TYR B 2 32 ? 40.111 69.235 51.006 1.00 41.60 ? 32 TYR H CB 1 ATOM 1856 C CG . TYR B 2 32 ? 41.156 69.805 51.939 1.00 42.82 ? 32 TYR H CG 1 ATOM 1857 C CD1 . TYR B 2 32 ? 41.831 70.975 51.624 1.00 43.25 ? 32 TYR H CD1 1 ATOM 1858 C CD2 . TYR B 2 32 ? 41.467 69.172 53.134 1.00 46.43 ? 32 TYR H CD2 1 ATOM 1859 C CE1 . TYR B 2 32 ? 42.787 71.500 52.475 1.00 46.04 ? 32 TYR H CE1 1 ATOM 1860 C CE2 . TYR B 2 32 ? 42.421 69.689 53.992 1.00 46.31 ? 32 TYR H CE2 1 ATOM 1861 C CZ . TYR B 2 32 ? 43.077 70.852 53.656 1.00 50.58 ? 32 TYR H CZ 1 ATOM 1862 O OH . TYR B 2 32 ? 44.026 71.368 54.507 1.00 62.59 ? 32 TYR H OH 1 ATOM 1863 N N . ALA B 2 33 ? 37.598 70.078 49.144 1.00 37.51 ? 33 ALA H N 1 ATOM 1864 C CA . ALA B 2 33 ? 36.776 69.736 47.990 1.00 36.92 ? 33 ALA H CA 1 ATOM 1865 C C . ALA B 2 33 ? 37.573 68.910 46.984 1.00 43.55 ? 33 ALA H C 1 ATOM 1866 O O . ALA B 2 33 ? 38.804 68.970 46.953 1.00 43.81 ? 33 ALA H O 1 ATOM 1867 C CB . ALA B 2 33 ? 36.235 70.996 47.333 1.00 30.74 ? 33 ALA H CB 1 ATOM 1868 N N . ILE B 2 34 ? 36.867 68.138 46.164 1.00 46.81 ? 34 ILE H N 1 ATOM 1869 C CA . ILE B 2 34 ? 37.510 67.284 45.169 1.00 45.07 ? 34 ILE H CA 1 ATOM 1870 C C . ILE B 2 34 ? 36.992 67.605 43.769 1.00 45.57 ? 34 ILE H C 1 ATOM 1871 O O . ILE B 2 34 ? 35.797 67.495 43.504 1.00 44.95 ? 34 ILE H O 1 ATOM 1872 C CB . ILE B 2 34 ? 37.273 65.789 45.472 1.00 39.06 ? 34 ILE H CB 1 ATOM 1873 C CG1 . ILE B 2 34 ? 37.895 65.412 46.819 1.00 42.37 ? 34 ILE H CG1 1 ATOM 1874 C CG2 . ILE B 2 34 ? 37.831 64.918 44.354 1.00 36.43 ? 34 ILE H CG2 1 ATOM 1875 C CD1 . ILE B 2 34 ? 39.400 65.605 46.879 1.00 43.02 ? 34 ILE H CD1 1 ATOM 1876 N N . SER B 2 35 ? 37.891 68.010 42.877 1.00 41.15 ? 35 SER H N 1 ATOM 1877 C CA . SER B 2 35 ? 37.504 68.317 41.505 1.00 39.05 ? 35 SER H CA 1 ATOM 1878 C C . SER B 2 35 ? 37.879 67.189 40.558 1.00 35.92 ? 35 SER H C 1 ATOM 1879 O O . SER B 2 35 ? 38.622 66.278 40.917 1.00 34.35 ? 35 SER H O 1 ATOM 1880 C CB . SER B 2 35 ? 38.146 69.625 41.036 1.00 37.84 ? 35 SER H CB 1 ATOM 1881 O OG . SER B 2 35 ? 37.428 70.748 41.515 1.00 45.83 ? 35 SER H OG 1 ATOM 1882 N N . TRP B 2 36 ? 37.347 67.261 39.344 1.00 35.85 ? 36 TRP H N 1 ATOM 1883 C CA . TRP B 2 36 ? 37.680 66.307 38.300 1.00 34.25 ? 36 TRP H CA 1 ATOM 1884 C C . TRP B 2 36 ? 38.145 67.037 37.049 1.00 33.64 ? 36 TRP H C 1 ATOM 1885 O O . TRP B 2 36 ? 37.573 68.053 36.657 1.00 34.12 ? 36 TRP H O 1 ATOM 1886 C CB . TRP B 2 36 ? 36.486 65.413 37.980 1.00 35.42 ? 36 TRP H CB 1 ATOM 1887 C CG . TRP B 2 36 ? 36.170 64.431 39.061 1.00 43.07 ? 36 TRP H CG 1 ATOM 1888 C CD1 . TRP B 2 36 ? 35.335 64.619 40.121 1.00 45.92 ? 36 TRP H CD1 1 ATOM 1889 C CD2 . TRP B 2 36 ? 36.684 63.099 39.185 1.00 45.63 ? 36 TRP H CD2 1 ATOM 1890 N NE1 . TRP B 2 36 ? 35.295 63.486 40.898 1.00 48.55 ? 36 TRP H NE1 1 ATOM 1891 C CE2 . TRP B 2 36 ? 36.115 62.538 40.345 1.00 46.97 ? 36 TRP H CE2 1 ATOM 1892 C CE3 . TRP B 2 36 ? 37.568 62.325 38.425 1.00 42.60 ? 36 TRP H CE3 1 ATOM 1893 C CZ2 . TRP B 2 36 ? 36.401 61.240 40.765 1.00 48.40 ? 36 TRP H CZ2 1 ATOM 1894 C CZ3 . TRP B 2 36 ? 37.851 61.036 38.843 1.00 47.17 ? 36 TRP H CZ3 1 ATOM 1895 C CH2 . TRP B 2 36 ? 37.268 60.507 40.002 1.00 52.05 ? 36 TRP H CH2 1 ATOM 1896 N N . VAL B 2 37 ? 39.198 66.511 36.436 1.00 31.92 ? 37 VAL H N 1 ATOM 1897 C CA . VAL B 2 37 ? 39.778 67.096 35.239 1.00 32.80 ? 37 VAL H CA 1 ATOM 1898 C C . VAL B 2 37 ? 40.053 65.982 34.236 1.00 35.99 ? 37 VAL H C 1 ATOM 1899 O O . VAL B 2 37 ? 40.499 64.902 34.621 1.00 41.18 ? 37 VAL H O 1 ATOM 1900 C CB . VAL B 2 37 ? 41.082 67.861 35.565 1.00 33.99 ? 37 VAL H CB 1 ATOM 1901 C CG1 . VAL B 2 37 ? 41.780 68.321 34.295 1.00 32.83 ? 37 VAL H CG1 1 ATOM 1902 C CG2 . VAL B 2 37 ? 40.793 69.046 36.484 1.00 40.04 ? 37 VAL H CG2 1 ATOM 1903 N N . ARG B 2 38 ? 39.765 66.219 32.960 1.00 29.98 ? 38 ARG H N 1 ATOM 1904 C CA . ARG B 2 38 ? 40.097 65.232 31.938 1.00 33.94 ? 38 ARG H CA 1 ATOM 1905 C C . ARG B 2 38 ? 41.077 65.807 30.924 1.00 33.59 ? 38 ARG H C 1 ATOM 1906 O O . ARG B 2 38 ? 41.233 67.022 30.813 1.00 30.86 ? 38 ARG H O 1 ATOM 1907 C CB . ARG B 2 38 ? 38.836 64.724 31.226 1.00 38.70 ? 38 ARG H CB 1 ATOM 1908 C CG . ARG B 2 38 ? 38.288 65.657 30.162 1.00 35.34 ? 38 ARG H CG 1 ATOM 1909 C CD . ARG B 2 38 ? 37.121 65.022 29.425 1.00 37.42 ? 38 ARG H CD 1 ATOM 1910 N NE . ARG B 2 38 ? 36.645 65.867 28.335 1.00 39.77 ? 38 ARG H NE 1 ATOM 1911 C CZ . ARG B 2 38 ? 35.616 65.570 27.550 1.00 43.39 ? 38 ARG H CZ 1 ATOM 1912 N NH1 . ARG B 2 38 ? 34.940 64.443 27.732 1.00 45.07 ? 38 ARG H NH1 1 ATOM 1913 N NH2 . ARG B 2 38 ? 35.259 66.405 26.584 1.00 49.76 ? 38 ARG H NH2 1 ATOM 1914 N N . GLN B 2 39 ? 41.741 64.921 30.192 1.00 35.31 ? 39 GLN H N 1 ATOM 1915 C CA . GLN B 2 39 ? 42.692 65.325 29.163 1.00 34.46 ? 39 GLN H CA 1 ATOM 1916 C C . GLN B 2 39 ? 42.670 64.336 28.003 1.00 38.29 ? 39 GLN H C 1 ATOM 1917 O O . GLN B 2 39 ? 42.995 63.162 28.169 1.00 40.19 ? 39 GLN H O 1 ATOM 1918 C CB . GLN B 2 39 ? 44.106 65.435 29.748 1.00 32.08 ? 39 GLN H CB 1 ATOM 1919 C CG . GLN B 2 39 ? 45.149 65.980 28.784 1.00 32.28 ? 39 GLN H CG 1 ATOM 1920 C CD . GLN B 2 39 ? 46.501 66.176 29.443 1.00 35.61 ? 39 GLN H CD 1 ATOM 1921 O OE1 . GLN B 2 39 ? 46.858 65.459 30.376 1.00 37.78 ? 39 GLN H OE1 1 ATOM 1922 N NE2 . GLN B 2 39 ? 47.259 67.159 28.963 1.00 39.51 ? 39 GLN H NE2 1 ATOM 1923 N N . ALA B 2 40 ? 42.268 64.815 26.831 1.00 41.43 ? 40 ALA H N 1 ATOM 1924 C CA . ALA B 2 40 ? 42.249 63.989 25.628 1.00 45.05 ? 40 ALA H CA 1 ATOM 1925 C C . ALA B 2 40 ? 43.667 63.867 25.070 1.00 44.15 ? 40 ALA H C 1 ATOM 1926 O O . ALA B 2 40 ? 44.492 64.751 25.295 1.00 44.42 ? 40 ALA H O 1 ATOM 1927 C CB . ALA B 2 40 ? 41.302 64.580 24.594 1.00 38.76 ? 40 ALA H CB 1 ATOM 1928 N N . PRO B 2 41 ? 43.961 62.765 24.353 1.00 49.19 ? 41 PRO H N 1 ATOM 1929 C CA . PRO B 2 41 ? 45.310 62.527 23.814 1.00 46.88 ? 41 PRO H CA 1 ATOM 1930 C C . PRO B 2 41 ? 45.833 63.674 22.948 1.00 46.18 ? 41 PRO H C 1 ATOM 1931 O O . PRO B 2 41 ? 45.293 63.929 21.872 1.00 54.62 ? 41 PRO H O 1 ATOM 1932 C CB . PRO B 2 41 ? 45.132 61.260 22.971 1.00 49.92 ? 41 PRO H CB 1 ATOM 1933 C CG . PRO B 2 41 ? 43.981 60.557 23.593 1.00 51.49 ? 41 PRO H CG 1 ATOM 1934 C CD . PRO B 2 41 ? 43.053 61.638 24.069 1.00 50.93 ? 41 PRO H CD 1 ATOM 1935 N N . GLY B 2 42 ? 46.874 64.352 23.423 1.00 41.81 ? 42 GLY H N 1 ATOM 1936 C CA . GLY B 2 42 ? 47.474 65.455 22.693 1.00 40.49 ? 42 GLY H CA 1 ATOM 1937 C C . GLY B 2 42 ? 46.843 66.800 23.004 1.00 48.96 ? 42 GLY H C 1 ATOM 1938 O O . GLY B 2 42 ? 47.366 67.844 22.611 1.00 56.24 ? 42 GLY H O 1 ATOM 1939 N N . GLN B 2 43 ? 45.716 66.775 23.711 1.00 46.76 ? 43 GLN H N 1 ATOM 1940 C CA . GLN B 2 43 ? 44.983 67.989 24.053 1.00 47.75 ? 43 GLN H CA 1 ATOM 1941 C C . GLN B 2 43 ? 45.406 68.543 25.413 1.00 41.57 ? 43 GLN H C 1 ATOM 1942 O O . GLN B 2 43 ? 46.254 67.967 26.090 1.00 39.13 ? 43 GLN H O 1 ATOM 1943 C CB . GLN B 2 43 ? 43.476 67.714 24.046 1.00 55.66 ? 43 GLN H CB 1 ATOM 1944 C CG . GLN B 2 43 ? 42.948 67.156 22.734 1.00 64.63 ? 43 GLN H CG 1 ATOM 1945 C CD . GLN B 2 43 ? 42.969 68.178 21.619 1.00 73.59 ? 43 GLN H CD 1 ATOM 1946 O OE1 . GLN B 2 43 ? 42.024 68.951 21.453 1.00 80.87 ? 43 GLN H OE1 1 ATOM 1947 N NE2 . GLN B 2 43 ? 44.048 68.189 20.845 1.00 73.70 ? 43 GLN H NE2 1 ATOM 1948 N N . GLY B 2 44 ? 44.803 69.659 25.810 1.00 35.18 ? 44 GLY H N 1 ATOM 1949 C CA . GLY B 2 44 ? 45.105 70.284 27.086 1.00 33.77 ? 44 GLY H CA 1 ATOM 1950 C C . GLY B 2 44 ? 44.210 69.814 28.220 1.00 37.41 ? 44 GLY H C 1 ATOM 1951 O O . GLY B 2 44 ? 43.544 68.785 28.112 1.00 37.60 ? 44 GLY H O 1 ATOM 1952 N N . LEU B 2 45 ? 44.195 70.577 29.309 1.00 36.46 ? 45 LEU H N 1 ATOM 1953 C CA . LEU B 2 45 ? 43.425 70.225 30.502 1.00 37.15 ? 45 LEU H CA 1 ATOM 1954 C C . LEU B 2 45 ? 42.032 70.853 30.490 1.00 40.20 ? 45 LEU H C 1 ATOM 1955 O O . LEU B 2 45 ? 41.844 71.951 29.970 1.00 42.81 ? 45 LEU H O 1 ATOM 1956 C CB . LEU B 2 45 ? 44.181 70.654 31.763 1.00 34.05 ? 45 LEU H CB 1 ATOM 1957 C CG . LEU B 2 45 ? 45.569 70.037 31.960 1.00 33.14 ? 45 LEU H CG 1 ATOM 1958 C CD1 . LEU B 2 45 ? 46.355 70.798 33.017 1.00 26.03 ? 45 LEU H CD1 1 ATOM 1959 C CD2 . LEU B 2 45 ? 45.444 68.568 32.337 1.00 31.43 ? 45 LEU H CD2 1 ATOM 1960 N N . GLU B 2 46 ? 41.061 70.159 31.078 1.00 37.33 ? 46 GLU H N 1 ATOM 1961 C CA . GLU B 2 46 ? 39.686 70.641 31.093 1.00 39.05 ? 46 GLU H CA 1 ATOM 1962 C C . GLU B 2 46 ? 38.953 70.246 32.380 1.00 40.45 ? 46 GLU H C 1 ATOM 1963 O O . GLU B 2 46 ? 38.888 69.069 32.732 1.00 43.84 ? 46 GLU H O 1 ATOM 1964 C CB . GLU B 2 46 ? 38.933 70.109 29.869 1.00 37.01 ? 46 GLU H CB 1 ATOM 1965 C CG . GLU B 2 46 ? 37.593 70.775 29.617 1.00 41.70 ? 46 GLU H CG 1 ATOM 1966 C CD . GLU B 2 46 ? 36.914 70.258 28.362 1.00 50.92 ? 46 GLU H CD 1 ATOM 1967 O OE1 . GLU B 2 46 ? 37.236 69.131 27.924 1.00 48.90 ? 46 GLU H OE1 1 ATOM 1968 O OE2 . GLU B 2 46 ? 36.057 70.981 27.809 1.00 59.03 ? 46 GLU H OE2 1 ATOM 1969 N N . TRP B 2 47 ? 38.405 71.238 33.078 1.00 35.89 ? 47 TRP H N 1 ATOM 1970 C CA . TRP B 2 47 ? 37.631 70.999 34.294 1.00 35.61 ? 47 TRP H CA 1 ATOM 1971 C C . TRP B 2 47 ? 36.235 70.483 33.947 1.00 39.60 ? 47 TRP H C 1 ATOM 1972 O O . TRP B 2 47 ? 35.570 71.024 33.061 1.00 34.42 ? 47 TRP H O 1 ATOM 1973 C CB . TRP B 2 47 ? 37.540 72.284 35.126 1.00 33.54 ? 47 TRP H CB 1 ATOM 1974 C CG . TRP B 2 47 ? 36.795 72.161 36.429 1.00 29.90 ? 47 TRP H CG 1 ATOM 1975 C CD1 . TRP B 2 47 ? 37.248 71.588 37.586 1.00 30.84 ? 47 TRP H CD1 1 ATOM 1976 C CD2 . TRP B 2 47 ? 35.478 72.655 36.717 1.00 31.53 ? 47 TRP H CD2 1 ATOM 1977 N NE1 . TRP B 2 47 ? 36.288 71.682 38.569 1.00 31.06 ? 47 TRP H NE1 1 ATOM 1978 C CE2 . TRP B 2 47 ? 35.193 72.333 38.061 1.00 30.82 ? 47 TRP H CE2 1 ATOM 1979 C CE3 . TRP B 2 47 ? 34.509 73.330 35.966 1.00 33.84 ? 47 TRP H CE3 1 ATOM 1980 C CZ2 . TRP B 2 47 ? 33.982 72.665 38.669 1.00 37.13 ? 47 TRP H CZ2 1 ATOM 1981 C CZ3 . TRP B 2 47 ? 33.306 73.656 36.571 1.00 41.45 ? 47 TRP H CZ3 1 ATOM 1982 C CH2 . TRP B 2 47 ? 33.053 73.322 37.909 1.00 38.15 ? 47 TRP H CH2 1 ATOM 1983 N N . MET B 2 48 ? 35.799 69.435 34.639 1.00 33.46 ? 48 MET H N 1 ATOM 1984 C CA . MET B 2 48 ? 34.476 68.863 34.401 1.00 40.14 ? 48 MET H CA 1 ATOM 1985 C C . MET B 2 48 ? 33.498 69.249 35.502 1.00 41.05 ? 48 MET H C 1 ATOM 1986 O O . MET B 2 48 ? 32.364 69.637 35.234 1.00 45.13 ? 48 MET H O 1 ATOM 1987 C CB . MET B 2 48 ? 34.559 67.343 34.300 1.00 36.24 ? 48 MET H CB 1 ATOM 1988 C CG . MET B 2 48 ? 35.570 66.855 33.290 1.00 39.17 ? 48 MET H CG 1 ATOM 1989 S SD . MET B 2 48 ? 35.507 65.073 33.085 1.00 50.49 ? 48 MET H SD 1 ATOM 1990 C CE . MET B 2 48 ? 33.848 64.866 32.439 1.00 39.26 ? 48 MET H CE 1 ATOM 1991 N N . GLY B 2 49 ? 33.951 69.133 36.743 1.00 38.29 ? 49 GLY H N 1 ATOM 1992 C CA . GLY B 2 49 ? 33.131 69.462 37.889 1.00 38.87 ? 49 GLY H CA 1 ATOM 1993 C C . GLY B 2 49 ? 33.846 69.176 39.193 1.00 43.83 ? 49 GLY H C 1 ATOM 1994 O O . GLY B 2 49 ? 34.996 68.732 39.195 1.00 45.42 ? 49 GLY H O 1 ATOM 1995 N N . GLY B 2 50 ? 33.164 69.426 40.305 1.00 45.79 ? 50 GLY H N 1 ATOM 1996 C CA . GLY B 2 50 ? 33.738 69.179 41.612 1.00 30.59 ? 50 GLY H CA 1 ATOM 1997 C C . GLY B 2 50 ? 32.666 68.896 42.640 1.00 39.55 ? 50 GLY H C 1 ATOM 1998 O O . GLY B 2 50 ? 31.473 68.955 42.336 1.00 39.80 ? 50 GLY H O 1 ATOM 1999 N N . ILE B 2 51 ? 33.086 68.592 43.864 1.00 39.04 ? 51 ILE H N 1 ATOM 2000 C CA . ILE B 2 51 ? 32.143 68.277 44.926 1.00 36.92 ? 51 ILE H CA 1 ATOM 2001 C C . ILE B 2 51 ? 32.720 68.572 46.312 1.00 38.04 ? 51 ILE H C 1 ATOM 2002 O O . ILE B 2 51 ? 33.925 68.473 46.537 1.00 36.38 ? 51 ILE H O 1 ATOM 2003 C CB . ILE B 2 51 ? 31.697 66.795 44.846 1.00 37.82 ? 51 ILE H CB 1 ATOM 2004 C CG1 . ILE B 2 51 ? 30.536 66.518 45.805 1.00 39.06 ? 51 ILE H CG1 1 ATOM 2005 C CG2 . ILE B 2 51 ? 32.872 65.858 45.096 1.00 33.48 ? 51 ILE H CG2 1 ATOM 2006 C CD1 . ILE B 2 51 ? 29.945 65.133 45.666 1.00 48.13 ? 51 ILE H CD1 1 ATOM 2007 N N . ILE B 2 52 ? 31.838 68.970 47.223 1.00 40.82 ? 52 ILE H N 1 ATOM 2008 C CA . ILE B 2 52 ? 32.160 69.140 48.631 1.00 40.58 ? 52 ILE H CA 1 ATOM 2009 C C . ILE B 2 52 ? 31.708 67.902 49.389 1.00 40.92 ? 52 ILE H C 1 ATOM 2010 O O . ILE B 2 52 ? 30.523 67.767 49.683 1.00 47.86 ? 52 ILE H O 1 ATOM 2011 C CB . ILE B 2 52 ? 31.458 70.373 49.232 1.00 46.06 ? 52 ILE H CB 1 ATOM 2012 C CG1 . ILE B 2 52 ? 31.633 71.597 48.331 1.00 45.39 ? 52 ILE H CG1 1 ATOM 2013 C CG2 . ILE B 2 52 ? 31.957 70.638 50.643 1.00 44.32 ? 52 ILE H CG2 1 ATOM 2014 C CD1 . ILE B 2 52 ? 30.657 72.712 48.639 1.00 47.57 ? 52 ILE H CD1 1 ATOM 2015 N N . PRO B 2 53 A 32.641 66.992 49.699 1.00 39.81 ? 52 PRO H N 1 ATOM 2016 C CA . PRO B 2 53 A 32.318 65.711 50.340 1.00 41.61 ? 52 PRO H CA 1 ATOM 2017 C C . PRO B 2 53 A 31.457 65.852 51.593 1.00 46.52 ? 52 PRO H C 1 ATOM 2018 O O . PRO B 2 53 A 30.479 65.118 51.754 1.00 53.45 ? 52 PRO H O 1 ATOM 2019 C CB . PRO B 2 53 A 33.696 65.145 50.689 1.00 40.89 ? 52 PRO H CB 1 ATOM 2020 C CG . PRO B 2 53 A 34.597 65.723 49.654 1.00 36.40 ? 52 PRO H CG 1 ATOM 2021 C CD . PRO B 2 53 A 34.083 67.116 49.417 1.00 40.65 ? 52 PRO H CD 1 ATOM 2022 N N . ILE B 2 54 ? 31.810 66.797 52.457 1.00 45.13 ? 53 ILE H N 1 ATOM 2023 C CA . ILE B 2 54 ? 31.093 67.012 53.711 1.00 43.12 ? 53 ILE H CA 1 ATOM 2024 C C . ILE B 2 54 ? 29.617 67.339 53.477 1.00 42.70 ? 53 ILE H C 1 ATOM 2025 O O . ILE B 2 54 ? 28.751 66.916 54.245 1.00 45.26 ? 53 ILE H O 1 ATOM 2026 C CB . ILE B 2 54 ? 31.735 68.153 54.542 1.00 53.66 ? 53 ILE H CB 1 ATOM 2027 C CG1 . ILE B 2 54 ? 33.229 67.900 54.763 1.00 62.10 ? 53 ILE H CG1 1 ATOM 2028 C CG2 . ILE B 2 54 ? 31.027 68.316 55.879 1.00 54.41 ? 53 ILE H CG2 1 ATOM 2029 C CD1 . ILE B 2 54 ? 34.135 68.511 53.693 1.00 66.47 ? 53 ILE H CD1 1 ATOM 2030 N N . PHE B 2 55 ? 29.329 68.078 52.410 1.00 40.32 ? 54 PHE H N 1 ATOM 2031 C CA . PHE B 2 55 ? 27.965 68.535 52.150 1.00 43.80 ? 54 PHE H CA 1 ATOM 2032 C C . PHE B 2 55 ? 27.304 67.830 50.973 1.00 43.68 ? 54 PHE H C 1 ATOM 2033 O O . PHE B 2 55 ? 26.085 67.876 50.824 1.00 48.38 ? 54 PHE H O 1 ATOM 2034 C CB . PHE B 2 55 ? 27.954 70.043 51.907 1.00 40.15 ? 54 PHE H CB 1 ATOM 2035 C CG . PHE B 2 55 ? 28.260 70.849 53.130 1.00 42.81 ? 54 PHE H CG 1 ATOM 2036 C CD1 . PHE B 2 55 ? 27.865 70.403 54.383 1.00 45.86 ? 54 PHE H CD1 1 ATOM 2037 C CD2 . PHE B 2 55 ? 28.943 72.048 53.031 1.00 39.98 ? 54 PHE H CD2 1 ATOM 2038 C CE1 . PHE B 2 55 ? 28.142 71.140 55.517 1.00 48.28 ? 54 PHE H CE1 1 ATOM 2039 C CE2 . PHE B 2 55 ? 29.222 72.791 54.156 1.00 41.02 ? 54 PHE H CE2 1 ATOM 2040 C CZ . PHE B 2 55 ? 28.822 72.338 55.403 1.00 53.58 ? 54 PHE H CZ 1 ATOM 2041 N N . GLY B 2 56 ? 28.108 67.187 50.134 1.00 46.99 ? 55 GLY H N 1 ATOM 2042 C CA . GLY B 2 56 ? 27.588 66.506 48.964 1.00 47.61 ? 55 GLY H CA 1 ATOM 2043 C C . GLY B 2 56 ? 27.211 67.472 47.858 1.00 49.40 ? 55 GLY H C 1 ATOM 2044 O O . GLY B 2 56 ? 26.620 67.078 46.854 1.00 53.46 ? 55 GLY H O 1 ATOM 2045 N N . THR B 2 57 ? 27.551 68.744 48.051 1.00 50.16 ? 56 THR H N 1 ATOM 2046 C CA . THR B 2 57 ? 27.293 69.782 47.059 1.00 46.56 ? 56 THR H CA 1 ATOM 2047 C C . THR B 2 57 ? 28.207 69.619 45.851 1.00 39.89 ? 56 THR H C 1 ATOM 2048 O O . THR B 2 57 ? 29.426 69.614 45.986 1.00 42.27 ? 56 THR H O 1 ATOM 2049 C CB . THR B 2 57 ? 27.496 71.189 47.648 1.00 46.50 ? 56 THR H CB 1 ATOM 2050 O OG1 . THR B 2 57 ? 26.531 71.422 48.680 1.00 59.82 ? 56 THR H OG1 1 ATOM 2051 C CG2 . THR B 2 57 ? 27.347 72.251 46.570 1.00 43.01 ? 56 THR H CG2 1 ATOM 2052 N N . ALA B 2 58 ? 27.615 69.502 44.670 1.00 38.96 ? 57 ALA H N 1 ATOM 2053 C CA . ALA B 2 58 ? 28.387 69.296 43.454 1.00 42.58 ? 57 ALA H CA 1 ATOM 2054 C C . ALA B 2 58 ? 28.171 70.409 42.438 1.00 41.81 ? 57 ALA H C 1 ATOM 2055 O O . ALA B 2 58 ? 27.065 70.913 42.269 1.00 42.77 ? 57 ALA H O 1 ATOM 2056 C CB . ALA B 2 58 ? 28.048 67.946 42.835 1.00 39.30 ? 57 ALA H CB 1 ATOM 2057 N N . SER B 2 59 ? 29.252 70.784 41.767 1.00 39.49 ? 58 SER H N 1 ATOM 2058 C CA . SER B 2 59 ? 29.208 71.775 40.704 1.00 37.94 ? 58 SER H CA 1 ATOM 2059 C C . SER B 2 59 ? 29.754 71.155 39.426 1.00 41.42 ? 58 SER H C 1 ATOM 2060 O O . SER B 2 59 ? 30.621 70.286 39.476 1.00 37.68 ? 58 SER H O 1 ATOM 2061 C CB . SER B 2 59 ? 30.013 73.020 41.080 1.00 49.24 ? 58 SER H CB 1 ATOM 2062 O OG . SER B 2 59 ? 29.601 73.525 42.338 1.00 53.68 ? 58 SER H OG 1 ATOM 2063 N N . TYR B 2 60 ? 29.241 71.601 38.286 1.00 43.39 ? 59 TYR H N 1 ATOM 2064 C CA . TYR B 2 60 ? 29.608 71.012 37.007 1.00 46.24 ? 59 TYR H CA 1 ATOM 2065 C C . TYR B 2 60 ? 29.874 72.070 35.947 1.00 49.17 ? 59 TYR H C 1 ATOM 2066 O O . TYR B 2 60 ? 29.271 73.145 35.965 1.00 46.91 ? 59 TYR H O 1 ATOM 2067 C CB . TYR B 2 60 ? 28.503 70.073 36.513 1.00 50.35 ? 59 TYR H CB 1 ATOM 2068 C CG . TYR B 2 60 ? 28.117 68.983 37.486 1.00 52.31 ? 59 TYR H CG 1 ATOM 2069 C CD1 . TYR B 2 60 ? 28.872 67.822 37.592 1.00 54.95 ? 59 TYR H CD1 1 ATOM 2070 C CD2 . TYR B 2 60 ? 26.988 69.105 38.286 1.00 48.12 ? 59 TYR H CD2 1 ATOM 2071 C CE1 . TYR B 2 60 ? 28.521 66.819 38.473 1.00 41.99 ? 59 TYR H CE1 1 ATOM 2072 C CE2 . TYR B 2 60 ? 26.628 68.102 39.172 1.00 47.88 ? 59 TYR H CE2 1 ATOM 2073 C CZ . TYR B 2 60 ? 27.400 66.962 39.260 1.00 48.34 ? 59 TYR H CZ 1 ATOM 2074 O OH . TYR B 2 60 ? 27.054 65.959 40.136 1.00 49.52 ? 59 TYR H OH 1 ATOM 2075 N N . ALA B 2 61 ? 30.778 71.762 35.023 1.00 40.65 ? 60 ALA H N 1 ATOM 2076 C CA . ALA B 2 61 ? 30.925 72.569 33.822 1.00 46.59 ? 60 ALA H CA 1 ATOM 2077 C C . ALA B 2 61 ? 29.682 72.378 32.959 1.00 49.61 ? 60 ALA H C 1 ATOM 2078 O O . ALA B 2 61 ? 29.220 71.252 32.765 1.00 51.26 ? 60 ALA H O 1 ATOM 2079 C CB . ALA B 2 61 ? 32.180 72.184 33.059 1.00 40.78 ? 60 ALA H CB 1 ATOM 2080 N N . GLN B 2 62 ? 29.142 73.479 32.446 1.00 49.77 ? 61 GLN H N 1 ATOM 2081 C CA . GLN B 2 62 ? 27.895 73.442 31.683 1.00 47.30 ? 61 GLN H CA 1 ATOM 2082 C C . GLN B 2 62 ? 27.997 72.568 30.435 1.00 48.11 ? 61 GLN H C 1 ATOM 2083 O O . GLN B 2 62 ? 26.991 72.097 29.912 1.00 56.63 ? 61 GLN H O 1 ATOM 2084 C CB . GLN B 2 62 ? 27.472 74.859 31.299 1.00 51.57 ? 61 GLN H CB 1 ATOM 2085 C CG . GLN B 2 62 ? 27.142 75.735 32.498 1.00 58.57 ? 61 GLN H CG 1 ATOM 2086 C CD . GLN B 2 62 ? 26.566 77.080 32.108 1.00 65.11 ? 61 GLN H CD 1 ATOM 2087 O OE1 . GLN B 2 62 ? 26.565 77.453 30.934 1.00 73.67 ? 61 GLN H OE1 1 ATOM 2088 N NE2 . GLN B 2 62 ? 26.068 77.817 33.094 1.00 62.93 ? 61 GLN H NE2 1 ATOM 2089 N N . LYS B 2 63 ? 29.221 72.350 29.971 1.00 48.88 ? 62 LYS H N 1 ATOM 2090 C CA . LYS B 2 63 ? 29.477 71.511 28.810 1.00 47.31 ? 62 LYS H CA 1 ATOM 2091 C C . LYS B 2 63 ? 28.997 70.077 29.024 1.00 47.09 ? 62 LYS H C 1 ATOM 2092 O O . LYS B 2 63 ? 28.496 69.437 28.101 1.00 50.72 ? 62 LYS H O 1 ATOM 2093 C CB . LYS B 2 63 ? 30.974 71.521 28.480 1.00 47.08 ? 62 LYS H CB 1 ATOM 2094 C CG . LYS B 2 63 ? 31.371 70.647 27.302 1.00 55.74 ? 62 LYS H CG 1 ATOM 2095 C CD . LYS B 2 63 ? 32.867 70.740 27.037 1.00 59.84 ? 62 LYS H CD 1 ATOM 2096 C CE . LYS B 2 63 ? 33.283 69.856 25.872 1.00 62.09 ? 62 LYS H CE 1 ATOM 2097 N NZ . LYS B 2 63 ? 34.747 69.943 25.613 1.00 60.97 ? 62 LYS H NZ 1 ATOM 2098 N N . PHE B 2 64 ? 29.139 69.580 30.249 1.00 42.84 ? 63 PHE H N 1 ATOM 2099 C CA . PHE B 2 64 ? 28.865 68.176 30.533 1.00 42.15 ? 63 PHE H CA 1 ATOM 2100 C C . PHE B 2 64 ? 27.574 67.943 31.318 1.00 51.83 ? 63 PHE H C 1 ATOM 2101 O O . PHE B 2 64 ? 27.183 66.796 31.534 1.00 51.48 ? 63 PHE H O 1 ATOM 2102 C CB . PHE B 2 64 ? 30.038 67.557 31.297 1.00 39.07 ? 63 PHE H CB 1 ATOM 2103 C CG . PHE B 2 64 ? 31.347 67.647 30.570 1.00 48.96 ? 63 PHE H CG 1 ATOM 2104 C CD1 . PHE B 2 64 ? 31.613 66.822 29.490 1.00 52.93 ? 63 PHE H CD1 1 ATOM 2105 C CD2 . PHE B 2 64 ? 32.313 68.559 30.964 1.00 40.70 ? 63 PHE H CD2 1 ATOM 2106 C CE1 . PHE B 2 64 ? 32.819 66.906 28.816 1.00 49.12 ? 63 PHE H CE1 1 ATOM 2107 C CE2 . PHE B 2 64 ? 33.519 68.645 30.295 1.00 40.27 ? 63 PHE H CE2 1 ATOM 2108 C CZ . PHE B 2 64 ? 33.771 67.819 29.220 1.00 41.53 ? 63 PHE H CZ 1 ATOM 2109 N N . GLN B 2 65 ? 26.915 69.021 31.740 1.00 50.63 ? 64 GLN H N 1 ATOM 2110 C CA . GLN B 2 65 ? 25.673 68.907 32.506 1.00 50.96 ? 64 GLN H CA 1 ATOM 2111 C C . GLN B 2 65 ? 24.630 68.070 31.778 1.00 49.70 ? 64 GLN H C 1 ATOM 2112 O O . GLN B 2 65 ? 24.273 68.357 30.637 1.00 56.72 ? 64 GLN H O 1 ATOM 2113 C CB . GLN B 2 65 ? 25.098 70.289 32.817 1.00 51.76 ? 64 GLN H CB 1 ATOM 2114 C CG . GLN B 2 65 ? 25.959 71.115 33.749 1.00 56.19 ? 64 GLN H CG 1 ATOM 2115 C CD . GLN B 2 65 ? 25.151 72.114 34.548 1.00 59.56 ? 64 GLN H CD 1 ATOM 2116 O OE1 . GLN B 2 65 ? 25.305 73.326 34.391 1.00 67.69 ? 64 GLN H OE1 1 ATOM 2117 N NE2 . GLN B 2 65 ? 24.284 71.609 35.417 1.00 57.34 ? 64 GLN H NE2 1 ATOM 2118 N N . GLY B 2 66 ? 24.150 67.030 32.447 1.00 49.95 ? 65 GLY H N 1 ATOM 2119 C CA . GLY B 2 66 ? 23.195 66.118 31.849 1.00 52.85 ? 65 GLY H CA 1 ATOM 2120 C C . GLY B 2 66 ? 23.808 64.759 31.570 1.00 71.89 ? 65 GLY H C 1 ATOM 2121 O O . GLY B 2 66 ? 23.088 63.767 31.452 1.00 53.67 ? 65 GLY H O 1 ATOM 2122 N N . ARG B 2 67 ? 25.137 64.718 31.463 1.00 48.16 ? 66 ARG H N 1 ATOM 2123 C CA . ARG B 2 67 ? 25.861 63.473 31.204 1.00 61.69 ? 66 ARG H CA 1 ATOM 2124 C C . ARG B 2 67 ? 26.799 63.095 32.343 1.00 52.23 ? 66 ARG H C 1 ATOM 2125 O O . ARG B 2 67 ? 27.392 62.018 32.328 1.00 54.53 ? 66 ARG H O 1 ATOM 2126 C CB . ARG B 2 67 ? 26.689 63.573 29.917 1.00 61.79 ? 66 ARG H CB 1 ATOM 2127 C CG . ARG B 2 67 ? 25.900 63.759 28.644 1.00 64.98 ? 66 ARG H CG 1 ATOM 2128 C CD . ARG B 2 67 ? 26.744 63.397 27.422 1.00 59.64 ? 66 ARG H CD 1 ATOM 2129 N NE . ARG B 2 67 ? 27.927 64.241 27.262 1.00 48.42 ? 66 ARG H NE 1 ATOM 2130 C CZ . ARG B 2 67 ? 29.174 63.777 27.194 1.00 57.17 ? 66 ARG H CZ 1 ATOM 2131 N NH1 . ARG B 2 67 ? 29.409 62.473 27.281 1.00 46.36 ? 66 ARG H NH1 1 ATOM 2132 N NH2 . ARG B 2 67 ? 30.191 64.614 27.038 1.00 49.21 ? 66 ARG H NH2 1 ATOM 2133 N N . VAL B 2 68 ? 26.956 63.985 33.314 1.00 46.04 ? 67 VAL H N 1 ATOM 2134 C CA . VAL B 2 68 ? 27.949 63.772 34.360 1.00 46.40 ? 67 VAL H CA 1 ATOM 2135 C C . VAL B 2 68 ? 27.316 63.804 35.749 1.00 53.37 ? 67 VAL H C 1 ATOM 2136 O O . VAL B 2 68 ? 26.428 64.612 36.023 1.00 56.55 ? 67 VAL H O 1 ATOM 2137 C CB . VAL B 2 68 ? 29.088 64.824 34.271 1.00 42.13 ? 67 VAL H CB 1 ATOM 2138 C CG1 . VAL B 2 68 ? 28.543 66.237 34.454 1.00 47.74 ? 67 VAL H CG1 1 ATOM 2139 C CG2 . VAL B 2 68 ? 30.183 64.527 35.285 1.00 35.17 ? 67 VAL H CG2 1 ATOM 2140 N N . THR B 2 69 ? 27.765 62.900 36.614 1.00 47.40 ? 68 THR H N 1 ATOM 2141 C CA . THR B 2 69 ? 27.311 62.870 37.996 1.00 42.41 ? 68 THR H CA 1 ATOM 2142 C C . THR B 2 69 ? 28.496 62.640 38.927 1.00 45.19 ? 68 THR H C 1 ATOM 2143 O O . THR B 2 69 ? 29.187 61.626 38.828 1.00 48.26 ? 68 THR H O 1 ATOM 2144 C CB . THR B 2 69 ? 26.253 61.775 38.224 1.00 46.63 ? 68 THR H CB 1 ATOM 2145 O OG1 . THR B 2 69 ? 25.085 62.062 37.443 1.00 51.58 ? 68 THR H OG1 1 ATOM 2146 C CG2 . THR B 2 69 ? 25.866 61.705 39.692 1.00 44.54 ? 68 THR H CG2 1 ATOM 2147 N N . ILE B 2 70 ? 28.737 63.590 39.825 1.00 40.90 ? 69 ILE H N 1 ATOM 2148 C CA . ILE B 2 70 ? 29.849 63.484 40.762 1.00 41.07 ? 69 ILE H CA 1 ATOM 2149 C C . ILE B 2 70 ? 29.348 63.295 42.188 1.00 41.38 ? 69 ILE H C 1 ATOM 2150 O O . ILE B 2 70 ? 28.721 64.184 42.756 1.00 41.23 ? 69 ILE H O 1 ATOM 2151 C CB . ILE B 2 70 ? 30.761 64.725 40.704 1.00 40.61 ? 69 ILE H CB 1 ATOM 2152 C CG1 . ILE B 2 70 ? 31.340 64.892 39.300 1.00 39.21 ? 69 ILE H CG1 1 ATOM 2153 C CG2 . ILE B 2 70 ? 31.878 64.608 41.724 1.00 38.94 ? 69 ILE H CG2 1 ATOM 2154 C CD1 . ILE B 2 70 ? 32.171 66.141 39.130 1.00 41.98 ? 69 ILE H CD1 1 ATOM 2155 N N . THR B 2 71 ? 29.631 62.129 42.757 1.00 44.35 ? 70 THR H N 1 ATOM 2156 C CA . THR B 2 71 ? 29.206 61.805 44.114 1.00 46.74 ? 70 THR H CA 1 ATOM 2157 C C . THR B 2 71 ? 30.409 61.633 45.037 1.00 48.38 ? 70 THR H C 1 ATOM 2158 O O . THR B 2 71 ? 31.556 61.682 44.589 1.00 47.41 ? 70 THR H O 1 ATOM 2159 C CB . THR B 2 71 ? 28.356 60.519 44.146 1.00 47.15 ? 70 THR H CB 1 ATOM 2160 O OG1 . THR B 2 71 ? 29.107 59.432 43.590 1.00 42.65 ? 70 THR H OG1 1 ATOM 2161 C CG2 . THR B 2 71 ? 27.082 60.705 43.340 1.00 46.99 ? 70 THR H CG2 1 ATOM 2162 N N . ALA B 2 72 ? 30.143 61.431 46.324 1.00 47.73 ? 71 ALA H N 1 ATOM 2163 C CA . ALA B 2 72 ? 31.206 61.244 47.306 1.00 46.73 ? 71 ALA H CA 1 ATOM 2164 C C . ALA B 2 72 ? 30.716 60.466 48.527 1.00 52.87 ? 71 ALA H C 1 ATOM 2165 O O . ALA B 2 72 ? 29.736 60.847 49.165 1.00 59.92 ? 71 ALA H O 1 ATOM 2166 C CB . ALA B 2 72 ? 31.773 62.592 47.734 1.00 42.34 ? 71 ALA H CB 1 ATOM 2167 N N . ASP B 2 73 ? 31.404 59.375 48.845 1.00 55.54 ? 72 ASP H N 1 ATOM 2168 C CA . ASP B 2 73 ? 31.098 58.596 50.040 1.00 62.05 ? 72 ASP H CA 1 ATOM 2169 C C . ASP B 2 73 ? 32.007 59.032 51.185 1.00 67.78 ? 72 ASP H C 1 ATOM 2170 O O . ASP B 2 73 ? 33.193 58.706 51.205 1.00 66.85 ? 72 ASP H O 1 ATOM 2171 C CB . ASP B 2 73 ? 31.259 57.100 49.767 1.00 64.53 ? 72 ASP H CB 1 ATOM 2172 C CG . ASP B 2 73 ? 30.840 56.243 50.946 1.00 73.96 ? 72 ASP H CG 1 ATOM 2173 O OD1 . ASP B 2 73 ? 29.669 55.810 50.981 1.00 80.05 ? 72 ASP H OD1 1 ATOM 2174 O OD2 . ASP B 2 73 ? 31.681 56.005 51.839 1.00 76.60 ? 72 ASP H OD2 1 ATOM 2175 N N . LYS B 2 74 ? 31.444 59.770 52.136 1.00 79.09 ? 73 LYS H N 1 ATOM 2176 C CA . LYS B 2 74 ? 32.229 60.359 53.218 1.00 81.64 ? 73 LYS H CA 1 ATOM 2177 C C . LYS B 2 74 ? 32.718 59.324 54.228 1.00 84.07 ? 73 LYS H C 1 ATOM 2178 O O . LYS B 2 74 ? 33.699 59.556 54.937 1.00 85.04 ? 73 LYS H O 1 ATOM 2179 C CB . LYS B 2 74 ? 31.414 61.437 53.939 1.00 87.74 ? 73 LYS H CB 1 ATOM 2180 C CG . LYS B 2 74 ? 32.037 62.826 53.882 1.00 94.76 ? 73 LYS H CG 1 ATOM 2181 C CD . LYS B 2 74 ? 33.449 62.827 54.458 1.00 97.46 ? 73 LYS H CD 1 ATOM 2182 C CE . LYS B 2 74 ? 34.076 64.212 54.404 1.00 92.80 ? 73 LYS H CE 1 ATOM 2183 N NZ . LYS B 2 74 ? 35.452 64.218 54.972 1.00 88.84 ? 73 LYS H NZ 1 ATOM 2184 N N . SER B 2 75 ? 32.040 58.183 54.293 1.00 80.90 ? 74 SER H N 1 ATOM 2185 C CA . SER B 2 75 ? 32.401 57.148 55.255 1.00 82.69 ? 74 SER H CA 1 ATOM 2186 C C . SER B 2 75 ? 33.702 56.453 54.866 1.00 81.03 ? 74 SER H C 1 ATOM 2187 O O . SER B 2 75 ? 34.351 55.826 55.702 1.00 85.08 ? 74 SER H O 1 ATOM 2188 C CB . SER B 2 75 ? 31.275 56.120 55.390 1.00 83.08 ? 74 SER H CB 1 ATOM 2189 O OG . SER B 2 75 ? 31.021 55.476 54.155 1.00 81.64 ? 74 SER H OG 1 ATOM 2190 N N . THR B 2 76 ? 34.081 56.566 53.597 1.00 76.82 ? 75 THR H N 1 ATOM 2191 C CA . THR B 2 76 ? 35.308 55.942 53.112 1.00 74.57 ? 75 THR H CA 1 ATOM 2192 C C . THR B 2 76 ? 36.225 56.950 52.426 1.00 71.26 ? 75 THR H C 1 ATOM 2193 O O . THR B 2 76 ? 37.320 56.599 51.986 1.00 72.48 ? 75 THR H O 1 ATOM 2194 C CB . THR B 2 76 ? 35.008 54.796 52.123 1.00 70.53 ? 75 THR H CB 1 ATOM 2195 O OG1 . THR B 2 76 ? 34.366 55.322 50.955 1.00 67.47 ? 75 THR H OG1 1 ATOM 2196 C CG2 . THR B 2 76 ? 34.111 53.749 52.767 1.00 73.97 ? 75 THR H CG2 1 ATOM 2197 N N . SER B 2 77 ? 35.770 58.199 52.349 1.00 68.35 ? 76 SER H N 1 ATOM 2198 C CA . SER B 2 77 ? 36.476 59.254 51.625 1.00 67.09 ? 76 SER H CA 1 ATOM 2199 C C . SER B 2 77 ? 36.789 58.817 50.196 1.00 59.53 ? 76 SER H C 1 ATOM 2200 O O . SER B 2 77 ? 37.950 58.765 49.786 1.00 58.47 ? 76 SER H O 1 ATOM 2201 C CB . SER B 2 77 ? 37.759 59.657 52.356 1.00 71.69 ? 76 SER H CB 1 ATOM 2202 O OG . SER B 2 77 ? 37.462 60.352 53.554 1.00 76.95 ? 76 SER H OG 1 ATOM 2203 N N . THR B 2 78 ? 35.738 58.504 49.448 1.00 54.76 ? 77 THR H N 1 ATOM 2204 C CA . THR B 2 78 ? 35.873 58.086 48.062 1.00 47.62 ? 77 THR H CA 1 ATOM 2205 C C . THR B 2 78 ? 34.947 58.904 47.173 1.00 44.89 ? 77 THR H C 1 ATOM 2206 O O . THR B 2 78 ? 33.726 58.848 47.311 1.00 54.02 ? 77 THR H O 1 ATOM 2207 C CB . THR B 2 78 ? 35.557 56.591 47.889 1.00 49.01 ? 77 THR H CB 1 ATOM 2208 O OG1 . THR B 2 78 ? 36.351 55.824 48.803 1.00 56.25 ? 77 THR H OG1 1 ATOM 2209 C CG2 . THR B 2 78 ? 35.853 56.142 46.468 1.00 47.71 ? 77 THR H CG2 1 ATOM 2210 N N . ALA B 2 79 ? 35.534 59.674 46.265 1.00 37.38 ? 78 ALA H N 1 ATOM 2211 C CA . ALA B 2 79 ? 34.756 60.459 45.320 1.00 36.47 ? 78 ALA H CA 1 ATOM 2212 C C . ALA B 2 79 ? 34.524 59.655 44.048 1.00 40.48 ? 78 ALA H C 1 ATOM 2213 O O . ALA B 2 79 ? 35.282 58.737 43.736 1.00 43.51 ? 78 ALA H O 1 ATOM 2214 C CB . ALA B 2 79 ? 35.456 61.771 45.007 1.00 36.87 ? 78 ALA H CB 1 ATOM 2215 N N . TYR B 2 80 ? 33.467 59.994 43.320 1.00 41.31 ? 79 TYR H N 1 ATOM 2216 C CA . TYR B 2 80 ? 33.128 59.276 42.098 1.00 38.75 ? 79 TYR H CA 1 ATOM 2217 C C . TYR B 2 80 ? 32.779 60.239 40.969 1.00 38.52 ? 79 TYR H C 1 ATOM 2218 O O . TYR B 2 80 ? 32.234 61.319 41.206 1.00 44.44 ? 79 TYR H O 1 ATOM 2219 C CB . TYR B 2 80 ? 31.961 58.317 42.345 1.00 42.19 ? 79 TYR H CB 1 ATOM 2220 C CG . TYR B 2 80 ? 32.238 57.239 43.370 1.00 44.85 ? 79 TYR H CG 1 ATOM 2221 C CD1 . TYR B 2 80 ? 32.784 56.018 42.992 1.00 42.42 ? 79 TYR H CD1 1 ATOM 2222 C CD2 . TYR B 2 80 ? 31.941 57.436 44.714 1.00 45.02 ? 79 TYR H CD2 1 ATOM 2223 C CE1 . TYR B 2 80 ? 33.034 55.026 43.923 1.00 44.64 ? 79 TYR H CE1 1 ATOM 2224 C CE2 . TYR B 2 80 ? 32.188 56.449 45.653 1.00 45.85 ? 79 TYR H CE2 1 ATOM 2225 C CZ . TYR B 2 80 ? 32.734 55.246 45.251 1.00 47.85 ? 79 TYR H CZ 1 ATOM 2226 O OH . TYR B 2 80 ? 32.981 54.261 46.181 1.00 53.46 ? 79 TYR H OH 1 ATOM 2227 N N . MET B 2 81 ? 33.097 59.839 39.742 1.00 34.86 ? 80 MET H N 1 ATOM 2228 C CA . MET B 2 81 ? 32.751 60.617 38.560 1.00 38.86 ? 80 MET H CA 1 ATOM 2229 C C . MET B 2 81 ? 32.085 59.706 37.543 1.00 43.18 ? 80 MET H C 1 ATOM 2230 O O . MET B 2 81 ? 32.749 58.880 36.918 1.00 50.14 ? 80 MET H O 1 ATOM 2231 C CB . MET B 2 81 ? 33.996 61.273 37.957 1.00 45.41 ? 80 MET H CB 1 ATOM 2232 C CG . MET B 2 81 ? 33.722 62.352 36.901 1.00 45.94 ? 80 MET H CG 1 ATOM 2233 S SD . MET B 2 81 ? 33.266 61.749 35.266 1.00 63.67 ? 80 MET H SD 1 ATOM 2234 C CE . MET B 2 81 ? 34.639 60.671 34.874 1.00 30.96 ? 80 MET H CE 1 ATOM 2235 N N . GLU B 2 82 ? 30.774 59.850 37.381 1.00 41.91 ? 81 GLU H N 1 ATOM 2236 C CA . GLU B 2 82 ? 30.049 59.026 36.426 1.00 46.15 ? 81 GLU H CA 1 ATOM 2237 C C . GLU B 2 82 ? 29.730 59.809 35.155 1.00 50.80 ? 81 GLU H C 1 ATOM 2238 O O . GLU B 2 82 ? 29.061 60.844 35.201 1.00 52.96 ? 81 GLU H O 1 ATOM 2239 C CB . GLU B 2 82 ? 28.763 58.477 37.047 1.00 47.14 ? 81 GLU H CB 1 ATOM 2240 C CG . GLU B 2 82 ? 28.174 57.310 36.265 1.00 51.60 ? 81 GLU H CG 1 ATOM 2241 C CD . GLU B 2 82 ? 27.009 56.644 36.972 1.00 60.48 ? 81 GLU H CD 1 ATOM 2242 O OE1 . GLU B 2 82 ? 26.710 55.476 36.644 1.00 61.95 ? 81 GLU H OE1 1 ATOM 2243 O OE2 . GLU B 2 82 ? 26.389 57.285 37.848 1.00 68.54 ? 81 GLU H OE2 1 ATOM 2244 N N . LEU B 2 83 ? 30.218 59.303 34.025 1.00 47.91 ? 82 LEU H N 1 ATOM 2245 C CA . LEU B 2 83 ? 29.993 59.932 32.729 1.00 45.42 ? 82 LEU H CA 1 ATOM 2246 C C . LEU B 2 83 ? 29.205 58.996 31.824 1.00 48.55 ? 82 LEU H C 1 ATOM 2247 O O . LEU B 2 83 ? 29.658 57.896 31.513 1.00 42.69 ? 82 LEU H O 1 ATOM 2248 C CB . LEU B 2 83 ? 31.327 60.309 32.074 1.00 41.69 ? 82 LEU H CB 1 ATOM 2249 C CG . LEU B 2 83 ? 31.261 61.171 30.811 1.00 41.88 ? 82 LEU H CG 1 ATOM 2250 C CD1 . LEU B 2 83 ? 30.558 62.489 31.104 1.00 43.23 ? 82 LEU H CD1 1 ATOM 2251 C CD2 . LEU B 2 83 ? 32.654 61.419 30.261 1.00 37.33 ? 82 LEU H CD2 1 ATOM 2252 N N . SER B 2 84 A 28.027 59.438 31.401 1.00 50.28 ? 82 SER H N 1 ATOM 2253 C CA . SER B 2 84 A 27.148 58.600 30.595 1.00 53.47 ? 82 SER H CA 1 ATOM 2254 C C . SER B 2 84 A 27.072 59.086 29.152 1.00 55.90 ? 82 SER H C 1 ATOM 2255 O O . SER B 2 84 A 27.587 60.156 28.822 1.00 48.34 ? 82 SER H O 1 ATOM 2256 C CB . SER B 2 84 A 25.748 58.548 31.211 1.00 50.35 ? 82 SER H CB 1 ATOM 2257 O OG . SER B 2 84 A 25.230 59.849 31.420 1.00 60.00 ? 82 SER H OG 1 ATOM 2258 N N . SER B 2 85 B 26.423 58.285 28.307 1.00 53.47 ? 82 SER H N 1 ATOM 2259 C CA . SER B 2 85 B 26.293 58.574 26.882 1.00 61.70 ? 82 SER H CA 1 ATOM 2260 C C . SER B 2 85 B 27.655 58.840 26.261 1.00 54.36 ? 82 SER H C 1 ATOM 2261 O O . SER B 2 85 B 27.833 59.809 25.521 1.00 54.72 ? 82 SER H O 1 ATOM 2262 C CB . SER B 2 85 B 25.366 59.767 26.654 1.00 65.13 ? 82 SER H CB 1 ATOM 2263 O OG . SER B 2 85 B 25.315 60.121 25.283 1.00 71.73 ? 82 SER H OG 1 ATOM 2264 N N . LEU B 2 86 C 28.607 57.969 26.580 1.00 65.49 ? 82 LEU H N 1 ATOM 2265 C CA . LEU B 2 86 C 29.992 58.127 26.158 1.00 51.25 ? 82 LEU H CA 1 ATOM 2266 C C . LEU B 2 86 C 30.146 58.200 24.640 1.00 61.83 ? 82 LEU H C 1 ATOM 2267 O O . LEU B 2 86 C 29.613 57.369 23.901 1.00 58.33 ? 82 LEU H O 1 ATOM 2268 C CB . LEU B 2 86 C 30.841 56.981 26.714 1.00 53.92 ? 82 LEU H CB 1 ATOM 2269 C CG . LEU B 2 86 C 31.065 57.000 28.228 1.00 46.71 ? 82 LEU H CG 1 ATOM 2270 C CD1 . LEU B 2 86 C 31.656 55.688 28.710 1.00 46.78 ? 82 LEU H CD1 1 ATOM 2271 C CD2 . LEU B 2 86 C 31.963 58.161 28.609 1.00 43.46 ? 82 LEU H CD2 1 ATOM 2272 N N . ARG B 2 87 ? 30.876 59.216 24.192 1.00 53.56 ? 83 ARG H N 1 ATOM 2273 C CA . ARG B 2 87 ? 31.198 59.394 22.785 1.00 56.81 ? 83 ARG H CA 1 ATOM 2274 C C . ARG B 2 87 ? 32.695 59.175 22.598 1.00 59.22 ? 83 ARG H C 1 ATOM 2275 O O . ARG B 2 87 ? 33.440 59.131 23.574 1.00 52.39 ? 83 ARG H O 1 ATOM 2276 C CB . ARG B 2 87 ? 30.788 60.787 22.314 1.00 63.25 ? 83 ARG H CB 1 ATOM 2277 C CG . ARG B 2 87 ? 29.413 61.210 22.797 1.00 67.35 ? 83 ARG H CG 1 ATOM 2278 C CD . ARG B 2 87 ? 29.310 62.722 22.926 1.00 69.69 ? 83 ARG H CD 1 ATOM 2279 N NE . ARG B 2 87 ? 28.051 63.134 23.544 1.00 72.62 ? 83 ARG H NE 1 ATOM 2280 C CZ . ARG B 2 87 ? 27.699 64.399 23.750 1.00 77.13 ? 83 ARG H CZ 1 ATOM 2281 N NH1 . ARG B 2 87 ? 28.512 65.382 23.388 1.00 79.98 ? 83 ARG H NH1 1 ATOM 2282 N NH2 . ARG B 2 87 ? 26.534 64.682 24.319 1.00 78.28 ? 83 ARG H NH2 1 ATOM 2283 N N . SER B 2 88 ? 33.138 59.046 21.352 1.00 45.08 ? 84 SER H N 1 ATOM 2284 C CA . SER B 2 88 ? 34.549 58.793 21.084 1.00 50.42 ? 84 SER H CA 1 ATOM 2285 C C . SER B 2 88 ? 35.409 59.974 21.535 1.00 52.65 ? 84 SER H C 1 ATOM 2286 O O . SER B 2 88 ? 36.569 59.799 21.910 1.00 53.22 ? 84 SER H O 1 ATOM 2287 C CB . SER B 2 88 ? 34.776 58.498 19.598 1.00 51.85 ? 84 SER H CB 1 ATOM 2288 O OG . SER B 2 88 ? 34.393 59.597 18.793 1.00 61.82 ? 84 SER H OG 1 ATOM 2289 N N . GLU B 2 89 ? 34.823 61.168 21.521 1.00 53.58 ? 85 GLU H N 1 ATOM 2290 C CA . GLU B 2 89 ? 35.506 62.380 21.972 1.00 49.06 ? 85 GLU H CA 1 ATOM 2291 C C . GLU B 2 89 ? 35.693 62.408 23.487 1.00 44.58 ? 85 GLU H C 1 ATOM 2292 O O . GLU B 2 89 ? 36.276 63.347 24.026 1.00 44.28 ? 85 GLU H O 1 ATOM 2293 C CB . GLU B 2 89 ? 34.738 63.632 21.534 1.00 59.13 ? 85 GLU H CB 1 ATOM 2294 C CG . GLU B 2 89 ? 34.536 63.768 20.033 1.00 71.55 ? 85 GLU H CG 1 ATOM 2295 C CD . GLU B 2 89 ? 33.391 62.917 19.513 1.00 77.72 ? 85 GLU H CD 1 ATOM 2296 O OE1 . GLU B 2 89 ? 33.465 62.467 18.349 1.00 78.56 ? 85 GLU H OE1 1 ATOM 2297 O OE2 . GLU B 2 89 ? 32.417 62.700 20.265 1.00 77.78 ? 85 GLU H OE2 1 ATOM 2298 N N . ASP B 2 90 ? 35.183 61.390 24.173 1.00 44.64 ? 86 ASP H N 1 ATOM 2299 C CA . ASP B 2 90 ? 35.358 61.283 25.618 1.00 45.74 ? 86 ASP H CA 1 ATOM 2300 C C . ASP B 2 90 ? 36.576 60.424 25.954 1.00 46.11 ? 86 ASP H C 1 ATOM 2301 O O . ASP B 2 90 ? 36.915 60.244 27.125 1.00 38.79 ? 86 ASP H O 1 ATOM 2302 C CB . ASP B 2 90 ? 34.105 60.701 26.281 1.00 43.73 ? 86 ASP H CB 1 ATOM 2303 C CG . ASP B 2 90 ? 32.888 61.597 26.128 1.00 45.15 ? 86 ASP H CG 1 ATOM 2304 O OD1 . ASP B 2 90 ? 33.057 62.825 25.977 1.00 44.98 ? 86 ASP H OD1 1 ATOM 2305 O OD2 . ASP B 2 90 ? 31.755 61.068 26.163 1.00 51.96 ? 86 ASP H OD2 1 ATOM 2306 N N . THR B 2 91 ? 37.222 59.887 24.921 1.00 35.75 ? 87 THR H N 1 ATOM 2307 C CA . THR B 2 91 ? 38.455 59.135 25.107 1.00 35.97 ? 87 THR H CA 1 ATOM 2308 C C . THR B 2 91 ? 39.520 60.071 25.653 1.00 41.16 ? 87 THR H C 1 ATOM 2309 O O . THR B 2 91 ? 39.986 60.976 24.957 1.00 41.25 ? 87 THR H O 1 ATOM 2310 C CB . THR B 2 91 ? 38.952 58.494 23.799 1.00 41.83 ? 87 THR H CB 1 ATOM 2311 O OG1 . THR B 2 91 ? 38.017 57.498 23.363 1.00 39.67 ? 87 THR H OG1 1 ATOM 2312 C CG2 . THR B 2 91 ? 40.314 57.844 24.011 1.00 32.87 ? 87 THR H CG2 1 ATOM 2313 N N . ALA B 2 92 ? 39.897 59.845 26.905 1.00 36.47 ? 88 ALA H N 1 ATOM 2314 C CA . ALA B 2 92 ? 40.759 60.767 27.617 1.00 37.67 ? 88 ALA H CA 1 ATOM 2315 C C . ALA B 2 92 ? 41.247 60.158 28.916 1.00 38.48 ? 88 ALA H C 1 ATOM 2316 O O . ALA B 2 92 ? 40.748 59.121 29.349 1.00 39.13 ? 88 ALA H O 1 ATOM 2317 C CB . ALA B 2 92 ? 40.018 62.070 27.894 1.00 42.22 ? 88 ALA H CB 1 ATOM 2318 N N . VAL B 2 93 ? 42.229 60.806 29.531 1.00 37.45 ? 89 VAL H N 1 ATOM 2319 C CA . VAL B 2 93 ? 42.635 60.450 30.881 1.00 38.48 ? 89 VAL H CA 1 ATOM 2320 C C . VAL B 2 93 ? 41.888 61.334 31.868 1.00 40.13 ? 89 VAL H C 1 ATOM 2321 O O . VAL B 2 93 ? 41.871 62.558 31.722 1.00 38.91 ? 89 VAL H O 1 ATOM 2322 C CB . VAL B 2 93 ? 44.145 60.612 31.099 1.00 34.37 ? 89 VAL H CB 1 ATOM 2323 C CG1 . VAL B 2 93 ? 44.517 60.186 32.509 1.00 30.91 ? 89 VAL H CG1 1 ATOM 2324 C CG2 . VAL B 2 93 ? 44.919 59.807 30.070 1.00 30.24 ? 89 VAL H CG2 1 ATOM 2325 N N . TYR B 2 94 ? 41.264 60.714 32.864 1.00 38.56 ? 90 TYR H N 1 ATOM 2326 C CA . TYR B 2 94 ? 40.482 61.451 33.850 1.00 39.32 ? 90 TYR H CA 1 ATOM 2327 C C . TYR B 2 94 ? 41.202 61.525 35.195 1.00 39.98 ? 90 TYR H C 1 ATOM 2328 O O . TYR B 2 94 ? 41.558 60.499 35.776 1.00 44.15 ? 90 TYR H O 1 ATOM 2329 C CB . TYR B 2 94 ? 39.100 60.811 34.010 1.00 36.10 ? 90 TYR H CB 1 ATOM 2330 C CG . TYR B 2 94 ? 38.237 60.976 32.781 1.00 38.92 ? 90 TYR H CG 1 ATOM 2331 C CD1 . TYR B 2 94 ? 38.397 60.147 31.677 1.00 41.22 ? 90 TYR H CD1 1 ATOM 2332 C CD2 . TYR B 2 94 ? 37.277 61.973 32.716 1.00 39.43 ? 90 TYR H CD2 1 ATOM 2333 C CE1 . TYR B 2 94 ? 37.619 60.305 30.544 1.00 41.81 ? 90 TYR H CE1 1 ATOM 2334 C CE2 . TYR B 2 94 ? 36.492 62.138 31.587 1.00 40.28 ? 90 TYR H CE2 1 ATOM 2335 C CZ . TYR B 2 94 ? 36.668 61.302 30.505 1.00 42.87 ? 90 TYR H CZ 1 ATOM 2336 O OH . TYR B 2 94 ? 35.890 61.466 29.383 1.00 35.97 ? 90 TYR H OH 1 ATOM 2337 N N . TYR B 2 95 ? 41.414 62.745 35.681 1.00 34.46 ? 91 TYR H N 1 ATOM 2338 C CA . TYR B 2 95 ? 42.092 62.962 36.954 1.00 33.14 ? 91 TYR H CA 1 ATOM 2339 C C . TYR B 2 95 ? 41.132 63.456 38.033 1.00 35.87 ? 91 TYR H C 1 ATOM 2340 O O . TYR B 2 95 ? 40.202 64.213 37.747 1.00 34.80 ? 91 TYR H O 1 ATOM 2341 C CB . TYR B 2 95 ? 43.232 63.975 36.799 1.00 33.09 ? 91 TYR H CB 1 ATOM 2342 C CG . TYR B 2 95 ? 44.310 63.581 35.809 1.00 40.75 ? 91 TYR H CG 1 ATOM 2343 C CD1 . TYR B 2 95 ? 45.370 62.771 36.194 1.00 41.21 ? 91 TYR H CD1 1 ATOM 2344 C CD2 . TYR B 2 95 ? 44.278 64.036 34.495 1.00 39.66 ? 91 TYR H CD2 1 ATOM 2345 C CE1 . TYR B 2 95 ? 46.359 62.414 35.296 1.00 42.90 ? 91 TYR H CE1 1 ATOM 2346 C CE2 . TYR B 2 95 ? 45.263 63.684 33.593 1.00 38.89 ? 91 TYR H CE2 1 ATOM 2347 C CZ . TYR B 2 95 ? 46.300 62.873 33.999 1.00 42.08 ? 91 TYR H CZ 1 ATOM 2348 O OH . TYR B 2 95 ? 47.286 62.519 33.104 1.00 44.15 ? 91 TYR H OH 1 ATOM 2349 N N . CYS B 2 96 ? 41.357 63.016 39.269 1.00 31.80 ? 92 CYS H N 1 ATOM 2350 C CA . CYS B 2 96 ? 40.759 63.668 40.427 1.00 32.37 ? 92 CYS H CA 1 ATOM 2351 C C . CYS B 2 96 ? 41.856 64.489 41.105 1.00 39.59 ? 92 CYS H C 1 ATOM 2352 O O . CYS B 2 96 ? 43.040 64.170 40.986 1.00 33.15 ? 92 CYS H O 1 ATOM 2353 C CB . CYS B 2 96 ? 40.135 62.655 41.399 1.00 35.22 ? 92 CYS H CB 1 ATOM 2354 S SG . CYS B 2 96 ? 41.286 61.586 42.307 1.00 53.64 ? 92 CYS H SG 1 ATOM 2355 N N . ALA B 2 97 ? 41.465 65.554 41.796 1.00 36.21 ? 93 ALA H N 1 ATOM 2356 C CA . ALA B 2 97 ? 42.430 66.436 42.434 1.00 35.34 ? 93 ALA H CA 1 ATOM 2357 C C . ALA B 2 97 ? 41.815 67.164 43.625 1.00 36.88 ? 93 ALA H C 1 ATOM 2358 O O . ALA B 2 97 ? 40.640 67.522 43.602 1.00 38.62 ? 93 ALA H O 1 ATOM 2359 C CB . ALA B 2 97 ? 42.977 67.435 41.423 1.00 33.73 ? 93 ALA H CB 1 ATOM 2360 N N . ARG B 2 98 ? 42.618 67.376 44.664 1.00 39.33 ? 94 ARG H N 1 ATOM 2361 C CA . ARG B 2 98 ? 42.155 68.063 45.867 1.00 38.66 ? 94 ARG H CA 1 ATOM 2362 C C . ARG B 2 98 ? 42.319 69.574 45.743 1.00 42.81 ? 94 ARG H C 1 ATOM 2363 O O . ARG B 2 98 ? 43.351 70.056 45.274 1.00 43.30 ? 94 ARG H O 1 ATOM 2364 C CB . ARG B 2 98 ? 42.911 67.562 47.102 1.00 33.89 ? 94 ARG H CB 1 ATOM 2365 C CG . ARG B 2 98 ? 42.337 68.070 48.419 1.00 37.05 ? 94 ARG H CG 1 ATOM 2366 C CD . ARG B 2 98 ? 43.207 67.699 49.614 1.00 42.71 ? 94 ARG H CD 1 ATOM 2367 N NE . ARG B 2 98 ? 44.429 68.495 49.674 1.00 45.90 ? 94 ARG H NE 1 ATOM 2368 C CZ . ARG B 2 98 ? 45.274 68.491 50.700 1.00 44.83 ? 94 ARG H CZ 1 ATOM 2369 N NH1 . ARG B 2 98 ? 45.032 67.731 51.760 1.00 40.33 ? 94 ARG H NH1 1 ATOM 2370 N NH2 . ARG B 2 98 ? 46.362 69.248 50.668 1.00 35.52 ? 94 ARG H NH2 1 ATOM 2371 N N . VAL B 2 99 ? 41.300 70.320 46.158 1.00 41.22 ? 95 VAL H N 1 ATOM 2372 C CA . VAL B 2 99 ? 41.403 71.774 46.213 1.00 40.73 ? 95 VAL H CA 1 ATOM 2373 C C . VAL B 2 99 ? 42.104 72.173 47.507 1.00 40.06 ? 95 VAL H C 1 ATOM 2374 O O . VAL B 2 99 ? 41.461 72.395 48.531 1.00 39.89 ? 95 VAL H O 1 ATOM 2375 C CB . VAL B 2 99 ? 40.019 72.452 46.127 1.00 44.24 ? 95 VAL H CB 1 ATOM 2376 C CG1 . VAL B 2 99 ? 40.169 73.964 46.025 1.00 37.12 ? 95 VAL H CG1 1 ATOM 2377 C CG2 . VAL B 2 99 ? 39.237 71.912 44.937 1.00 33.25 ? 95 VAL H CG2 1 ATOM 2378 N N . GLY B 2 100 ? 43.430 72.253 47.456 1.00 42.82 ? 96 GLY H N 1 ATOM 2379 C CA . GLY B 2 100 ? 44.227 72.501 48.645 1.00 39.36 ? 96 GLY H CA 1 ATOM 2380 C C . GLY B 2 100 ? 44.269 73.942 49.117 1.00 38.84 ? 96 GLY H C 1 ATOM 2381 O O . GLY B 2 100 ? 44.422 74.205 50.308 1.00 43.12 ? 96 GLY H O 1 ATOM 2382 N N . TYR B 2 101 ? 44.137 74.880 48.184 1.00 38.31 ? 97 TYR H N 1 ATOM 2383 C CA . TYR B 2 101 ? 44.223 76.302 48.511 1.00 40.25 ? 97 TYR H CA 1 ATOM 2384 C C . TYR B 2 101 ? 43.000 77.061 48.017 1.00 44.92 ? 97 TYR H C 1 ATOM 2385 O O . TYR B 2 101 ? 42.738 77.105 46.819 1.00 52.19 ? 97 TYR H O 1 ATOM 2386 C CB . TYR B 2 101 ? 45.488 76.917 47.908 1.00 35.55 ? 97 TYR H CB 1 ATOM 2387 C CG . TYR B 2 101 ? 46.753 76.187 48.276 1.00 34.92 ? 97 TYR H CG 1 ATOM 2388 C CD1 . TYR B 2 101 ? 47.430 76.481 49.453 1.00 35.42 ? 97 TYR H CD1 1 ATOM 2389 C CD2 . TYR B 2 101 ? 47.272 75.203 47.448 1.00 37.60 ? 97 TYR H CD2 1 ATOM 2390 C CE1 . TYR B 2 101 ? 48.585 75.817 49.795 1.00 35.70 ? 97 TYR H CE1 1 ATOM 2391 C CE2 . TYR B 2 101 ? 48.431 74.529 47.783 1.00 39.16 ? 97 TYR H CE2 1 ATOM 2392 C CZ . TYR B 2 101 ? 49.083 74.842 48.959 1.00 36.93 ? 97 TYR H CZ 1 ATOM 2393 O OH . TYR B 2 101 ? 50.235 74.179 49.299 1.00 42.63 ? 97 TYR H OH 1 ATOM 2394 N N . CYS B 2 102 ? 42.263 77.667 48.943 1.00 43.93 ? 98 CYS H N 1 ATOM 2395 C CA . CYS B 2 102 ? 41.070 78.436 48.602 1.00 43.15 ? 98 CYS H CA 1 ATOM 2396 C C . CYS B 2 102 ? 41.398 79.650 47.734 1.00 40.33 ? 98 CYS H C 1 ATOM 2397 O O . CYS B 2 102 ? 42.390 80.334 47.966 1.00 43.04 ? 98 CYS H O 1 ATOM 2398 C CB . CYS B 2 102 ? 40.348 78.895 49.877 1.00 42.26 ? 98 CYS H CB 1 ATOM 2399 S SG . CYS B 2 102 ? 39.614 77.583 50.886 1.00 82.96 ? 98 CYS H SG 1 ATOM 2400 N N . SER B 2 103 ? 40.557 79.922 46.740 1.00 39.25 ? 99 SER H N 1 ATOM 2401 C CA . SER B 2 103 ? 40.684 81.149 45.960 1.00 38.27 ? 99 SER H CA 1 ATOM 2402 C C . SER B 2 103 ? 40.097 82.310 46.752 1.00 35.31 ? 99 SER H C 1 ATOM 2403 O O . SER B 2 103 ? 39.740 82.154 47.917 1.00 38.32 ? 99 SER H O 1 ATOM 2404 C CB . SER B 2 103 ? 39.988 81.024 44.602 1.00 39.87 ? 99 SER H CB 1 ATOM 2405 O OG . SER B 2 103 ? 38.590 80.897 44.755 1.00 42.27 ? 99 SER H OG 1 ATOM 2406 N N . SER B 2 104 ? 39.988 83.472 46.120 1.00 36.17 ? 100 SER H N 1 ATOM 2407 C CA . SER B 2 104 ? 39.491 84.652 46.817 1.00 42.09 ? 100 SER H CA 1 ATOM 2408 C C . SER B 2 104 ? 37.970 84.632 46.979 1.00 48.56 ? 100 SER H C 1 ATOM 2409 O O . SER B 2 104 ? 37.428 85.389 47.780 1.00 53.35 ? 100 SER H O 1 ATOM 2410 C CB . SER B 2 104 ? 39.915 85.929 46.085 1.00 38.72 ? 100 SER H CB 1 ATOM 2411 O OG . SER B 2 104 ? 39.160 86.114 44.901 1.00 41.58 ? 100 SER H OG 1 ATOM 2412 N N . THR B 2 105 A 37.287 83.765 46.233 1.00 49.93 ? 100 THR H N 1 ATOM 2413 C CA . THR B 2 105 A 35.820 83.727 46.263 1.00 47.83 ? 100 THR H CA 1 ATOM 2414 C C . THR B 2 105 A 35.231 82.522 47.002 1.00 45.54 ? 100 THR H C 1 ATOM 2415 O O . THR B 2 105 A 34.129 82.613 47.540 1.00 49.92 ? 100 THR H O 1 ATOM 2416 C CB . THR B 2 105 A 35.223 83.745 44.840 1.00 45.02 ? 100 THR H CB 1 ATOM 2417 O OG1 . THR B 2 105 A 35.756 82.656 44.074 1.00 47.17 ? 100 THR H OG1 1 ATOM 2418 C CG2 . THR B 2 105 A 35.539 85.056 44.142 1.00 43.99 ? 100 THR H CG2 1 ATOM 2419 N N . SER B 2 106 B 35.944 81.398 47.020 1.00 41.40 ? 100 SER H N 1 ATOM 2420 C CA . SER B 2 106 B 35.467 80.216 47.741 1.00 43.31 ? 100 SER H CA 1 ATOM 2421 C C . SER B 2 106 B 36.572 79.188 47.978 1.00 44.59 ? 100 SER H C 1 ATOM 2422 O O . SER B 2 106 B 37.739 79.428 47.654 1.00 45.56 ? 100 SER H O 1 ATOM 2423 C CB . SER B 2 106 B 34.302 79.559 46.991 1.00 46.75 ? 100 SER H CB 1 ATOM 2424 O OG . SER B 2 106 B 34.711 79.050 45.733 1.00 48.99 ? 100 SER H OG 1 ATOM 2425 N N . CYS B 2 107 C 36.195 78.045 48.548 1.00 40.85 ? 100 CYS H N 1 ATOM 2426 C CA . CYS B 2 107 C 37.146 76.980 48.855 1.00 37.21 ? 100 CYS H CA 1 ATOM 2427 C C . CYS B 2 107 C 36.900 75.712 48.037 1.00 42.24 ? 100 CYS H C 1 ATOM 2428 O O . CYS B 2 107 C 37.677 74.760 48.121 1.00 47.15 ? 100 CYS H O 1 ATOM 2429 C CB . CYS B 2 107 C 37.108 76.644 50.346 1.00 36.10 ? 100 CYS H CB 1 ATOM 2430 S SG . CYS B 2 107 C 37.687 77.975 51.420 1.00 47.80 ? 100 CYS H SG 1 ATOM 2431 N N . ASN B 2 108 D 35.818 75.688 47.262 1.00 43.20 ? 100 ASN H N 1 ATOM 2432 C CA . ASN B 2 108 D 35.610 74.609 46.297 1.00 42.93 ? 100 ASN H CA 1 ATOM 2433 C C . ASN B 2 108 D 36.166 75.031 44.941 1.00 43.29 ? 100 ASN H C 1 ATOM 2434 O O . ASN B 2 108 D 36.181 74.256 43.981 1.00 41.17 ? 100 ASN H O 1 ATOM 2435 C CB . ASN B 2 108 D 34.130 74.228 46.193 1.00 43.45 ? 100 ASN H CB 1 ATOM 2436 C CG . ASN B 2 108 D 33.231 75.420 45.949 1.00 46.77 ? 100 ASN H CG 1 ATOM 2437 O OD1 . ASN B 2 108 D 33.569 76.549 46.297 1.00 52.86 ? 100 ASN H OD1 1 ATOM 2438 N ND2 . ASN B 2 108 D 32.068 75.172 45.354 1.00 49.46 ? 100 ASN H ND2 1 ATOM 2439 N N . ARG B 2 109 E 36.618 76.281 44.883 1.00 41.96 ? 100 ARG H N 1 ATOM 2440 C CA . ARG B 2 109 E 37.433 76.775 43.784 1.00 40.09 ? 100 ARG H CA 1 ATOM 2441 C C . ARG B 2 109 E 38.803 77.159 44.323 1.00 45.93 ? 100 ARG H C 1 ATOM 2442 O O . ARG B 2 109 E 38.908 77.819 45.362 1.00 46.86 ? 100 ARG H O 1 ATOM 2443 C CB . ARG B 2 109 E 36.782 77.972 43.097 1.00 39.24 ? 100 ARG H CB 1 ATOM 2444 C CG . ARG B 2 109 E 35.618 77.610 42.198 1.00 46.69 ? 100 ARG H CG 1 ATOM 2445 C CD . ARG B 2 109 E 35.183 78.809 41.375 1.00 49.12 ? 100 ARG H CD 1 ATOM 2446 N NE . ARG B 2 109 E 34.877 79.953 42.226 1.00 53.04 ? 100 ARG H NE 1 ATOM 2447 C CZ . ARG B 2 109 E 33.706 80.141 42.822 1.00 50.08 ? 100 ARG H CZ 1 ATOM 2448 N NH1 . ARG B 2 109 E 32.731 79.258 42.655 1.00 50.15 ? 100 ARG H NH1 1 ATOM 2449 N NH2 . ARG B 2 109 E 33.510 81.208 43.583 1.00 45.69 ? 100 ARG H NH2 1 ATOM 2450 N N . GLY B 2 110 F 39.850 76.741 43.621 1.00 43.47 ? 100 GLY H N 1 ATOM 2451 C CA . GLY B 2 110 F 41.204 76.983 44.070 1.00 32.70 ? 100 GLY H CA 1 ATOM 2452 C C . GLY B 2 110 F 42.188 76.063 43.373 1.00 39.99 ? 100 GLY H C 1 ATOM 2453 O O . GLY B 2 110 F 41.796 75.220 42.562 1.00 42.37 ? 100 GLY H O 1 ATOM 2454 N N . ALA B 2 111 G 43.467 76.222 43.690 1.00 36.36 ? 100 ALA H N 1 ATOM 2455 C CA . ALA B 2 111 G 44.518 75.439 43.055 1.00 36.80 ? 100 ALA H CA 1 ATOM 2456 C C . ALA B 2 111 G 44.485 73.982 43.497 1.00 35.33 ? 100 ALA H C 1 ATOM 2457 O O . ALA B 2 111 G 44.263 73.686 44.670 1.00 35.14 ? 100 ALA H O 1 ATOM 2458 C CB . ALA B 2 111 G 45.873 76.049 43.356 1.00 33.70 ? 100 ALA H CB 1 ATOM 2459 N N . PHE B 2 112 H 44.722 73.080 42.549 1.00 31.36 ? 100 PHE H N 1 ATOM 2460 C CA . PHE B 2 112 H 44.726 71.647 42.827 1.00 31.22 ? 100 PHE H CA 1 ATOM 2461 C C . PHE B 2 112 H 46.123 71.183 43.237 1.00 33.12 ? 100 PHE H C 1 ATOM 2462 O O . PHE B 2 112 H 47.005 71.051 42.391 1.00 38.53 ? 100 PHE H O 1 ATOM 2463 C CB . PHE B 2 112 H 44.249 70.864 41.601 1.00 32.51 ? 100 PHE H CB 1 ATOM 2464 C CG . PHE B 2 112 H 42.936 71.347 41.040 1.00 34.00 ? 100 PHE H CG 1 ATOM 2465 C CD1 . PHE B 2 112 H 42.653 71.206 39.695 1.00 37.74 ? 100 PHE H CD1 1 ATOM 2466 C CD2 . PHE B 2 112 H 41.989 71.938 41.858 1.00 40.27 ? 100 PHE H CD2 1 ATOM 2467 C CE1 . PHE B 2 112 H 41.450 71.650 39.173 1.00 43.24 ? 100 PHE H CE1 1 ATOM 2468 C CE2 . PHE B 2 112 H 40.786 72.385 41.343 1.00 44.48 ? 100 PHE H CE2 1 ATOM 2469 C CZ . PHE B 2 112 H 40.515 72.239 39.998 1.00 39.59 ? 100 PHE H CZ 1 ATOM 2470 N N . ASP B 2 113 ? 46.324 70.936 44.529 1.00 34.55 ? 101 ASP H N 1 ATOM 2471 C CA . ASP B 2 113 ? 47.659 70.617 45.040 1.00 40.19 ? 101 ASP H CA 1 ATOM 2472 C C . ASP B 2 113 ? 47.997 69.125 44.969 1.00 41.39 ? 101 ASP H C 1 ATOM 2473 O O . ASP B 2 113 ? 49.140 68.756 44.720 1.00 43.00 ? 101 ASP H O 1 ATOM 2474 C CB . ASP B 2 113 ? 47.815 71.119 46.483 1.00 42.16 ? 101 ASP H CB 1 ATOM 2475 C CG . ASP B 2 113 ? 46.880 70.422 47.456 1.00 47.41 ? 101 ASP H CG 1 ATOM 2476 O OD1 . ASP B 2 113 ? 45.854 69.862 47.014 1.00 45.62 ? 101 ASP H OD1 1 ATOM 2477 O OD2 . ASP B 2 113 ? 47.171 70.443 48.671 1.00 48.45 ? 101 ASP H OD2 1 ATOM 2478 N N . ILE B 2 114 ? 47.004 68.270 45.184 1.00 44.03 ? 102 ILE H N 1 ATOM 2479 C CA . ILE B 2 114 ? 47.229 66.830 45.151 1.00 42.88 ? 102 ILE H CA 1 ATOM 2480 C C . ILE B 2 114 ? 46.397 66.173 44.055 1.00 46.11 ? 102 ILE H C 1 ATOM 2481 O O . ILE B 2 114 ? 45.187 66.374 43.981 1.00 46.62 ? 102 ILE H O 1 ATOM 2482 C CB . ILE B 2 114 ? 46.903 66.184 46.509 1.00 40.73 ? 102 ILE H CB 1 ATOM 2483 C CG1 . ILE B 2 114 ? 47.722 66.852 47.620 1.00 39.65 ? 102 ILE H CG1 1 ATOM 2484 C CG2 . ILE B 2 114 ? 47.165 64.685 46.464 1.00 38.99 ? 102 ILE H CG2 1 ATOM 2485 C CD1 . ILE B 2 114 ? 47.379 66.363 49.011 1.00 40.57 ? 102 ILE H CD1 1 ATOM 2486 N N . TRP B 2 115 ? 47.056 65.393 43.202 1.00 43.03 ? 103 TRP H N 1 ATOM 2487 C CA . TRP B 2 115 ? 46.396 64.762 42.063 1.00 39.58 ? 103 TRP H CA 1 ATOM 2488 C C . TRP B 2 115 ? 46.423 63.243 42.158 1.00 38.77 ? 103 TRP H C 1 ATOM 2489 O O . TRP B 2 115 ? 47.356 62.667 42.715 1.00 34.39 ? 103 TRP H O 1 ATOM 2490 C CB . TRP B 2 115 ? 47.059 65.194 40.752 1.00 34.51 ? 103 TRP H CB 1 ATOM 2491 C CG . TRP B 2 115 ? 46.939 66.654 40.443 1.00 33.57 ? 103 TRP H CG 1 ATOM 2492 C CD1 . TRP B 2 115 ? 47.509 67.686 41.127 1.00 31.00 ? 103 TRP H CD1 1 ATOM 2493 C CD2 . TRP B 2 115 ? 46.223 67.242 39.350 1.00 33.34 ? 103 TRP H CD2 1 ATOM 2494 N NE1 . TRP B 2 115 ? 47.182 68.882 40.537 1.00 35.72 ? 103 TRP H NE1 1 ATOM 2495 C CE2 . TRP B 2 115 ? 46.394 68.638 39.443 1.00 35.51 ? 103 TRP H CE2 1 ATOM 2496 C CE3 . TRP B 2 115 ? 45.449 66.724 38.305 1.00 31.42 ? 103 TRP H CE3 1 ATOM 2497 C CZ2 . TRP B 2 115 ? 45.821 69.524 38.532 1.00 30.53 ? 103 TRP H CZ2 1 ATOM 2498 C CZ3 . TRP B 2 115 ? 44.879 67.607 37.400 1.00 35.01 ? 103 TRP H CZ3 1 ATOM 2499 C CH2 . TRP B 2 115 ? 45.069 68.991 37.520 1.00 38.04 ? 103 TRP H CH2 1 ATOM 2500 N N . GLY B 2 116 ? 45.394 62.603 41.608 1.00 40.24 ? 104 GLY H N 1 ATOM 2501 C CA . GLY B 2 116 ? 45.382 61.158 41.460 1.00 32.19 ? 104 GLY H CA 1 ATOM 2502 C C . GLY B 2 116 ? 46.227 60.748 40.266 1.00 39.22 ? 104 GLY H C 1 ATOM 2503 O O . GLY B 2 116 ? 46.652 61.606 39.485 1.00 34.06 ? 104 GLY H O 1 ATOM 2504 N N . GLN B 2 117 ? 46.471 59.448 40.114 1.00 32.01 ? 105 GLN H N 1 ATOM 2505 C CA . GLN B 2 117 ? 47.341 58.958 39.047 1.00 34.26 ? 105 GLN H CA 1 ATOM 2506 C C . GLN B 2 117 ? 46.647 58.988 37.691 1.00 40.47 ? 105 GLN H C 1 ATOM 2507 O O . GLN B 2 117 ? 47.271 58.744 36.659 1.00 47.55 ? 105 GLN H O 1 ATOM 2508 C CB . GLN B 2 117 ? 47.820 57.537 39.349 1.00 33.33 ? 105 GLN H CB 1 ATOM 2509 C CG . GLN B 2 117 ? 46.805 56.441 39.040 1.00 38.08 ? 105 GLN H CG 1 ATOM 2510 C CD . GLN B 2 117 ? 45.799 56.232 40.156 1.00 43.02 ? 105 GLN H CD 1 ATOM 2511 O OE1 . GLN B 2 117 ? 45.583 57.111 40.994 1.00 45.25 ? 105 GLN H OE1 1 ATOM 2512 N NE2 . GLN B 2 117 ? 45.181 55.058 40.175 1.00 45.88 ? 105 GLN H NE2 1 ATOM 2513 N N . GLY B 2 118 ? 45.353 59.283 37.698 1.00 39.44 ? 106 GLY H N 1 ATOM 2514 C CA . GLY B 2 118 ? 44.590 59.360 36.471 1.00 35.60 ? 106 GLY H CA 1 ATOM 2515 C C . GLY B 2 118 ? 43.990 58.027 36.079 1.00 39.47 ? 106 GLY H C 1 ATOM 2516 O O . GLY B 2 118 ? 44.471 56.966 36.481 1.00 42.24 ? 106 GLY H O 1 ATOM 2517 N N . THR B 2 119 ? 42.922 58.088 35.293 1.00 37.98 ? 107 THR H N 1 ATOM 2518 C CA . THR B 2 119 ? 42.265 56.893 34.803 1.00 33.59 ? 107 THR H CA 1 ATOM 2519 C C . THR B 2 119 ? 42.028 57.028 33.307 1.00 40.62 ? 107 THR H C 1 ATOM 2520 O O . THR B 2 119 ? 41.358 57.957 32.856 1.00 45.82 ? 107 THR H O 1 ATOM 2521 C CB . THR B 2 119 ? 40.931 56.640 35.525 1.00 35.66 ? 107 THR H CB 1 ATOM 2522 O OG1 . THR B 2 119 ? 41.180 56.285 36.891 1.00 34.90 ? 107 THR H OG1 1 ATOM 2523 C CG2 . THR B 2 119 ? 40.164 55.513 34.850 1.00 33.45 ? 107 THR H CG2 1 ATOM 2524 N N . MET B 2 120 ? 42.599 56.110 32.536 1.00 38.64 ? 108 MET H N 1 ATOM 2525 C CA . MET B 2 120 ? 42.410 56.117 31.094 1.00 36.74 ? 108 MET H CA 1 ATOM 2526 C C . MET B 2 120 ? 41.045 55.539 30.742 1.00 39.71 ? 108 MET H C 1 ATOM 2527 O O . MET B 2 120 ? 40.689 54.448 31.191 1.00 40.00 ? 108 MET H O 1 ATOM 2528 C CB . MET B 2 120 ? 43.521 55.325 30.397 1.00 34.12 ? 108 MET H CB 1 ATOM 2529 C CG . MET B 2 120 ? 43.466 55.397 28.875 1.00 39.32 ? 108 MET H CG 1 ATOM 2530 S SD . MET B 2 120 ? 43.566 57.089 28.258 1.00 98.65 ? 108 MET H SD 1 ATOM 2531 C CE . MET B 2 120 ? 43.404 56.840 26.494 1.00 39.36 ? 108 MET H CE 1 ATOM 2532 N N . VAL B 2 121 ? 40.276 56.283 29.954 1.00 39.34 ? 109 VAL H N 1 ATOM 2533 C CA . VAL B 2 121 ? 38.987 55.804 29.469 1.00 38.63 ? 109 VAL H CA 1 ATOM 2534 C C . VAL B 2 121 ? 38.946 55.877 27.947 1.00 38.69 ? 109 VAL H C 1 ATOM 2535 O O . VAL B 2 121 ? 39.126 56.946 27.363 1.00 38.69 ? 109 VAL H O 1 ATOM 2536 C CB . VAL B 2 121 ? 37.808 56.617 30.052 1.00 37.19 ? 109 VAL H CB 1 ATOM 2537 C CG1 . VAL B 2 121 ? 36.491 56.143 29.454 1.00 36.56 ? 109 VAL H CG1 1 ATOM 2538 C CG2 . VAL B 2 121 ? 37.778 56.510 31.566 1.00 37.43 ? 109 VAL H CG2 1 ATOM 2539 N N . THR B 2 122 ? 38.709 54.738 27.307 1.00 38.53 ? 110 THR H N 1 ATOM 2540 C CA . THR B 2 122 ? 38.669 54.681 25.853 1.00 35.93 ? 110 THR H CA 1 ATOM 2541 C C . THR B 2 122 ? 37.273 54.333 25.359 1.00 39.28 ? 110 THR H C 1 ATOM 2542 O O . THR B 2 122 ? 36.706 53.312 25.740 1.00 45.00 ? 110 THR H O 1 ATOM 2543 C CB . THR B 2 122 ? 39.673 53.659 25.305 1.00 32.94 ? 110 THR H CB 1 ATOM 2544 O OG1 . THR B 2 122 ? 40.995 54.021 25.725 1.00 39.06 ? 110 THR H OG1 1 ATOM 2545 C CG2 . THR B 2 122 ? 39.625 53.624 23.784 1.00 38.66 ? 110 THR H CG2 1 ATOM 2546 N N . VAL B 2 123 ? 36.718 55.195 24.515 1.00 42.12 ? 111 VAL H N 1 ATOM 2547 C CA . VAL B 2 123 ? 35.388 54.973 23.966 1.00 44.00 ? 111 VAL H CA 1 ATOM 2548 C C . VAL B 2 123 ? 35.473 54.720 22.471 1.00 46.95 ? 111 VAL H C 1 ATOM 2549 O O . VAL B 2 123 ? 35.842 55.604 21.699 1.00 50.31 ? 111 VAL H O 1 ATOM 2550 C CB . VAL B 2 123 ? 34.455 56.166 24.229 1.00 45.85 ? 111 VAL H CB 1 ATOM 2551 C CG1 . VAL B 2 123 ? 33.038 55.829 23.792 1.00 41.39 ? 111 VAL H CG1 1 ATOM 2552 C CG2 . VAL B 2 123 ? 34.482 56.542 25.701 1.00 39.77 ? 111 VAL H CG2 1 ATOM 2553 N N . SER B 2 124 ? 35.129 53.504 22.068 1.00 48.43 ? 112 SER H N 1 ATOM 2554 C CA . SER B 2 124 ? 35.260 53.101 20.678 1.00 48.16 ? 112 SER H CA 1 ATOM 2555 C C . SER B 2 124 ? 34.348 51.925 20.370 1.00 49.20 ? 112 SER H C 1 ATOM 2556 O O . SER B 2 124 ? 33.969 51.168 21.264 1.00 52.23 ? 112 SER H O 1 ATOM 2557 C CB . SER B 2 124 ? 36.716 52.743 20.364 1.00 41.77 ? 112 SER H CB 1 ATOM 2558 O OG . SER B 2 124 ? 36.843 52.192 19.066 1.00 43.82 ? 112 SER H OG 1 ATOM 2559 N N . SER B 2 125 ? 33.995 51.780 19.099 1.00 49.68 ? 113 SER H N 1 ATOM 2560 C CA . SER B 2 125 ? 33.167 50.663 18.666 1.00 48.69 ? 113 SER H CA 1 ATOM 2561 C C . SER B 2 125 ? 34.011 49.403 18.513 1.00 44.73 ? 113 SER H C 1 ATOM 2562 O O . SER B 2 125 ? 33.483 48.306 18.363 1.00 51.73 ? 113 SER H O 1 ATOM 2563 C CB . SER B 2 125 ? 32.461 50.996 17.352 1.00 53.48 ? 113 SER H CB 1 ATOM 2564 O OG . SER B 2 125 ? 31.609 52.117 17.507 1.00 63.97 ? 113 SER H OG 1 ATOM 2565 N N . ALA B 2 126 ? 35.328 49.570 18.555 1.00 42.43 ? 114 ALA H N 1 ATOM 2566 C CA . ALA B 2 126 ? 36.245 48.443 18.432 1.00 46.46 ? 114 ALA H CA 1 ATOM 2567 C C . ALA B 2 126 ? 36.211 47.571 19.680 1.00 46.44 ? 114 ALA H C 1 ATOM 2568 O O . ALA B 2 126 ? 35.912 48.044 20.777 1.00 44.99 ? 114 ALA H O 1 ATOM 2569 C CB . ALA B 2 126 ? 37.659 48.933 18.174 1.00 37.00 ? 114 ALA H CB 1 ATOM 2570 N N . SER B 2 127 ? 36.516 46.291 19.506 1.00 46.84 ? 115 SER H N 1 ATOM 2571 C CA . SER B 2 127 ? 36.583 45.366 20.629 1.00 48.13 ? 115 SER H CA 1 ATOM 2572 C C . SER B 2 127 ? 38.032 45.057 20.977 1.00 44.54 ? 115 SER H C 1 ATOM 2573 O O . SER B 2 127 ? 38.918 45.178 20.133 1.00 45.78 ? 115 SER H O 1 ATOM 2574 C CB . SER B 2 127 ? 35.824 44.077 20.313 1.00 51.84 ? 115 SER H CB 1 ATOM 2575 O OG . SER B 2 127 ? 34.438 44.335 20.167 1.00 58.57 ? 115 SER H OG 1 ATOM 2576 N N . THR B 2 128 ? 38.265 44.669 22.226 1.00 43.19 ? 116 THR H N 1 ATOM 2577 C CA . THR B 2 128 ? 39.607 44.371 22.708 1.00 48.51 ? 116 THR H CA 1 ATOM 2578 C C . THR B 2 128 ? 40.261 43.264 21.883 1.00 51.48 ? 116 THR H C 1 ATOM 2579 O O . THR B 2 128 ? 39.664 42.212 21.653 1.00 52.46 ? 116 THR H O 1 ATOM 2580 C CB . THR B 2 128 ? 39.586 43.967 24.194 1.00 49.27 ? 116 THR H CB 1 ATOM 2581 O OG1 . THR B 2 128 ? 38.997 45.022 24.966 1.00 51.80 ? 116 THR H OG1 1 ATOM 2582 C CG2 . THR B 2 128 ? 40.995 43.698 24.702 1.00 49.15 ? 116 THR H CG2 1 ATOM 2583 N N . LYS B 2 129 ? 41.485 43.516 21.429 1.00 50.06 ? 117 LYS H N 1 ATOM 2584 C CA . LYS B 2 129 ? 42.201 42.575 20.577 1.00 50.39 ? 117 LYS H CA 1 ATOM 2585 C C . LYS B 2 129 ? 43.707 42.619 20.838 1.00 48.53 ? 117 LYS H C 1 ATOM 2586 O O . LYS B 2 129 ? 44.304 43.693 20.907 1.00 37.98 ? 117 LYS H O 1 ATOM 2587 C CB . LYS B 2 129 ? 41.913 42.870 19.101 1.00 47.47 ? 117 LYS H CB 1 ATOM 2588 C CG . LYS B 2 129 ? 42.688 42.000 18.125 1.00 49.03 ? 117 LYS H CG 1 ATOM 2589 C CD . LYS B 2 129 ? 42.490 42.463 16.688 1.00 52.00 ? 117 LYS H CD 1 ATOM 2590 C CE . LYS B 2 129 ? 43.404 41.709 15.733 1.00 56.40 ? 117 LYS H CE 1 ATOM 2591 N NZ . LYS B 2 129 ? 43.180 40.237 15.796 1.00 64.92 ? 117 LYS H NZ 1 ATOM 2592 N N . GLY B 2 130 ? 44.314 41.444 20.983 1.00 49.39 ? 118 GLY H N 1 ATOM 2593 C CA . GLY B 2 130 ? 45.747 41.346 21.187 1.00 45.45 ? 118 GLY H CA 1 ATOM 2594 C C . GLY B 2 130 ? 46.516 41.671 19.922 1.00 43.42 ? 118 GLY H C 1 ATOM 2595 O O . GLY B 2 130 ? 45.993 41.519 18.819 1.00 40.13 ? 118 GLY H O 1 ATOM 2596 N N . PRO B 2 131 ? 47.771 42.119 20.076 1.00 45.71 ? 119 PRO H N 1 ATOM 2597 C CA . PRO B 2 131 ? 48.607 42.553 18.952 1.00 45.43 ? 119 PRO H CA 1 ATOM 2598 C C . PRO B 2 131 ? 49.286 41.414 18.192 1.00 42.78 ? 119 PRO H C 1 ATOM 2599 O O . PRO B 2 131 ? 49.596 40.369 18.765 1.00 40.68 ? 119 PRO H O 1 ATOM 2600 C CB . PRO B 2 131 ? 49.659 43.428 19.633 1.00 44.33 ? 119 PRO H CB 1 ATOM 2601 C CG . PRO B 2 131 ? 49.818 42.812 20.980 1.00 40.96 ? 119 PRO H CG 1 ATOM 2602 C CD . PRO B 2 131 ? 48.441 42.331 21.372 1.00 45.47 ? 119 PRO H CD 1 ATOM 2603 N N . SER B 2 132 ? 49.502 41.631 16.899 1.00 43.79 ? 120 SER H N 1 ATOM 2604 C CA . SER B 2 132 ? 50.363 40.770 16.101 1.00 46.40 ? 120 SER H CA 1 ATOM 2605 C C . SER B 2 132 ? 51.751 41.391 16.060 1.00 47.94 ? 120 SER H C 1 ATOM 2606 O O . SER B 2 132 ? 51.922 42.507 15.571 1.00 50.26 ? 120 SER H O 1 ATOM 2607 C CB . SER B 2 132 ? 49.812 40.590 14.685 1.00 49.43 ? 120 SER H CB 1 ATOM 2608 O OG . SER B 2 132 ? 48.586 39.881 14.694 1.00 62.07 ? 120 SER H OG 1 ATOM 2609 N N . VAL B 2 133 ? 52.741 40.674 16.582 1.00 45.89 ? 121 VAL H N 1 ATOM 2610 C CA . VAL B 2 133 ? 54.093 41.213 16.671 1.00 45.36 ? 121 VAL H CA 1 ATOM 2611 C C . VAL B 2 133 ? 54.978 40.716 15.536 1.00 44.30 ? 121 VAL H C 1 ATOM 2612 O O . VAL B 2 133 ? 55.269 39.526 15.436 1.00 45.16 ? 121 VAL H O 1 ATOM 2613 C CB . VAL B 2 133 ? 54.753 40.855 18.014 1.00 42.03 ? 121 VAL H CB 1 ATOM 2614 C CG1 . VAL B 2 133 ? 56.146 41.462 18.095 1.00 38.25 ? 121 VAL H CG1 1 ATOM 2615 C CG2 . VAL B 2 133 ? 53.886 41.334 19.169 1.00 35.98 ? 121 VAL H CG2 1 ATOM 2616 N N . PHE B 2 134 ? 55.406 41.641 14.684 1.00 44.38 ? 122 PHE H N 1 ATOM 2617 C CA . PHE B 2 134 ? 56.271 41.305 13.561 1.00 45.70 ? 122 PHE H CA 1 ATOM 2618 C C . PHE B 2 134 ? 57.652 41.920 13.748 1.00 49.89 ? 122 PHE H C 1 ATOM 2619 O O . PHE B 2 134 ? 57.777 43.036 14.254 1.00 54.44 ? 122 PHE H O 1 ATOM 2620 C CB . PHE B 2 134 ? 55.653 41.773 12.242 1.00 46.15 ? 122 PHE H CB 1 ATOM 2621 C CG . PHE B 2 134 ? 54.265 41.252 12.005 1.00 48.80 ? 122 PHE H CG 1 ATOM 2622 C CD1 . PHE B 2 134 ? 54.032 39.891 11.882 1.00 46.24 ? 122 PHE H CD1 1 ATOM 2623 C CD2 . PHE B 2 134 ? 53.192 42.124 11.892 1.00 50.79 ? 122 PHE H CD2 1 ATOM 2624 C CE1 . PHE B 2 134 ? 52.753 39.408 11.660 1.00 45.25 ? 122 PHE H CE1 1 ATOM 2625 C CE2 . PHE B 2 134 ? 51.911 41.645 11.669 1.00 51.99 ? 122 PHE H CE2 1 ATOM 2626 C CZ . PHE B 2 134 ? 51.694 40.286 11.553 1.00 47.81 ? 122 PHE H CZ 1 ATOM 2627 N N . PRO B 2 135 ? 58.700 41.188 13.346 1.00 49.33 ? 123 PRO H N 1 ATOM 2628 C CA . PRO B 2 135 ? 60.069 41.681 13.514 1.00 50.05 ? 123 PRO H CA 1 ATOM 2629 C C . PRO B 2 135 ? 60.474 42.688 12.447 1.00 44.42 ? 123 PRO H C 1 ATOM 2630 O O . PRO B 2 135 ? 60.059 42.581 11.294 1.00 41.63 ? 123 PRO H O 1 ATOM 2631 C CB . PRO B 2 135 ? 60.910 40.407 13.403 1.00 49.87 ? 123 PRO H CB 1 ATOM 2632 C CG . PRO B 2 135 ? 60.120 39.536 12.488 1.00 49.03 ? 123 PRO H CG 1 ATOM 2633 C CD . PRO B 2 135 ? 58.668 39.828 12.779 1.00 50.54 ? 123 PRO H CD 1 ATOM 2634 N N . LEU B 2 136 ? 61.276 43.667 12.848 1.00 39.04 ? 124 LEU H N 1 ATOM 2635 C CA . LEU B 2 136 ? 61.919 44.574 11.910 1.00 40.07 ? 124 LEU H CA 1 ATOM 2636 C C . LEU B 2 136 ? 63.384 44.173 11.773 1.00 43.67 ? 124 LEU H C 1 ATOM 2637 O O . LEU B 2 136 ? 64.237 44.638 12.527 1.00 48.89 ? 124 LEU H O 1 ATOM 2638 C CB . LEU B 2 136 ? 61.786 46.020 12.381 1.00 34.11 ? 124 LEU H CB 1 ATOM 2639 C CG . LEU B 2 136 ? 60.338 46.472 12.576 1.00 32.59 ? 124 LEU H CG 1 ATOM 2640 C CD1 . LEU B 2 136 ? 60.270 47.827 13.265 1.00 35.60 ? 124 LEU H CD1 1 ATOM 2641 C CD2 . LEU B 2 136 ? 59.625 46.508 11.238 1.00 32.70 ? 124 LEU H CD2 1 ATOM 2642 N N . ALA B 2 137 ? 63.660 43.293 10.815 1.00 43.89 ? 125 ALA H N 1 ATOM 2643 C CA . ALA B 2 137 ? 64.987 42.710 10.654 1.00 47.42 ? 125 ALA H CA 1 ATOM 2644 C C . ALA B 2 137 ? 66.040 43.743 10.272 1.00 52.39 ? 125 ALA H C 1 ATOM 2645 O O . ALA B 2 137 ? 65.792 44.611 9.437 1.00 56.63 ? 125 ALA H O 1 ATOM 2646 C CB . ALA B 2 137 ? 64.948 41.598 9.614 1.00 48.28 ? 125 ALA H CB 1 ATOM 2647 N N . PRO B 2 138 ? 67.224 43.650 10.894 1.00 56.95 ? 126 PRO H N 1 ATOM 2648 C CA . PRO B 2 138 ? 68.376 44.479 10.526 1.00 58.13 ? 126 PRO H CA 1 ATOM 2649 C C . PRO B 2 138 ? 69.018 44.012 9.227 1.00 60.78 ? 126 PRO H C 1 ATOM 2650 O O . PRO B 2 138 ? 69.033 42.813 8.942 1.00 59.31 ? 126 PRO H O 1 ATOM 2651 C CB . PRO B 2 138 ? 69.333 44.288 11.703 1.00 56.55 ? 126 PRO H CB 1 ATOM 2652 C CG . PRO B 2 138 ? 69.010 42.927 12.213 1.00 56.69 ? 126 PRO H CG 1 ATOM 2653 C CD . PRO B 2 138 ? 67.517 42.792 12.056 1.00 56.50 ? 126 PRO H CD 1 ATOM 2654 N N . SER B 2 139 ? 69.541 44.955 8.451 1.00 66.60 ? 127 SER H N 1 ATOM 2655 C CA . SER B 2 139 ? 70.212 44.638 7.197 1.00 71.40 ? 127 SER H CA 1 ATOM 2656 C C . SER B 2 139 ? 71.133 45.776 6.787 1.00 76.00 ? 127 SER H C 1 ATOM 2657 O O . SER B 2 139 ? 71.381 46.696 7.568 1.00 76.80 ? 127 SER H O 1 ATOM 2658 C CB . SER B 2 139 ? 69.194 44.366 6.089 1.00 72.63 ? 127 SER H CB 1 ATOM 2659 O OG . SER B 2 139 ? 68.465 45.540 5.774 1.00 73.11 ? 127 SER H OG 1 ATOM 2660 N N . SER B 2 140 ? 71.633 45.712 5.557 1.00 77.79 ? 128 SER H N 1 ATOM 2661 C CA . SER B 2 140 ? 72.446 46.786 5.004 1.00 80.15 ? 128 SER H CA 1 ATOM 2662 C C . SER B 2 140 ? 71.612 48.047 4.813 1.00 81.23 ? 128 SER H C 1 ATOM 2663 O O . SER B 2 140 ? 72.136 49.161 4.830 1.00 86.39 ? 128 SER H O 1 ATOM 2664 C CB . SER B 2 140 ? 73.066 46.358 3.674 1.00 86.83 ? 128 SER H CB 1 ATOM 2665 O OG . SER B 2 140 ? 72.062 45.983 2.747 1.00 88.30 ? 128 SER H OG 1 ATOM 2666 N N . LYS B 2 141 ? 70.307 47.864 4.634 1.00 77.08 ? 129 LYS H N 1 ATOM 2667 C CA . LYS B 2 141 ? 69.393 48.987 4.463 1.00 75.32 ? 129 LYS H CA 1 ATOM 2668 C C . LYS B 2 141 ? 68.947 49.538 5.815 1.00 74.56 ? 129 LYS H C 1 ATOM 2669 O O . LYS B 2 141 ? 68.059 50.388 5.889 1.00 69.51 ? 129 LYS H O 1 ATOM 2670 C CB . LYS B 2 141 ? 68.179 48.571 3.629 1.00 71.10 ? 129 LYS H CB 1 ATOM 2671 C CG . LYS B 2 141 ? 68.505 48.272 2.170 1.00 77.74 ? 129 LYS H CG 1 ATOM 2672 C CD . LYS B 2 141 ? 69.016 49.514 1.451 1.00 83.42 ? 129 LYS H CD 1 ATOM 2673 C CE . LYS B 2 141 ? 69.407 49.210 0.011 1.00 95.03 ? 129 LYS H CE 1 ATOM 2674 N NZ . LYS B 2 141 ? 70.588 48.305 -0.073 1.00 101.70 ? 129 LYS H NZ 1 ATOM 2675 N N . SER B 2 142 ? 69.570 49.044 6.882 1.00 75.79 ? 130 SER H N 1 ATOM 2676 C CA . SER B 2 142 ? 69.310 49.545 8.226 1.00 70.66 ? 130 SER H CA 1 ATOM 2677 C C . SER B 2 142 ? 70.618 49.718 8.996 1.00 67.65 ? 130 SER H C 1 ATOM 2678 O O . SER B 2 142 ? 70.616 49.954 10.203 1.00 62.72 ? 130 SER H O 1 ATOM 2679 C CB . SER B 2 142 ? 68.365 48.608 8.979 1.00 68.45 ? 130 SER H CB 1 ATOM 2680 O OG . SER B 2 142 ? 68.891 47.294 9.032 1.00 73.95 ? 130 SER H OG 1 ATOM 2681 N N . THR B 2 143 ? 71.734 49.602 8.283 1.00 76.15 ? 131 THR H N 1 ATOM 2682 C CA . THR B 2 143 ? 73.054 49.770 8.880 1.00 82.24 ? 131 THR H CA 1 ATOM 2683 C C . THR B 2 143 ? 73.727 51.034 8.351 1.00 92.05 ? 131 THR H C 1 ATOM 2684 O O . THR B 2 143 ? 73.666 51.325 7.156 1.00 95.99 ? 131 THR H O 1 ATOM 2685 C CB . THR B 2 143 ? 73.961 48.553 8.597 1.00 81.95 ? 131 THR H CB 1 ATOM 2686 O OG1 . THR B 2 143 ? 73.274 47.347 8.950 1.00 81.38 ? 131 THR H OG1 1 ATOM 2687 C CG2 . THR B 2 143 ? 75.253 48.646 9.395 1.00 82.22 ? 131 THR H CG2 1 ATOM 2688 N N . SER B 2 144 ? 74.361 51.787 9.245 1.00 97.67 ? 132 SER H N 1 ATOM 2689 C CA . SER B 2 144 ? 75.082 52.992 8.851 1.00 102.57 ? 132 SER H CA 1 ATOM 2690 C C . SER B 2 144 ? 76.405 53.126 9.599 1.00 103.54 ? 132 SER H C 1 ATOM 2691 O O . SER B 2 144 ? 76.489 53.819 10.614 1.00 102.28 ? 132 SER H O 1 ATOM 2692 C CB . SER B 2 144 ? 74.221 54.236 9.086 1.00 105.82 ? 132 SER H CB 1 ATOM 2693 O OG . SER B 2 144 ? 73.917 54.395 10.460 1.00 107.41 ? 132 SER H OG 1 ATOM 2694 N N . GLY B 2 145 ? 77.435 52.454 9.090 1.00 104.25 ? 133 GLY H N 1 ATOM 2695 C CA . GLY B 2 145 ? 78.772 52.558 9.644 1.00 100.96 ? 133 GLY H CA 1 ATOM 2696 C C . GLY B 2 145 ? 78.911 52.088 11.080 1.00 91.50 ? 133 GLY H C 1 ATOM 2697 O O . GLY B 2 145 ? 79.107 52.895 11.988 1.00 90.49 ? 133 GLY H O 1 ATOM 2698 N N . GLY B 2 146 ? 78.809 50.781 11.288 1.00 84.08 ? 134 GLY H N 1 ATOM 2699 C CA . GLY B 2 146 ? 79.037 50.205 12.600 1.00 86.13 ? 134 GLY H CA 1 ATOM 2700 C C . GLY B 2 146 ? 77.800 50.069 13.466 1.00 78.84 ? 134 GLY H C 1 ATOM 2701 O O . GLY B 2 146 ? 77.781 49.269 14.400 1.00 73.79 ? 134 GLY H O 1 ATOM 2702 N N . THR B 2 147 ? 76.768 50.852 13.169 1.00 79.77 ? 135 THR H N 1 ATOM 2703 C CA . THR B 2 147 ? 75.521 50.779 13.925 1.00 75.31 ? 135 THR H CA 1 ATOM 2704 C C . THR B 2 147 ? 74.373 50.271 13.056 1.00 70.22 ? 135 THR H C 1 ATOM 2705 O O . THR B 2 147 ? 74.137 50.780 11.961 1.00 73.61 ? 135 THR H O 1 ATOM 2706 C CB . THR B 2 147 ? 75.136 52.148 14.518 1.00 80.13 ? 135 THR H CB 1 ATOM 2707 O OG1 . THR B 2 147 ? 75.115 53.134 13.479 1.00 91.40 ? 135 THR H OG1 1 ATOM 2708 C CG2 . THR B 2 147 ? 76.136 52.567 15.588 1.00 79.97 ? 135 THR H CG2 1 ATOM 2709 N N . ALA B 2 148 ? 73.664 49.261 13.550 1.00 65.04 ? 136 ALA H N 1 ATOM 2710 C CA . ALA B 2 148 ? 72.538 48.696 12.816 1.00 55.93 ? 136 ALA H CA 1 ATOM 2711 C C . ALA B 2 148 ? 71.224 48.938 13.545 1.00 56.72 ? 136 ALA H C 1 ATOM 2712 O O . ALA B 2 148 ? 71.171 48.930 14.775 1.00 52.32 ? 136 ALA H O 1 ATOM 2713 C CB . ALA B 2 148 ? 72.743 47.209 12.585 1.00 61.06 ? 136 ALA H CB 1 ATOM 2714 N N . ALA B 2 149 ? 70.164 49.153 12.775 1.00 54.10 ? 137 ALA H N 1 ATOM 2715 C CA . ALA B 2 149 ? 68.839 49.355 13.339 1.00 48.31 ? 137 ALA H CA 1 ATOM 2716 C C . ALA B 2 149 ? 68.012 48.080 13.235 1.00 47.23 ? 137 ALA H C 1 ATOM 2717 O O . ALA B 2 149 ? 68.092 47.352 12.245 1.00 49.28 ? 137 ALA H O 1 ATOM 2718 C CB . ALA B 2 149 ? 68.133 50.507 12.639 1.00 44.47 ? 137 ALA H CB 1 ATOM 2719 N N . LEU B 2 150 ? 67.226 47.813 14.270 1.00 42.76 ? 138 LEU H N 1 ATOM 2720 C CA . LEU B 2 150 ? 66.315 46.680 14.275 1.00 44.38 ? 138 LEU H CA 1 ATOM 2721 C C . LEU B 2 150 ? 65.171 46.982 15.229 1.00 45.41 ? 138 LEU H C 1 ATOM 2722 O O . LEU B 2 150 ? 65.265 47.902 16.042 1.00 41.58 ? 138 LEU H O 1 ATOM 2723 C CB . LEU B 2 150 ? 67.038 45.392 14.673 1.00 41.54 ? 138 LEU H CB 1 ATOM 2724 C CG . LEU B 2 150 ? 67.728 45.337 16.039 1.00 45.80 ? 138 LEU H CG 1 ATOM 2725 C CD1 . LEU B 2 150 ? 66.837 44.684 17.092 1.00 44.65 ? 138 LEU H CD1 1 ATOM 2726 C CD2 . LEU B 2 150 ? 69.056 44.603 15.931 1.00 51.55 ? 138 LEU H CD2 1 ATOM 2727 N N . GLY B 2 151 ? 64.090 46.218 15.132 1.00 44.31 ? 139 GLY H N 1 ATOM 2728 C CA . GLY B 2 151 ? 62.959 46.457 16.002 1.00 42.76 ? 139 GLY H CA 1 ATOM 2729 C C . GLY B 2 151 ? 61.798 45.493 15.896 1.00 36.52 ? 139 GLY H C 1 ATOM 2730 O O . GLY B 2 151 ? 61.908 44.419 15.306 1.00 34.73 ? 139 GLY H O 1 ATOM 2731 N N . CYS B 2 152 ? 60.680 45.898 16.491 1.00 34.92 ? 140 CYS H N 1 ATOM 2732 C CA . CYS B 2 152 ? 59.445 45.123 16.485 1.00 33.57 ? 140 CYS H CA 1 ATOM 2733 C C . CYS B 2 152 ? 58.288 45.973 15.980 1.00 36.58 ? 140 CYS H C 1 ATOM 2734 O O . CYS B 2 152 ? 58.207 47.168 16.276 1.00 35.98 ? 140 CYS H O 1 ATOM 2735 C CB . CYS B 2 152 ? 59.118 44.599 17.887 1.00 31.28 ? 140 CYS H CB 1 ATOM 2736 S SG . CYS B 2 152 ? 59.914 43.042 18.355 1.00 48.94 ? 140 CYS H SG 1 ATOM 2737 N N . LEU B 2 153 ? 57.393 45.354 15.222 1.00 36.71 ? 141 LEU H N 1 ATOM 2738 C CA . LEU B 2 153 ? 56.183 46.027 14.772 1.00 34.76 ? 141 LEU H CA 1 ATOM 2739 C C . LEU B 2 153 ? 54.966 45.462 15.501 1.00 37.90 ? 141 LEU H C 1 ATOM 2740 O O . LEU B 2 153 ? 54.564 44.319 15.271 1.00 35.83 ? 141 LEU H O 1 ATOM 2741 C CB . LEU B 2 153 ? 56.018 45.886 13.259 1.00 36.24 ? 141 LEU H CB 1 ATOM 2742 C CG . LEU B 2 153 ? 54.778 46.543 12.651 1.00 39.89 ? 141 LEU H CG 1 ATOM 2743 C CD1 . LEU B 2 153 ? 54.823 48.053 12.827 1.00 40.55 ? 141 LEU H CD1 1 ATOM 2744 C CD2 . LEU B 2 153 ? 54.644 46.174 11.183 1.00 38.20 ? 141 LEU H CD2 1 ATOM 2745 N N . VAL B 2 154 ? 54.395 46.271 16.390 1.00 39.39 ? 142 VAL H N 1 ATOM 2746 C CA . VAL B 2 154 ? 53.226 45.885 17.172 1.00 37.01 ? 142 VAL H CA 1 ATOM 2747 C C . VAL B 2 154 ? 51.954 46.387 16.494 1.00 37.02 ? 142 VAL H C 1 ATOM 2748 O O . VAL B 2 154 ? 51.558 47.539 16.678 1.00 40.26 ? 142 VAL H O 1 ATOM 2749 C CB . VAL B 2 154 ? 53.310 46.443 18.603 1.00 36.41 ? 142 VAL H CB 1 ATOM 2750 C CG1 . VAL B 2 154 ? 52.113 45.998 19.428 1.00 31.37 ? 142 VAL H CG1 1 ATOM 2751 C CG2 . VAL B 2 154 ? 54.610 46.003 19.260 1.00 37.11 ? 142 VAL H CG2 1 ATOM 2752 N N . LYS B 2 155 ? 51.313 45.520 15.715 1.00 35.65 ? 143 LYS H N 1 ATOM 2753 C CA . LYS B 2 155 ? 50.231 45.954 14.835 1.00 40.12 ? 143 LYS H CA 1 ATOM 2754 C C . LYS B 2 155 ? 48.844 45.447 15.238 1.00 41.00 ? 143 LYS H C 1 ATOM 2755 O O . LYS B 2 155 ? 48.694 44.329 15.737 1.00 39.95 ? 143 LYS H O 1 ATOM 2756 C CB . LYS B 2 155 ? 50.536 45.517 13.398 1.00 48.43 ? 143 LYS H CB 1 ATOM 2757 C CG . LYS B 2 155 ? 49.627 46.130 12.348 1.00 50.44 ? 143 LYS H CG 1 ATOM 2758 C CD . LYS B 2 155 ? 50.052 45.724 10.950 1.00 54.80 ? 143 LYS H CD 1 ATOM 2759 C CE . LYS B 2 155 ? 49.164 46.374 9.901 1.00 60.22 ? 143 LYS H CE 1 ATOM 2760 N NZ . LYS B 2 155 ? 49.185 47.860 10.011 1.00 57.60 ? 143 LYS H NZ 1 ATOM 2761 N N . ASP B 2 156 ? 47.842 46.296 15.021 1.00 43.50 ? 144 ASP H N 1 ATOM 2762 C CA . ASP B 2 156 ? 46.430 45.923 15.125 1.00 41.84 ? 144 ASP H CA 1 ATOM 2763 C C . ASP B 2 156 ? 46.007 45.433 16.509 1.00 40.42 ? 144 ASP H C 1 ATOM 2764 O O . ASP B 2 156 ? 45.557 44.300 16.659 1.00 42.95 ? 144 ASP H O 1 ATOM 2765 C CB . ASP B 2 156 ? 46.095 44.852 14.083 1.00 43.14 ? 144 ASP H CB 1 ATOM 2766 C CG . ASP B 2 156 ? 46.276 45.346 12.659 1.00 48.03 ? 144 ASP H CG 1 ATOM 2767 O OD1 . ASP B 2 156 ? 46.217 46.576 12.444 1.00 47.56 ? 144 ASP H OD1 1 ATOM 2768 O OD2 . ASP B 2 156 ? 46.473 44.507 11.752 1.00 52.05 ? 144 ASP H OD2 1 ATOM 2769 N N . TYR B 2 157 ? 46.134 46.294 17.513 1.00 39.01 ? 145 TYR H N 1 ATOM 2770 C CA . TYR B 2 157 ? 45.674 45.956 18.857 1.00 39.77 ? 145 TYR H CA 1 ATOM 2771 C C . TYR B 2 157 ? 44.712 47.003 19.408 1.00 39.88 ? 145 TYR H C 1 ATOM 2772 O O . TYR B 2 157 ? 44.655 48.130 18.918 1.00 43.87 ? 145 TYR H O 1 ATOM 2773 C CB . TYR B 2 157 ? 46.860 45.789 19.810 1.00 38.72 ? 145 TYR H CB 1 ATOM 2774 C CG . TYR B 2 157 ? 47.646 47.056 20.064 1.00 36.94 ? 145 TYR H CG 1 ATOM 2775 C CD1 . TYR B 2 157 ? 48.755 47.372 19.293 1.00 34.07 ? 145 TYR H CD1 1 ATOM 2776 C CD2 . TYR B 2 157 ? 47.284 47.929 21.083 1.00 37.86 ? 145 TYR H CD2 1 ATOM 2777 C CE1 . TYR B 2 157 ? 49.477 48.525 19.524 1.00 36.76 ? 145 TYR H CE1 1 ATOM 2778 C CE2 . TYR B 2 157 ? 47.997 49.087 21.319 1.00 39.49 ? 145 TYR H CE2 1 ATOM 2779 C CZ . TYR B 2 157 ? 49.094 49.379 20.538 1.00 40.14 ? 145 TYR H CZ 1 ATOM 2780 O OH . TYR B 2 157 ? 49.808 50.527 20.778 1.00 37.63 ? 145 TYR H OH 1 ATOM 2781 N N . PHE B 2 158 ? 43.963 46.619 20.437 1.00 41.15 ? 146 PHE H N 1 ATOM 2782 C CA . PHE B 2 158 ? 43.014 47.517 21.084 1.00 39.20 ? 146 PHE H CA 1 ATOM 2783 C C . PHE B 2 158 ? 42.677 47.028 22.490 1.00 44.55 ? 146 PHE H C 1 ATOM 2784 O O . PHE B 2 158 ? 42.458 45.836 22.696 1.00 49.30 ? 146 PHE H O 1 ATOM 2785 C CB . PHE B 2 158 ? 41.736 47.644 20.247 1.00 40.86 ? 146 PHE H CB 1 ATOM 2786 C CG . PHE B 2 158 ? 40.738 48.611 20.813 1.00 44.10 ? 146 PHE H CG 1 ATOM 2787 C CD1 . PHE B 2 158 ? 40.811 49.960 20.506 1.00 43.87 ? 146 PHE H CD1 1 ATOM 2788 C CD2 . PHE B 2 158 ? 39.732 48.174 21.662 1.00 44.71 ? 146 PHE H CD2 1 ATOM 2789 C CE1 . PHE B 2 158 ? 39.899 50.854 21.032 1.00 41.26 ? 146 PHE H CE1 1 ATOM 2790 C CE2 . PHE B 2 158 ? 38.821 49.063 22.191 1.00 44.32 ? 146 PHE H CE2 1 ATOM 2791 C CZ . PHE B 2 158 ? 38.905 50.405 21.875 1.00 44.37 ? 146 PHE H CZ 1 ATOM 2792 N N . PRO B 2 159 ? 42.642 47.947 23.468 1.00 44.98 ? 147 PRO H N 1 ATOM 2793 C CA . PRO B 2 159 ? 42.993 49.360 23.323 1.00 44.65 ? 147 PRO H CA 1 ATOM 2794 C C . PRO B 2 159 ? 44.421 49.652 23.765 1.00 43.62 ? 147 PRO H C 1 ATOM 2795 O O . PRO B 2 159 ? 45.221 48.732 23.931 1.00 41.99 ? 147 PRO H O 1 ATOM 2796 C CB . PRO B 2 159 ? 42.005 50.044 24.256 1.00 42.83 ? 147 PRO H CB 1 ATOM 2797 C CG . PRO B 2 159 ? 41.908 49.076 25.391 1.00 38.87 ? 147 PRO H CG 1 ATOM 2798 C CD . PRO B 2 159 ? 42.014 47.690 24.777 1.00 39.09 ? 147 PRO H CD 1 ATOM 2799 N N . GLU B 2 160 ? 44.724 50.932 23.957 1.00 46.24 ? 148 GLU H N 1 ATOM 2800 C CA . GLU B 2 160 ? 45.977 51.350 24.575 1.00 43.05 ? 148 GLU H CA 1 ATOM 2801 C C . GLU B 2 160 ? 46.011 50.880 26.030 1.00 47.18 ? 148 GLU H C 1 ATOM 2802 O O . GLU B 2 160 ? 44.963 50.639 26.627 1.00 56.86 ? 148 GLU H O 1 ATOM 2803 C CB . GLU B 2 160 ? 46.127 52.875 24.503 1.00 41.40 ? 148 GLU H CB 1 ATOM 2804 C CG . GLU B 2 160 ? 46.363 53.438 23.110 1.00 44.46 ? 148 GLU H CG 1 ATOM 2805 C CD . GLU B 2 160 ? 47.835 53.677 22.815 1.00 54.20 ? 148 GLU H CD 1 ATOM 2806 O OE1 . GLU B 2 160 ? 48.663 52.801 23.147 1.00 57.07 ? 148 GLU H OE1 1 ATOM 2807 O OE2 . GLU B 2 160 ? 48.165 54.748 22.260 1.00 58.04 ? 148 GLU H OE2 1 ATOM 2808 N N . PRO B 2 161 ? 47.214 50.737 26.606 1.00 46.15 ? 149 PRO H N 1 ATOM 2809 C CA . PRO B 2 161 ? 48.507 50.847 25.934 1.00 43.02 ? 149 PRO H CA 1 ATOM 2810 C C . PRO B 2 161 ? 49.182 49.494 25.776 1.00 44.36 ? 149 PRO H C 1 ATOM 2811 O O . PRO B 2 161 ? 48.668 48.483 26.264 1.00 43.61 ? 149 PRO H O 1 ATOM 2812 C CB . PRO B 2 161 ? 49.300 51.731 26.889 1.00 40.94 ? 149 PRO H CB 1 ATOM 2813 C CG . PRO B 2 161 ? 48.821 51.269 28.245 1.00 39.57 ? 149 PRO H CG 1 ATOM 2814 C CD . PRO B 2 161 ? 47.377 50.794 28.071 1.00 41.35 ? 149 PRO H CD 1 ATOM 2815 N N . VAL B 2 162 ? 50.321 49.482 25.094 1.00 41.54 ? 150 VAL H N 1 ATOM 2816 C CA . VAL B 2 162 ? 51.202 48.327 25.117 1.00 44.21 ? 150 VAL H CA 1 ATOM 2817 C C . VAL B 2 162 ? 52.567 48.770 25.615 1.00 47.80 ? 150 VAL H C 1 ATOM 2818 O O . VAL B 2 162 ? 53.008 49.885 25.335 1.00 51.01 ? 150 VAL H O 1 ATOM 2819 C CB . VAL B 2 162 ? 51.347 47.656 23.734 1.00 44.46 ? 150 VAL H CB 1 ATOM 2820 C CG1 . VAL B 2 162 ? 50.042 47.015 23.306 1.00 42.62 ? 150 VAL H CG1 1 ATOM 2821 C CG2 . VAL B 2 162 ? 51.826 48.658 22.698 1.00 51.34 ? 150 VAL H CG2 1 ATOM 2822 N N . THR B 2 163 ? 53.224 47.906 26.375 1.00 47.69 ? 151 THR H N 1 ATOM 2823 C CA . THR B 2 163 ? 54.589 48.169 26.798 1.00 47.15 ? 151 THR H CA 1 ATOM 2824 C C . THR B 2 163 ? 55.520 47.160 26.145 1.00 48.21 ? 151 THR H C 1 ATOM 2825 O O . THR B 2 163 ? 55.208 45.970 26.071 1.00 54.04 ? 151 THR H O 1 ATOM 2826 C CB . THR B 2 163 ? 54.735 48.109 28.326 1.00 48.54 ? 151 THR H CB 1 ATOM 2827 O OG1 . THR B 2 163 ? 54.286 46.835 28.802 1.00 55.93 ? 151 THR H OG1 1 ATOM 2828 C CG2 . THR B 2 163 ? 53.908 49.208 28.977 1.00 43.70 ? 151 THR H CG2 1 ATOM 2829 N N . VAL B 2 164 ? 56.656 47.641 25.655 1.00 46.84 ? 152 VAL H N 1 ATOM 2830 C CA . VAL B 2 164 ? 57.635 46.766 25.027 1.00 47.85 ? 152 VAL H CA 1 ATOM 2831 C C . VAL B 2 164 ? 59.024 46.994 25.611 1.00 48.84 ? 152 VAL H C 1 ATOM 2832 O O . VAL B 2 164 ? 59.501 48.128 25.699 1.00 50.66 ? 152 VAL H O 1 ATOM 2833 C CB . VAL B 2 164 ? 57.668 46.965 23.490 1.00 51.73 ? 152 VAL H CB 1 ATOM 2834 C CG1 . VAL B 2 164 ? 57.603 48.433 23.145 1.00 57.88 ? 152 VAL H CG1 1 ATOM 2835 C CG2 . VAL B 2 164 ? 58.912 46.326 22.885 1.00 46.06 ? 152 VAL H CG2 1 ATOM 2836 N N . SER B 2 165 ? 59.652 45.903 26.040 1.00 46.66 ? 153 SER H N 1 ATOM 2837 C CA . SER B 2 165 ? 61.027 45.938 26.507 1.00 39.69 ? 153 SER H CA 1 ATOM 2838 C C . SER B 2 165 ? 61.883 45.083 25.584 1.00 45.99 ? 153 SER H C 1 ATOM 2839 O O . SER B 2 165 ? 61.358 44.376 24.723 1.00 43.60 ? 153 SER H O 1 ATOM 2840 C CB . SER B 2 165 ? 61.131 45.438 27.950 1.00 35.85 ? 153 SER H CB 1 ATOM 2841 O OG . SER B 2 165 ? 60.843 44.051 28.035 1.00 34.71 ? 153 SER H OG 1 ATOM 2842 N N . TRP B 2 166 ? 63.199 45.154 25.768 1.00 54.29 ? 154 TRP H N 1 ATOM 2843 C CA . TRP B 2 166 ? 64.140 44.357 24.985 1.00 50.77 ? 154 TRP H CA 1 ATOM 2844 C C . TRP B 2 166 ? 65.049 43.543 25.896 1.00 51.09 ? 154 TRP H C 1 ATOM 2845 O O . TRP B 2 166 ? 65.606 44.074 26.856 1.00 54.22 ? 154 TRP H O 1 ATOM 2846 C CB . TRP B 2 166 ? 64.973 45.255 24.070 1.00 46.51 ? 154 TRP H CB 1 ATOM 2847 C CG . TRP B 2 166 ? 64.188 45.827 22.932 1.00 39.27 ? 154 TRP H CG 1 ATOM 2848 C CD1 . TRP B 2 166 ? 63.473 46.988 22.933 1.00 38.13 ? 154 TRP H CD1 1 ATOM 2849 C CD2 . TRP B 2 166 ? 64.032 45.259 21.626 1.00 39.89 ? 154 TRP H CD2 1 ATOM 2850 N NE1 . TRP B 2 166 ? 62.881 47.181 21.706 1.00 41.14 ? 154 TRP H NE1 1 ATOM 2851 C CE2 . TRP B 2 166 ? 63.209 46.133 20.886 1.00 42.74 ? 154 TRP H CE2 1 ATOM 2852 C CE3 . TRP B 2 166 ? 64.509 44.098 21.009 1.00 41.25 ? 154 TRP H CE3 1 ATOM 2853 C CZ2 . TRP B 2 166 ? 62.853 45.881 19.561 1.00 37.85 ? 154 TRP H CZ2 1 ATOM 2854 C CZ3 . TRP B 2 166 ? 64.154 43.850 19.693 1.00 41.55 ? 154 TRP H CZ3 1 ATOM 2855 C CH2 . TRP B 2 166 ? 63.335 44.737 18.985 1.00 40.08 ? 154 TRP H CH2 1 ATOM 2856 N N . ASN B 2 167 ? 65.191 42.257 25.586 1.00 49.24 ? 155 ASN H N 1 ATOM 2857 C CA . ASN B 2 167 ? 65.973 41.329 26.402 1.00 48.23 ? 155 ASN H CA 1 ATOM 2858 C C . ASN B 2 167 ? 65.557 41.358 27.869 1.00 49.47 ? 155 ASN H C 1 ATOM 2859 O O . ASN B 2 167 ? 66.402 41.279 28.768 1.00 47.67 ? 155 ASN H O 1 ATOM 2860 C CB . ASN B 2 167 ? 67.469 41.628 26.271 1.00 49.56 ? 155 ASN H CB 1 ATOM 2861 C CG . ASN B 2 167 ? 67.996 41.349 24.878 1.00 51.45 ? 155 ASN H CG 1 ATOM 2862 O OD1 . ASN B 2 167 ? 67.228 41.258 23.921 1.00 54.38 ? 155 ASN H OD1 1 ATOM 2863 N ND2 . ASN B 2 167 ? 69.310 41.209 24.756 1.00 56.09 ? 155 ASN H ND2 1 ATOM 2864 N N . SER B 2 168 ? 64.249 41.483 28.091 1.00 47.94 ? 156 SER H N 1 ATOM 2865 C CA . SER B 2 168 ? 63.659 41.453 29.427 1.00 51.12 ? 156 SER H CA 1 ATOM 2866 C C . SER B 2 168 ? 64.216 42.554 30.327 1.00 54.06 ? 156 SER H C 1 ATOM 2867 O O . SER B 2 168 ? 64.409 42.349 31.527 1.00 56.41 ? 156 SER H O 1 ATOM 2868 C CB . SER B 2 168 ? 63.875 40.082 30.074 1.00 54.55 ? 156 SER H CB 1 ATOM 2869 O OG . SER B 2 168 ? 63.436 39.043 29.216 1.00 55.83 ? 156 SER H OG 1 ATOM 2870 N N . GLY B 2 169 ? 64.471 43.720 29.741 1.00 50.05 ? 157 GLY H N 1 ATOM 2871 C CA . GLY B 2 169 ? 64.950 44.862 30.497 1.00 47.11 ? 157 GLY H CA 1 ATOM 2872 C C . GLY B 2 169 ? 66.453 45.065 30.463 1.00 52.01 ? 157 GLY H C 1 ATOM 2873 O O . GLY B 2 169 ? 66.945 46.129 30.834 1.00 55.82 ? 157 GLY H O 1 ATOM 2874 N N . ALA B 2 170 ? 67.188 44.048 30.021 1.00 54.00 ? 158 ALA H N 1 ATOM 2875 C CA . ALA B 2 170 ? 68.645 44.136 29.960 1.00 59.90 ? 158 ALA H CA 1 ATOM 2876 C C . ALA B 2 170 ? 69.098 45.164 28.927 1.00 59.45 ? 158 ALA H C 1 ATOM 2877 O O . ALA B 2 170 ? 70.042 45.916 29.159 1.00 58.60 ? 158 ALA H O 1 ATOM 2878 C CB . ALA B 2 170 ? 69.247 42.779 29.648 1.00 55.28 ? 158 ALA H CB 1 ATOM 2879 N N . LEU B 2 171 ? 68.417 45.193 27.786 1.00 56.55 ? 159 LEU H N 1 ATOM 2880 C CA . LEU B 2 171 ? 68.778 46.106 26.708 1.00 53.50 ? 159 LEU H CA 1 ATOM 2881 C C . LEU B 2 171 ? 67.914 47.363 26.735 1.00 50.05 ? 159 LEU H C 1 ATOM 2882 O O . LEU B 2 171 ? 66.735 47.326 26.386 1.00 44.84 ? 159 LEU H O 1 ATOM 2883 C CB . LEU B 2 171 ? 68.653 45.406 25.354 1.00 47.93 ? 159 LEU H CB 1 ATOM 2884 C CG . LEU B 2 171 ? 68.937 46.278 24.132 1.00 50.40 ? 159 LEU H CG 1 ATOM 2885 C CD1 . LEU B 2 171 ? 70.381 46.748 24.136 1.00 46.18 ? 159 LEU H CD1 1 ATOM 2886 C CD2 . LEU B 2 171 ? 68.610 45.529 22.852 1.00 47.69 ? 159 LEU H CD2 1 ATOM 2887 N N . THR B 2 172 ? 68.513 48.476 27.147 1.00 54.34 ? 160 THR H N 1 ATOM 2888 C CA . THR B 2 172 ? 67.795 49.743 27.258 1.00 50.89 ? 160 THR H CA 1 ATOM 2889 C C . THR B 2 172 ? 68.412 50.844 26.397 1.00 54.50 ? 160 THR H C 1 ATOM 2890 O O . THR B 2 172 ? 67.725 51.779 25.991 1.00 52.64 ? 160 THR H O 1 ATOM 2891 C CB . THR B 2 172 ? 67.749 50.233 28.719 1.00 49.93 ? 160 THR H CB 1 ATOM 2892 O OG1 . THR B 2 172 ? 69.082 50.328 29.237 1.00 54.47 ? 160 THR H OG1 1 ATOM 2893 C CG2 . THR B 2 172 ? 66.949 49.269 29.576 1.00 51.20 ? 160 THR H CG2 1 ATOM 2894 N N . SER B 2 173 ? 69.709 50.729 26.125 1.00 61.84 ? 161 SER H N 1 ATOM 2895 C CA . SER B 2 173 ? 70.427 51.746 25.359 1.00 56.99 ? 161 SER H CA 1 ATOM 2896 C C . SER B 2 173 ? 69.943 51.814 23.912 1.00 48.10 ? 161 SER H C 1 ATOM 2897 O O . SER B 2 173 ? 69.708 50.789 23.275 1.00 47.06 ? 161 SER H O 1 ATOM 2898 C CB . SER B 2 173 ? 71.938 51.476 25.388 1.00 60.16 ? 161 SER H CB 1 ATOM 2899 O OG . SER B 2 173 ? 72.449 51.498 26.712 1.00 60.49 ? 161 SER H OG 1 ATOM 2900 N N . GLY B 2 174 ? 69.794 53.033 23.403 1.00 43.24 ? 162 GLY H N 1 ATOM 2901 C CA . GLY B 2 174 ? 69.448 53.252 22.010 1.00 41.88 ? 162 GLY H CA 1 ATOM 2902 C C . GLY B 2 174 ? 68.063 52.770 21.626 1.00 47.21 ? 162 GLY H C 1 ATOM 2903 O O . GLY B 2 174 ? 67.772 52.575 20.448 1.00 57.01 ? 162 GLY H O 1 ATOM 2904 N N . VAL B 2 175 ? 67.203 52.585 22.621 1.00 44.19 ? 163 VAL H N 1 ATOM 2905 C CA . VAL B 2 175 ? 65.854 52.092 22.387 1.00 37.74 ? 163 VAL H CA 1 ATOM 2906 C C . VAL B 2 175 ? 64.853 53.228 22.173 1.00 38.81 ? 163 VAL H C 1 ATOM 2907 O O . VAL B 2 175 ? 64.764 54.152 22.985 1.00 38.81 ? 163 VAL H O 1 ATOM 2908 C CB . VAL B 2 175 ? 65.377 51.221 23.559 1.00 32.48 ? 163 VAL H CB 1 ATOM 2909 C CG1 . VAL B 2 175 ? 63.904 50.878 23.406 1.00 31.75 ? 163 VAL H CG1 1 ATOM 2910 C CG2 . VAL B 2 175 ? 66.223 49.961 23.659 1.00 35.31 ? 163 VAL H CG2 1 ATOM 2911 N N . HIS B 2 176 ? 64.112 53.160 21.072 1.00 33.35 ? 164 HIS H N 1 ATOM 2912 C CA . HIS B 2 176 ? 63.023 54.096 20.825 1.00 40.07 ? 164 HIS H CA 1 ATOM 2913 C C . HIS B 2 176 ? 61.711 53.353 20.596 1.00 43.12 ? 164 HIS H C 1 ATOM 2914 O O . HIS B 2 176 ? 61.550 52.649 19.598 1.00 44.15 ? 164 HIS H O 1 ATOM 2915 C CB . HIS B 2 176 ? 63.322 54.990 19.620 1.00 41.58 ? 164 HIS H CB 1 ATOM 2916 C CG . HIS B 2 176 ? 64.328 56.066 19.891 1.00 44.01 ? 164 HIS H CG 1 ATOM 2917 N ND1 . HIS B 2 176 ? 65.592 56.059 19.343 1.00 37.24 ? 164 HIS H ND1 1 ATOM 2918 C CD2 . HIS B 2 176 ? 64.250 57.190 20.643 1.00 42.92 ? 164 HIS H CD2 1 ATOM 2919 C CE1 . HIS B 2 176 ? 66.251 57.130 19.748 1.00 40.02 ? 164 HIS H CE1 1 ATOM 2920 N NE2 . HIS B 2 176 ? 65.459 57.832 20.538 1.00 42.95 ? 164 HIS H NE2 1 ATOM 2921 N N . THR B 2 177 ? 60.781 53.500 21.530 1.00 40.30 ? 165 THR H N 1 ATOM 2922 C CA . THR B 2 177 ? 59.432 52.987 21.337 1.00 38.44 ? 165 THR H CA 1 ATOM 2923 C C . THR B 2 177 ? 58.501 54.148 21.027 1.00 30.93 ? 165 THR H C 1 ATOM 2924 O O . THR B 2 177 ? 58.312 55.043 21.848 1.00 31.48 ? 165 THR H O 1 ATOM 2925 C CB . THR B 2 177 ? 58.920 52.221 22.570 1.00 36.82 ? 165 THR H CB 1 ATOM 2926 O OG1 . THR B 2 177 ? 59.670 51.009 22.721 1.00 38.79 ? 165 THR H OG1 1 ATOM 2927 C CG2 . THR B 2 177 ? 57.453 51.878 22.398 1.00 28.62 ? 165 THR H CG2 1 ATOM 2928 N N . PHE B 2 178 ? 57.925 54.129 19.833 1.00 31.65 ? 166 PHE H N 1 ATOM 2929 C CA . PHE B 2 178 ? 57.141 55.255 19.350 1.00 35.71 ? 166 PHE H CA 1 ATOM 2930 C C . PHE B 2 178 ? 55.714 55.248 19.888 1.00 36.39 ? 166 PHE H C 1 ATOM 2931 O O . PHE B 2 178 ? 55.177 54.192 20.222 1.00 42.55 ? 166 PHE H O 1 ATOM 2932 C CB . PHE B 2 178 ? 57.130 55.256 17.821 1.00 31.66 ? 166 PHE H CB 1 ATOM 2933 C CG . PHE B 2 178 ? 58.487 55.453 17.215 1.00 36.97 ? 166 PHE H CG 1 ATOM 2934 C CD1 . PHE B 2 178 ? 59.324 54.372 16.983 1.00 35.38 ? 166 PHE H CD1 1 ATOM 2935 C CD2 . PHE B 2 178 ? 58.930 56.723 16.880 1.00 35.42 ? 166 PHE H CD2 1 ATOM 2936 C CE1 . PHE B 2 178 ? 60.574 54.557 16.429 1.00 36.91 ? 166 PHE H CE1 1 ATOM 2937 C CE2 . PHE B 2 178 ? 60.184 56.912 16.325 1.00 34.05 ? 166 PHE H CE2 1 ATOM 2938 C CZ . PHE B 2 178 ? 61.003 55.832 16.101 1.00 34.56 ? 166 PHE H CZ 1 ATOM 2939 N N . PRO B 2 179 ? 55.101 56.437 19.995 1.00 37.51 ? 167 PRO H N 1 ATOM 2940 C CA . PRO B 2 179 ? 53.686 56.502 20.372 1.00 37.71 ? 167 PRO H CA 1 ATOM 2941 C C . PRO B 2 179 ? 52.820 55.767 19.359 1.00 43.48 ? 167 PRO H C 1 ATOM 2942 O O . PRO B 2 179 ? 53.107 55.810 18.160 1.00 40.74 ? 167 PRO H O 1 ATOM 2943 C CB . PRO B 2 179 ? 53.384 58.003 20.364 1.00 37.19 ? 167 PRO H CB 1 ATOM 2944 C CG . PRO B 2 179 ? 54.705 58.655 20.583 1.00 37.40 ? 167 PRO H CG 1 ATOM 2945 C CD . PRO B 2 179 ? 55.704 57.777 19.887 1.00 37.13 ? 167 PRO H CD 1 ATOM 2946 N N . ALA B 2 180 ? 51.778 55.098 19.838 1.00 46.66 ? 168 ALA H N 1 ATOM 2947 C CA . ALA B 2 180 ? 50.898 54.338 18.962 1.00 42.89 ? 168 ALA H CA 1 ATOM 2948 C C . ALA B 2 180 ? 50.101 55.258 18.053 1.00 37.89 ? 168 ALA H C 1 ATOM 2949 O O . ALA B 2 180 ? 49.785 56.390 18.414 1.00 38.77 ? 168 ALA H O 1 ATOM 2950 C CB . ALA B 2 180 ? 49.964 53.470 19.777 1.00 47.39 ? 168 ALA H CB 1 ATOM 2951 N N . VAL B 2 181 ? 49.780 54.759 16.867 1.00 37.52 ? 169 VAL H N 1 ATOM 2952 C CA . VAL B 2 181 ? 48.946 55.494 15.933 1.00 41.71 ? 169 VAL H CA 1 ATOM 2953 C C . VAL B 2 181 ? 47.613 54.762 15.774 1.00 47.53 ? 169 VAL H C 1 ATOM 2954 O O . VAL B 2 181 ? 47.560 53.533 15.804 1.00 46.72 ? 169 VAL H O 1 ATOM 2955 C CB . VAL B 2 181 ? 49.653 55.669 14.565 1.00 49.54 ? 169 VAL H CB 1 ATOM 2956 C CG1 . VAL B 2 181 ? 49.884 54.323 13.891 1.00 45.72 ? 169 VAL H CG1 1 ATOM 2957 C CG2 . VAL B 2 181 ? 48.862 56.604 13.665 1.00 62.69 ? 169 VAL H CG2 1 ATOM 2958 N N . LEU B 2 182 ? 46.532 55.524 15.642 1.00 45.31 ? 170 LEU H N 1 ATOM 2959 C CA . LEU B 2 182 ? 45.204 54.943 15.497 1.00 40.44 ? 170 LEU H CA 1 ATOM 2960 C C . LEU B 2 182 ? 44.858 54.764 14.026 1.00 43.21 ? 170 LEU H C 1 ATOM 2961 O O . LEU B 2 182 ? 44.708 55.738 13.292 1.00 48.24 ? 170 LEU H O 1 ATOM 2962 C CB . LEU B 2 182 ? 44.156 55.816 16.191 1.00 39.50 ? 170 LEU H CB 1 ATOM 2963 C CG . LEU B 2 182 ? 42.710 55.316 16.175 1.00 42.04 ? 170 LEU H CG 1 ATOM 2964 C CD1 . LEU B 2 182 ? 42.586 53.979 16.885 1.00 43.11 ? 170 LEU H CD1 1 ATOM 2965 C CD2 . LEU B 2 182 ? 41.787 56.343 16.809 1.00 45.40 ? 170 LEU H CD2 1 ATOM 2966 N N . GLN B 2 183 ? 44.739 53.512 13.600 1.00 39.76 ? 171 GLN H N 1 ATOM 2967 C CA . GLN B 2 183 ? 44.425 53.202 12.212 1.00 42.41 ? 171 GLN H CA 1 ATOM 2968 C C . GLN B 2 183 ? 42.946 53.430 11.923 1.00 50.71 ? 171 GLN H C 1 ATOM 2969 O O . GLN B 2 183 ? 42.142 53.596 12.841 1.00 53.36 ? 171 GLN H O 1 ATOM 2970 C CB . GLN B 2 183 ? 44.812 51.759 11.891 1.00 48.39 ? 171 GLN H CB 1 ATOM 2971 C CG . GLN B 2 183 ? 46.280 51.448 12.150 1.00 48.75 ? 171 GLN H CG 1 ATOM 2972 C CD . GLN B 2 183 ? 46.569 49.960 12.150 1.00 54.76 ? 171 GLN H CD 1 ATOM 2973 O OE1 . GLN B 2 183 ? 47.496 49.495 11.484 1.00 63.66 ? 171 GLN H OE1 1 ATOM 2974 N NE2 . GLN B 2 183 ? 45.780 49.204 12.904 1.00 53.06 ? 171 GLN H NE2 1 ATOM 2975 N N . SER B 2 184 ? 42.590 53.434 10.642 1.00 56.38 ? 172 SER H N 1 ATOM 2976 C CA . SER B 2 184 ? 41.216 53.699 10.228 1.00 58.67 ? 172 SER H CA 1 ATOM 2977 C C . SER B 2 184 ? 40.278 52.562 10.622 1.00 55.44 ? 172 SER H C 1 ATOM 2978 O O . SER B 2 184 ? 39.059 52.716 10.593 1.00 59.00 ? 172 SER H O 1 ATOM 2979 C CB . SER B 2 184 ? 41.150 53.933 8.717 1.00 65.17 ? 172 SER H CB 1 ATOM 2980 O OG . SER B 2 184 ? 41.662 52.820 8.004 1.00 68.14 ? 172 SER H OG 1 ATOM 2981 N N . SER B 2 185 ? 40.855 51.425 10.995 1.00 51.16 ? 173 SER H N 1 ATOM 2982 C CA . SER B 2 185 ? 40.077 50.264 11.412 1.00 54.27 ? 173 SER H CA 1 ATOM 2983 C C . SER B 2 185 ? 39.657 50.368 12.873 1.00 52.42 ? 173 SER H C 1 ATOM 2984 O O . SER B 2 185 ? 38.866 49.557 13.358 1.00 52.64 ? 173 SER H O 1 ATOM 2985 C CB . SER B 2 185 ? 40.877 48.979 11.196 1.00 54.54 ? 173 SER H CB 1 ATOM 2986 O OG . SER B 2 185 ? 42.083 49.004 11.941 1.00 51.41 ? 173 SER H OG 1 ATOM 2987 N N . GLY B 2 186 ? 40.191 51.367 13.569 1.00 46.08 ? 174 GLY H N 1 ATOM 2988 C CA . GLY B 2 186 ? 39.904 51.550 14.979 1.00 43.29 ? 174 GLY H CA 1 ATOM 2989 C C . GLY B 2 186 ? 40.916 50.846 15.864 1.00 45.89 ? 174 GLY H C 1 ATOM 2990 O O . GLY B 2 186 ? 40.827 50.901 17.091 1.00 49.02 ? 174 GLY H O 1 ATOM 2991 N N . LEU B 2 187 ? 41.881 50.179 15.238 1.00 46.80 ? 175 LEU H N 1 ATOM 2992 C CA . LEU B 2 187 ? 42.923 49.474 15.974 1.00 45.10 ? 175 LEU H CA 1 ATOM 2993 C C . LEU B 2 187 ? 44.198 50.308 16.053 1.00 45.70 ? 175 LEU H C 1 ATOM 2994 O O . LEU B 2 187 ? 44.519 51.063 15.134 1.00 42.15 ? 175 LEU H O 1 ATOM 2995 C CB . LEU B 2 187 ? 43.216 48.117 15.327 1.00 42.86 ? 175 LEU H CB 1 ATOM 2996 C CG . LEU B 2 187 ? 42.044 47.132 15.230 1.00 50.16 ? 175 LEU H CG 1 ATOM 2997 C CD1 . LEU B 2 187 ? 42.454 45.857 14.501 1.00 51.56 ? 175 LEU H CD1 1 ATOM 2998 C CD2 . LEU B 2 187 ? 41.479 46.807 16.607 1.00 53.97 ? 175 LEU H CD2 1 ATOM 2999 N N . TYR B 2 188 ? 44.914 50.172 17.165 1.00 44.23 ? 176 TYR H N 1 ATOM 3000 C CA . TYR B 2 188 ? 46.173 50.876 17.362 1.00 38.82 ? 176 TYR H CA 1 ATOM 3001 C C . TYR B 2 188 ? 47.331 50.084 16.769 1.00 38.91 ? 176 TYR H C 1 ATOM 3002 O O . TYR B 2 188 ? 47.196 48.899 16.470 1.00 38.88 ? 176 TYR H O 1 ATOM 3003 C CB . TYR B 2 188 ? 46.420 51.133 18.849 1.00 35.90 ? 176 TYR H CB 1 ATOM 3004 C CG . TYR B 2 188 ? 45.490 52.148 19.473 1.00 39.33 ? 176 TYR H CG 1 ATOM 3005 C CD1 . TYR B 2 188 ? 45.791 53.502 19.441 1.00 37.49 ? 176 TYR H CD1 1 ATOM 3006 C CD2 . TYR B 2 188 ? 44.313 51.754 20.102 1.00 40.21 ? 176 TYR H CD2 1 ATOM 3007 C CE1 . TYR B 2 188 ? 44.949 54.437 20.011 1.00 34.82 ? 176 TYR H CE1 1 ATOM 3008 C CE2 . TYR B 2 188 ? 43.464 52.684 20.677 1.00 34.53 ? 176 TYR H CE2 1 ATOM 3009 C CZ . TYR B 2 188 ? 43.789 54.024 20.627 1.00 34.31 ? 176 TYR H CZ 1 ATOM 3010 O OH . TYR B 2 188 ? 42.952 54.960 21.195 1.00 35.37 ? 176 TYR H OH 1 ATOM 3011 N N . SER B 2 189 ? 48.471 50.747 16.606 1.00 43.06 ? 177 SER H N 1 ATOM 3012 C CA . SER B 2 189 ? 49.672 50.107 16.078 1.00 39.98 ? 177 SER H CA 1 ATOM 3013 C C . SER B 2 189 ? 50.902 50.953 16.391 1.00 39.18 ? 177 SER H C 1 ATOM 3014 O O . SER B 2 189 ? 50.884 52.170 16.206 1.00 42.60 ? 177 SER H O 1 ATOM 3015 C CB . SER B 2 189 ? 49.546 49.894 14.567 1.00 36.96 ? 177 SER H CB 1 ATOM 3016 O OG . SER B 2 189 ? 50.662 49.191 14.052 1.00 37.52 ? 177 SER H OG 1 ATOM 3017 N N . LEU B 2 190 ? 51.966 50.324 16.878 1.00 36.75 ? 178 LEU H N 1 ATOM 3018 C CA . LEU B 2 190 ? 53.215 51.053 17.078 1.00 36.75 ? 178 LEU H CA 1 ATOM 3019 C C . LEU B 2 190 ? 54.448 50.230 16.729 1.00 37.09 ? 178 LEU H C 1 ATOM 3020 O O . LEU B 2 190 ? 54.376 49.015 16.534 1.00 34.48 ? 178 LEU H O 1 ATOM 3021 C CB . LEU B 2 190 ? 53.327 51.568 18.519 1.00 33.27 ? 178 LEU H CB 1 ATOM 3022 C CG . LEU B 2 190 ? 53.318 50.671 19.759 1.00 36.06 ? 178 LEU H CG 1 ATOM 3023 C CD1 . LEU B 2 190 ? 54.618 49.894 19.957 1.00 36.76 ? 178 LEU H CD1 1 ATOM 3024 C CD2 . LEU B 2 190 ? 53.042 51.534 20.975 1.00 34.99 ? 178 LEU H CD2 1 ATOM 3025 N N . SER B 2 191 ? 55.582 50.916 16.652 1.00 39.18 ? 179 SER H N 1 ATOM 3026 C CA . SER B 2 191 ? 56.862 50.269 16.421 1.00 38.87 ? 179 SER H CA 1 ATOM 3027 C C . SER B 2 191 ? 57.814 50.551 17.577 1.00 38.50 ? 179 SER H C 1 ATOM 3028 O O . SER B 2 191 ? 57.672 51.546 18.288 1.00 42.55 ? 179 SER H O 1 ATOM 3029 C CB . SER B 2 191 ? 57.471 50.738 15.099 1.00 40.05 ? 179 SER H CB 1 ATOM 3030 O OG . SER B 2 191 ? 57.599 52.150 15.065 1.00 43.95 ? 179 SER H OG 1 ATOM 3031 N N . SER B 2 192 ? 58.778 49.659 17.764 1.00 35.14 ? 180 SER H N 1 ATOM 3032 C CA . SER B 2 192 ? 59.808 49.836 18.776 1.00 32.70 ? 180 SER H CA 1 ATOM 3033 C C . SER B 2 192 ? 61.152 49.422 18.197 1.00 36.81 ? 180 SER H C 1 ATOM 3034 O O . SER B 2 192 ? 61.356 48.253 17.883 1.00 38.74 ? 180 SER H O 1 ATOM 3035 C CB . SER B 2 192 ? 59.488 49.019 20.028 1.00 34.12 ? 180 SER H CB 1 ATOM 3036 O OG . SER B 2 192 ? 60.440 49.261 21.048 1.00 38.76 ? 180 SER H OG 1 ATOM 3037 N N . VAL B 2 193 ? 62.063 50.378 18.045 1.00 36.63 ? 181 VAL H N 1 ATOM 3038 C CA . VAL B 2 193 ? 63.358 50.094 17.438 1.00 34.45 ? 181 VAL H CA 1 ATOM 3039 C C . VAL B 2 193 ? 64.509 50.301 18.415 1.00 37.29 ? 181 VAL H C 1 ATOM 3040 O O . VAL B 2 193 ? 64.360 50.968 19.439 1.00 44.04 ? 181 VAL H O 1 ATOM 3041 C CB . VAL B 2 193 ? 63.599 50.971 16.196 1.00 37.56 ? 181 VAL H CB 1 ATOM 3042 C CG1 . VAL B 2 193 ? 62.462 50.800 15.201 1.00 39.13 ? 181 VAL H CG1 1 ATOM 3043 C CG2 . VAL B 2 193 ? 63.743 52.432 16.596 1.00 34.62 ? 181 VAL H CG2 1 ATOM 3044 N N . VAL B 2 194 ? 65.659 49.725 18.088 1.00 40.14 ? 182 VAL H N 1 ATOM 3045 C CA . VAL B 2 194 ? 66.869 49.901 18.887 1.00 42.30 ? 182 VAL H CA 1 ATOM 3046 C C . VAL B 2 194 ? 68.114 49.827 18.004 1.00 44.12 ? 182 VAL H C 1 ATOM 3047 O O . VAL B 2 194 ? 68.261 48.912 17.194 1.00 44.30 ? 182 VAL H O 1 ATOM 3048 C CB . VAL B 2 194 ? 66.963 48.847 20.021 1.00 50.07 ? 182 VAL H CB 1 ATOM 3049 C CG1 . VAL B 2 194 ? 66.689 47.445 19.487 1.00 46.29 ? 182 VAL H CG1 1 ATOM 3050 C CG2 . VAL B 2 194 ? 68.316 48.917 20.716 1.00 49.94 ? 182 VAL H CG2 1 ATOM 3051 N N . THR B 2 195 ? 68.997 50.812 18.145 1.00 46.82 ? 183 THR H N 1 ATOM 3052 C CA . THR B 2 195 ? 70.260 50.808 17.417 1.00 53.11 ? 183 THR H CA 1 ATOM 3053 C C . THR B 2 195 ? 71.326 50.056 18.208 1.00 58.47 ? 183 THR H C 1 ATOM 3054 O O . THR B 2 195 ? 71.577 50.356 19.375 1.00 57.24 ? 183 THR H O 1 ATOM 3055 C CB . THR B 2 195 ? 70.757 52.237 17.118 1.00 53.96 ? 183 THR H CB 1 ATOM 3056 O OG1 . THR B 2 195 ? 70.770 53.005 18.328 1.00 60.95 ? 183 THR H OG1 1 ATOM 3057 C CG2 . THR B 2 195 ? 69.856 52.916 16.101 1.00 49.41 ? 183 THR H CG2 1 ATOM 3058 N N . VAL B 2 196 ? 71.943 49.072 17.560 1.00 62.73 ? 184 VAL H N 1 ATOM 3059 C CA . VAL B 2 196 ? 72.968 48.242 18.187 1.00 58.60 ? 184 VAL H CA 1 ATOM 3060 C C . VAL B 2 196 ? 74.220 48.208 17.314 1.00 60.29 ? 184 VAL H C 1 ATOM 3061 O O . VAL B 2 196 ? 74.153 48.526 16.127 1.00 61.16 ? 184 VAL H O 1 ATOM 3062 C CB . VAL B 2 196 ? 72.463 46.798 18.419 1.00 47.42 ? 184 VAL H CB 1 ATOM 3063 C CG1 . VAL B 2 196 ? 71.169 46.805 19.216 1.00 46.63 ? 184 VAL H CG1 1 ATOM 3064 C CG2 . VAL B 2 196 ? 72.269 46.083 17.092 1.00 47.17 ? 184 VAL H CG2 1 ATOM 3065 N N . PRO B 2 197 ? 75.373 47.843 17.901 1.00 63.61 ? 185 PRO H N 1 ATOM 3066 C CA . PRO B 2 197 ? 76.574 47.641 17.084 1.00 64.31 ? 185 PRO H CA 1 ATOM 3067 C C . PRO B 2 197 ? 76.352 46.604 15.984 1.00 65.80 ? 185 PRO H C 1 ATOM 3068 O O . PRO B 2 197 ? 75.766 45.553 16.235 1.00 69.69 ? 185 PRO H O 1 ATOM 3069 C CB . PRO B 2 197 ? 77.607 47.154 18.101 1.00 68.03 ? 185 PRO H CB 1 ATOM 3070 C CG . PRO B 2 197 ? 77.182 47.788 19.377 1.00 67.51 ? 185 PRO H CG 1 ATOM 3071 C CD . PRO B 2 197 ? 75.677 47.792 19.343 1.00 63.00 ? 185 PRO H CD 1 ATOM 3072 N N . SER B 2 198 ? 76.820 46.908 14.778 1.00 69.33 ? 186 SER H N 1 ATOM 3073 C CA . SER B 2 198 ? 76.579 46.061 13.614 1.00 74.37 ? 186 SER H CA 1 ATOM 3074 C C . SER B 2 198 ? 77.367 44.752 13.661 1.00 77.76 ? 186 SER H C 1 ATOM 3075 O O . SER B 2 198 ? 77.102 43.834 12.884 1.00 77.08 ? 186 SER H O 1 ATOM 3076 C CB . SER B 2 198 ? 76.919 46.825 12.332 1.00 81.49 ? 186 SER H CB 1 ATOM 3077 O OG . SER B 2 198 ? 76.527 46.098 11.182 1.00 87.10 ? 186 SER H OG 1 ATOM 3078 N N . SER B 2 199 ? 78.332 44.667 14.571 1.00 81.21 ? 187 SER H N 1 ATOM 3079 C CA . SER B 2 199 ? 79.163 43.474 14.691 1.00 87.16 ? 187 SER H CA 1 ATOM 3080 C C . SER B 2 199 ? 78.522 42.409 15.578 1.00 86.12 ? 187 SER H C 1 ATOM 3081 O O . SER B 2 199 ? 78.982 41.268 15.620 1.00 90.71 ? 187 SER H O 1 ATOM 3082 C CB . SER B 2 199 ? 80.543 43.842 15.241 1.00 91.49 ? 187 SER H CB 1 ATOM 3083 O OG . SER B 2 199 ? 80.441 44.422 16.531 1.00 88.96 ? 187 SER H OG 1 ATOM 3084 N N . SER B 2 200 ? 77.459 42.783 16.283 1.00 81.03 ? 188 SER H N 1 ATOM 3085 C CA . SER B 2 200 ? 76.810 41.873 17.221 1.00 80.90 ? 188 SER H CA 1 ATOM 3086 C C . SER B 2 200 ? 75.662 41.105 16.574 1.00 81.13 ? 188 SER H C 1 ATOM 3087 O O . SER B 2 200 ? 75.005 40.292 17.224 1.00 83.31 ? 188 SER H O 1 ATOM 3088 C CB . SER B 2 200 ? 76.294 42.642 18.439 1.00 79.27 ? 188 SER H CB 1 ATOM 3089 O OG . SER B 2 200 ? 75.229 43.508 18.083 1.00 78.55 ? 188 SER H OG 1 ATOM 3090 N N . LEU B 2 201 ? 75.427 41.362 15.292 1.00 79.99 ? 189 LEU H N 1 ATOM 3091 C CA . LEU B 2 201 ? 74.309 40.745 14.586 1.00 76.03 ? 189 LEU H CA 1 ATOM 3092 C C . LEU B 2 201 ? 74.545 39.260 14.323 1.00 80.67 ? 189 LEU H C 1 ATOM 3093 O O . LEU B 2 201 ? 73.623 38.534 13.956 1.00 82.42 ? 189 LEU H O 1 ATOM 3094 C CB . LEU B 2 201 ? 74.044 41.476 13.267 1.00 72.00 ? 189 LEU H CB 1 ATOM 3095 C CG . LEU B 2 201 ? 73.583 42.931 13.379 1.00 63.07 ? 189 LEU H CG 1 ATOM 3096 C CD1 . LEU B 2 201 ? 73.289 43.509 12.004 1.00 60.58 ? 189 LEU H CD1 1 ATOM 3097 C CD2 . LEU B 2 201 ? 72.366 43.047 14.285 1.00 55.71 ? 189 LEU H CD2 1 ATOM 3098 N N . GLY B 2 202 ? 75.779 38.812 14.519 1.00 89.50 ? 190 GLY H N 1 ATOM 3099 C CA . GLY B 2 202 ? 76.127 37.425 14.280 1.00 94.70 ? 190 GLY H CA 1 ATOM 3100 C C . GLY B 2 202 ? 76.175 36.583 15.541 1.00 97.40 ? 190 GLY H C 1 ATOM 3101 O O . GLY B 2 202 ? 76.311 35.362 15.471 1.00 103.83 ? 190 GLY H O 1 ATOM 3102 N N . THR B 2 203 ? 76.065 37.232 16.697 1.00 92.83 ? 191 THR H N 1 ATOM 3103 C CA . THR B 2 203 ? 76.148 36.526 17.971 1.00 95.01 ? 191 THR H CA 1 ATOM 3104 C C . THR B 2 203 ? 74.996 36.870 18.912 1.00 90.94 ? 191 THR H C 1 ATOM 3105 O O . THR B 2 203 ? 74.323 35.979 19.431 1.00 94.08 ? 191 THR H O 1 ATOM 3106 C CB . THR B 2 203 ? 77.476 36.828 18.699 1.00 101.46 ? 191 THR H CB 1 ATOM 3107 O OG1 . THR B 2 203 ? 77.593 38.239 18.921 1.00 100.82 ? 191 THR H OG1 1 ATOM 3108 C CG2 . THR B 2 203 ? 78.664 36.345 17.880 1.00 105.82 ? 191 THR H CG2 1 ATOM 3109 N N . GLN B 2 204 ? 74.774 38.163 19.129 1.00 82.68 ? 192 GLN H N 1 ATOM 3110 C CA . GLN B 2 204 ? 73.807 38.619 20.123 1.00 74.15 ? 192 GLN H CA 1 ATOM 3111 C C . GLN B 2 204 ? 72.358 38.372 19.712 1.00 67.17 ? 192 GLN H C 1 ATOM 3112 O O . GLN B 2 204 ? 71.954 38.669 18.586 1.00 64.12 ? 192 GLN H O 1 ATOM 3113 C CB . GLN B 2 204 ? 74.007 40.107 20.414 1.00 72.30 ? 192 GLN H CB 1 ATOM 3114 C CG . GLN B 2 204 ? 73.047 40.668 21.455 1.00 71.37 ? 192 GLN H CG 1 ATOM 3115 C CD . GLN B 2 204 ? 73.190 39.995 22.807 1.00 75.65 ? 192 GLN H CD 1 ATOM 3116 O OE1 . GLN B 2 204 ? 74.292 39.630 23.219 1.00 83.91 ? 192 GLN H OE1 1 ATOM 3117 N NE2 . GLN B 2 204 ? 72.072 39.824 23.503 1.00 70.41 ? 192 GLN H NE2 1 ATOM 3118 N N . THR B 2 205 ? 71.579 37.833 20.643 1.00 63.93 ? 193 THR H N 1 ATOM 3119 C CA . THR B 2 205 ? 70.159 37.600 20.422 1.00 61.40 ? 193 THR H CA 1 ATOM 3120 C C . THR B 2 205 ? 69.343 38.807 20.881 1.00 57.43 ? 193 THR H C 1 ATOM 3121 O O . THR B 2 205 ? 69.526 39.303 21.993 1.00 58.96 ? 193 THR H O 1 ATOM 3122 C CB . THR B 2 205 ? 69.673 36.333 21.159 1.00 59.19 ? 193 THR H CB 1 ATOM 3123 O OG1 . THR B 2 205 ? 70.227 35.171 20.532 1.00 63.39 ? 193 THR H OG1 1 ATOM 3124 C CG2 . THR B 2 205 ? 68.155 36.237 21.128 1.00 56.17 ? 193 THR H CG2 1 ATOM 3125 N N . TYR B 2 206 ? 68.452 39.283 20.017 1.00 50.60 ? 194 TYR H N 1 ATOM 3126 C CA . TYR B 2 206 ? 67.574 40.393 20.361 1.00 49.39 ? 194 TYR H CA 1 ATOM 3127 C C . TYR B 2 206 ? 66.112 39.959 20.346 1.00 52.78 ? 194 TYR H C 1 ATOM 3128 O O . TYR B 2 206 ? 65.586 39.553 19.310 1.00 53.81 ? 194 TYR H O 1 ATOM 3129 C CB . TYR B 2 206 ? 67.785 41.564 19.400 1.00 43.96 ? 194 TYR H CB 1 ATOM 3130 C CG . TYR B 2 206 ? 69.187 42.118 19.429 1.00 47.71 ? 194 TYR H CG 1 ATOM 3131 C CD1 . TYR B 2 206 ? 69.579 43.020 20.409 1.00 45.87 ? 194 TYR H CD1 1 ATOM 3132 C CD2 . TYR B 2 206 ? 70.123 41.733 18.481 1.00 56.90 ? 194 TYR H CD2 1 ATOM 3133 C CE1 . TYR B 2 206 ? 70.860 43.524 20.442 1.00 51.66 ? 194 TYR H CE1 1 ATOM 3134 C CE2 . TYR B 2 206 ? 71.413 42.234 18.505 1.00 62.80 ? 194 TYR H CE2 1 ATOM 3135 C CZ . TYR B 2 206 ? 71.775 43.131 19.487 1.00 59.77 ? 194 TYR H CZ 1 ATOM 3136 O OH . TYR B 2 206 ? 73.058 43.629 19.516 1.00 60.34 ? 194 TYR H OH 1 ATOM 3137 N N . ILE B 2 207 ? 65.462 40.047 21.501 1.00 53.10 ? 195 ILE H N 1 ATOM 3138 C CA . ILE B 2 207 ? 64.067 39.642 21.621 1.00 51.31 ? 195 ILE H CA 1 ATOM 3139 C C . ILE B 2 207 ? 63.163 40.819 21.993 1.00 47.57 ? 195 ILE H C 1 ATOM 3140 O O . ILE B 2 207 ? 63.482 41.611 22.880 1.00 42.62 ? 195 ILE H O 1 ATOM 3141 C CB . ILE B 2 207 ? 63.898 38.515 22.662 1.00 47.16 ? 195 ILE H CB 1 ATOM 3142 C CG1 . ILE B 2 207 ? 64.711 37.287 22.250 1.00 48.80 ? 195 ILE H CG1 1 ATOM 3143 C CG2 . ILE B 2 207 ? 62.432 38.142 22.821 1.00 45.93 ? 195 ILE H CG2 1 ATOM 3144 C CD1 . ILE B 2 207 ? 64.675 36.163 23.263 1.00 54.45 ? 195 ILE H CD1 1 ATOM 3145 N N . CYS B 2 208 ? 62.041 40.920 21.288 1.00 42.59 ? 196 CYS H N 1 ATOM 3146 C CA . CYS B 2 208 ? 61.008 41.917 21.548 1.00 43.50 ? 196 CYS H CA 1 ATOM 3147 C C . CYS B 2 208 ? 60.057 41.412 22.634 1.00 42.02 ? 196 CYS H C 1 ATOM 3148 O O . CYS B 2 208 ? 59.459 40.352 22.480 1.00 46.03 ? 196 CYS H O 1 ATOM 3149 C CB . CYS B 2 208 ? 60.235 42.211 20.254 1.00 38.47 ? 196 CYS H CB 1 ATOM 3150 S SG . CYS B 2 208 ? 59.381 43.787 20.174 1.00 99.85 ? 196 CYS H SG 1 ATOM 3151 N N . ASN B 2 209 ? 59.919 42.149 23.731 1.00 40.52 ? 197 ASN H N 1 ATOM 3152 C CA . ASN B 2 209 ? 58.986 41.738 24.780 1.00 44.44 ? 197 ASN H CA 1 ATOM 3153 C C . ASN B 2 209 ? 57.742 42.614 24.819 1.00 46.78 ? 197 ASN H C 1 ATOM 3154 O O . ASN B 2 209 ? 57.707 43.622 25.522 1.00 47.35 ? 197 ASN H O 1 ATOM 3155 C CB . ASN B 2 209 ? 59.662 41.756 26.148 1.00 51.46 ? 197 ASN H CB 1 ATOM 3156 C CG . ASN B 2 209 ? 60.976 41.017 26.155 1.00 61.40 ? 197 ASN H CG 1 ATOM 3157 O OD1 . ASN B 2 209 ? 62.022 41.602 26.430 1.00 63.50 ? 197 ASN H OD1 1 ATOM 3158 N ND2 . ASN B 2 209 ? 60.935 39.724 25.851 1.00 66.48 ? 197 ASN H ND2 1 ATOM 3159 N N . VAL B 2 210 ? 56.717 42.214 24.073 1.00 46.51 ? 198 VAL H N 1 ATOM 3160 C CA . VAL B 2 210 ? 55.510 43.018 23.946 1.00 41.36 ? 198 VAL H CA 1 ATOM 3161 C C . VAL B 2 210 ? 54.442 42.609 24.956 1.00 45.21 ? 198 VAL H C 1 ATOM 3162 O O . VAL B 2 210 ? 54.044 41.445 25.019 1.00 50.38 ? 198 VAL H O 1 ATOM 3163 C CB . VAL B 2 210 ? 54.929 42.917 22.531 1.00 37.15 ? 198 VAL H CB 1 ATOM 3164 C CG1 . VAL B 2 210 ? 53.724 43.832 22.389 1.00 36.22 ? 198 VAL H CG1 1 ATOM 3165 C CG2 . VAL B 2 210 ? 55.989 43.273 21.507 1.00 32.66 ? 198 VAL H CG2 1 ATOM 3166 N N . ASN B 2 211 ? 53.985 43.576 25.744 1.00 40.38 ? 199 ASN H N 1 ATOM 3167 C CA . ASN B 2 211 ? 52.941 43.339 26.731 1.00 41.87 ? 199 ASN H CA 1 ATOM 3168 C C . ASN B 2 211 ? 51.667 44.113 26.409 1.00 40.44 ? 199 ASN H C 1 ATOM 3169 O O . ASN B 2 211 ? 51.713 45.315 26.146 1.00 37.89 ? 199 ASN H O 1 ATOM 3170 C CB . ASN B 2 211 ? 53.431 43.716 28.131 1.00 49.36 ? 199 ASN H CB 1 ATOM 3171 C CG . ASN B 2 211 ? 54.332 42.661 28.742 1.00 54.29 ? 199 ASN H CG 1 ATOM 3172 O OD1 . ASN B 2 211 ? 54.878 41.812 28.041 1.00 63.46 ? 199 ASN H OD1 1 ATOM 3173 N ND2 . ASN B 2 211 ? 54.488 42.709 30.059 1.00 52.28 ? 199 ASN H ND2 1 ATOM 3174 N N . HIS B 2 212 ? 50.534 43.417 26.419 1.00 43.82 ? 200 HIS H N 1 ATOM 3175 C CA . HIS B 2 212 ? 49.236 44.067 26.260 1.00 44.14 ? 200 HIS H CA 1 ATOM 3176 C C . HIS B 2 212 ? 48.285 43.604 27.354 1.00 46.04 ? 200 HIS H C 1 ATOM 3177 O O . HIS B 2 212 ? 47.537 42.640 27.176 1.00 49.68 ? 200 HIS H O 1 ATOM 3178 C CB . HIS B 2 212 ? 48.635 43.783 24.882 1.00 50.42 ? 200 HIS H CB 1 ATOM 3179 C CG . HIS B 2 212 ? 47.435 44.621 24.562 1.00 56.22 ? 200 HIS H CG 1 ATOM 3180 N ND1 . HIS B 2 212 ? 46.338 44.128 23.889 1.00 60.12 ? 200 HIS H ND1 1 ATOM 3181 C CD2 . HIS B 2 212 ? 47.163 45.923 24.821 1.00 52.15 ? 200 HIS H CD2 1 ATOM 3182 C CE1 . HIS B 2 212 ? 45.440 45.088 23.751 1.00 56.78 ? 200 HIS H CE1 1 ATOM 3183 N NE2 . HIS B 2 212 ? 45.917 46.187 24.308 1.00 50.37 ? 200 HIS H NE2 1 ATOM 3184 N N . LYS B 2 213 ? 48.332 44.302 28.485 1.00 49.61 ? 201 LYS H N 1 ATOM 3185 C CA . LYS B 2 213 ? 47.500 43.997 29.650 1.00 44.99 ? 201 LYS H CA 1 ATOM 3186 C C . LYS B 2 213 ? 45.988 43.881 29.374 1.00 48.31 ? 201 LYS H C 1 ATOM 3187 O O . LYS B 2 213 ? 45.356 42.949 29.871 1.00 52.55 ? 201 LYS H O 1 ATOM 3188 C CB . LYS B 2 213 ? 47.742 45.052 30.738 1.00 46.06 ? 201 LYS H CB 1 ATOM 3189 C CG . LYS B 2 213 ? 46.966 44.837 32.027 1.00 50.99 ? 201 LYS H CG 1 ATOM 3190 C CD . LYS B 2 213 ? 47.263 45.941 33.032 1.00 55.06 ? 201 LYS H CD 1 ATOM 3191 C CE . LYS B 2 213 ? 46.408 45.819 34.284 1.00 65.28 ? 201 LYS H CE 1 ATOM 3192 N NZ . LYS B 2 213 ? 46.633 44.531 34.999 1.00 73.90 ? 201 LYS H NZ 1 ATOM 3193 N N . PRO B 2 214 ? 45.397 44.815 28.595 1.00 47.75 ? 202 PRO H N 1 ATOM 3194 C CA . PRO B 2 214 ? 43.939 44.715 28.426 1.00 48.35 ? 202 PRO H CA 1 ATOM 3195 C C . PRO B 2 214 ? 43.460 43.406 27.797 1.00 53.29 ? 202 PRO H C 1 ATOM 3196 O O . PRO B 2 214 ? 42.333 42.983 28.061 1.00 63.53 ? 202 PRO H O 1 ATOM 3197 C CB . PRO B 2 214 ? 43.613 45.894 27.505 1.00 43.56 ? 202 PRO H CB 1 ATOM 3198 C CG . PRO B 2 214 ? 44.703 46.874 27.749 1.00 53.59 ? 202 PRO H CG 1 ATOM 3199 C CD . PRO B 2 214 ? 45.929 46.043 27.970 1.00 40.52 ? 202 PRO H CD 1 ATOM 3200 N N . SER B 2 215 ? 44.302 42.774 26.988 1.00 54.90 ? 203 SER H N 1 ATOM 3201 C CA . SER B 2 215 ? 43.922 41.534 26.320 1.00 58.33 ? 203 SER H CA 1 ATOM 3202 C C . SER B 2 215 ? 44.588 40.313 26.948 1.00 58.99 ? 203 SER H C 1 ATOM 3203 O O . SER B 2 215 ? 44.449 39.199 26.441 1.00 57.43 ? 203 SER H O 1 ATOM 3204 C CB . SER B 2 215 ? 44.271 41.605 24.834 1.00 55.89 ? 203 SER H CB 1 ATOM 3205 O OG . SER B 2 215 ? 45.663 41.784 24.654 1.00 57.14 ? 203 SER H OG 1 ATOM 3206 N N . ASN B 2 216 ? 45.306 40.532 28.047 1.00 49.79 ? 204 ASN H N 1 ATOM 3207 C CA . ASN B 2 216 ? 46.056 39.474 28.717 1.00 53.86 ? 204 ASN H CA 1 ATOM 3208 C C . ASN B 2 216 ? 47.029 38.791 27.756 1.00 47.65 ? 204 ASN H C 1 ATOM 3209 O O . ASN B 2 216 ? 47.172 37.570 27.758 1.00 50.69 ? 204 ASN H O 1 ATOM 3210 C CB . ASN B 2 216 ? 45.103 38.443 29.328 1.00 52.45 ? 204 ASN H CB 1 ATOM 3211 C CG . ASN B 2 216 ? 45.780 37.562 30.359 1.00 54.48 ? 204 ASN H CG 1 ATOM 3212 O OD1 . ASN B 2 216 ? 46.580 38.034 31.164 1.00 54.23 ? 204 ASN H OD1 1 ATOM 3213 N ND2 . ASN B 2 216 ? 45.466 36.272 30.333 1.00 54.84 ? 204 ASN H ND2 1 ATOM 3214 N N . THR B 2 217 ? 47.695 39.593 26.934 1.00 45.51 ? 205 THR H N 1 ATOM 3215 C CA . THR B 2 217 ? 48.566 39.071 25.886 1.00 48.01 ? 205 THR H CA 1 ATOM 3216 C C . THR B 2 217 ? 50.036 39.406 26.128 1.00 46.10 ? 205 THR H C 1 ATOM 3217 O O . THR B 2 217 ? 50.389 40.562 26.351 1.00 46.39 ? 205 THR H O 1 ATOM 3218 C CB . THR B 2 217 ? 48.157 39.620 24.500 1.00 45.75 ? 205 THR H CB 1 ATOM 3219 O OG1 . THR B 2 217 ? 46.802 39.250 24.216 1.00 63.45 ? 205 THR H OG1 1 ATOM 3220 C CG2 . THR B 2 217 ? 49.066 39.070 23.411 1.00 63.31 ? 205 THR H CG2 1 ATOM 3221 N N . LYS B 2 218 ? 50.886 38.386 26.088 1.00 51.13 ? 206 LYS H N 1 ATOM 3222 C CA . LYS B 2 218 ? 52.333 38.589 26.100 1.00 50.50 ? 206 LYS H CA 1 ATOM 3223 C C . LYS B 2 218 ? 52.976 37.861 24.928 1.00 51.79 ? 206 LYS H C 1 ATOM 3224 O O . LYS B 2 218 ? 52.767 36.659 24.740 1.00 54.96 ? 206 LYS H O 1 ATOM 3225 C CB . LYS B 2 218 ? 52.949 38.112 27.417 1.00 57.31 ? 206 LYS H CB 1 ATOM 3226 C CG . LYS B 2 218 ? 52.702 39.042 28.592 1.00 60.68 ? 206 LYS H CG 1 ATOM 3227 C CD . LYS B 2 218 ? 53.421 38.552 29.840 1.00 60.41 ? 206 LYS H CD 1 ATOM 3228 C CE . LYS B 2 218 ? 53.176 39.491 31.009 1.00 63.84 ? 206 LYS H CE 1 ATOM 3229 N NZ . LYS B 2 218 ? 53.951 39.099 32.219 1.00 67.63 ? 206 LYS H NZ 1 ATOM 3230 N N . VAL B 2 219 ? 53.752 38.597 24.137 1.00 47.48 ? 207 VAL H N 1 ATOM 3231 C CA . VAL B 2 219 ? 54.437 38.023 22.984 1.00 45.13 ? 207 VAL H CA 1 ATOM 3232 C C . VAL B 2 219 ? 55.928 38.327 23.013 1.00 47.51 ? 207 VAL H C 1 ATOM 3233 O O . VAL B 2 219 ? 56.335 39.473 23.206 1.00 46.55 ? 207 VAL H O 1 ATOM 3234 C CB . VAL B 2 219 ? 53.856 38.549 21.657 1.00 47.08 ? 207 VAL H CB 1 ATOM 3235 C CG1 . VAL B 2 219 ? 54.615 37.964 20.473 1.00 41.69 ? 207 VAL H CG1 1 ATOM 3236 C CG2 . VAL B 2 219 ? 52.376 38.228 21.555 1.00 42.67 ? 207 VAL H CG2 1 ATOM 3237 N N . ASP B 2 220 ? 56.739 37.293 22.823 1.00 52.73 ? 208 ASP H N 1 ATOM 3238 C CA . ASP B 2 220 ? 58.177 37.471 22.678 1.00 46.98 ? 208 ASP H CA 1 ATOM 3239 C C . ASP B 2 220 ? 58.597 37.141 21.253 1.00 46.96 ? 208 ASP H C 1 ATOM 3240 O O . ASP B 2 220 ? 58.377 36.030 20.769 1.00 54.68 ? 208 ASP H O 1 ATOM 3241 C CB . ASP B 2 220 ? 58.937 36.606 23.683 1.00 49.29 ? 208 ASP H CB 1 ATOM 3242 C CG . ASP B 2 220 ? 58.773 37.099 25.106 1.00 54.87 ? 208 ASP H CG 1 ATOM 3243 O OD1 . ASP B 2 220 ? 58.586 38.322 25.285 1.00 55.65 ? 208 ASP H OD1 1 ATOM 3244 O OD2 . ASP B 2 220 ? 58.827 36.272 26.042 1.00 60.83 ? 208 ASP H OD2 1 ATOM 3245 N N . LYS B 2 221 ? 59.190 38.119 20.579 1.00 43.63 ? 209 LYS H N 1 ATOM 3246 C CA . LYS B 2 221 ? 59.597 37.944 19.193 1.00 46.81 ? 209 LYS H CA 1 ATOM 3247 C C . LYS B 2 221 ? 61.094 38.157 19.024 1.00 50.74 ? 209 LYS H C 1 ATOM 3248 O O . LYS B 2 221 ? 61.609 39.250 19.262 1.00 51.27 ? 209 LYS H O 1 ATOM 3249 C CB . LYS B 2 221 ? 58.823 38.898 18.281 1.00 45.94 ? 209 LYS H CB 1 ATOM 3250 C CG . LYS B 2 221 ? 59.169 38.762 16.809 1.00 48.98 ? 209 LYS H CG 1 ATOM 3251 C CD . LYS B 2 221 ? 58.806 37.386 16.273 1.00 52.37 ? 209 LYS H CD 1 ATOM 3252 C CE . LYS B 2 221 ? 57.309 37.137 16.348 1.00 56.61 ? 209 LYS H CE 1 ATOM 3253 N NZ . LYS B 2 221 ? 56.930 35.811 15.783 1.00 62.96 ? 209 LYS H NZ 1 ATOM 3254 N N . LYS B 2 222 ? 61.788 37.100 18.616 1.00 50.68 ? 210 LYS H N 1 ATOM 3255 C CA . LYS B 2 222 ? 63.213 37.176 18.340 1.00 49.21 ? 210 LYS H CA 1 ATOM 3256 C C . LYS B 2 222 ? 63.458 37.825 16.981 1.00 54.20 ? 210 LYS H C 1 ATOM 3257 O O . LYS B 2 222 ? 62.933 37.372 15.963 1.00 58.04 ? 210 LYS H O 1 ATOM 3258 C CB . LYS B 2 222 ? 63.845 35.783 18.385 1.00 48.60 ? 210 LYS H CB 1 ATOM 3259 C CG . LYS B 2 222 ? 65.351 35.773 18.160 1.00 54.04 ? 210 LYS H CG 1 ATOM 3260 C CD . LYS B 2 222 ? 65.920 34.359 18.220 1.00 55.11 ? 210 LYS H CD 1 ATOM 3261 C CE . LYS B 2 222 ? 67.423 34.363 17.997 1.00 59.11 ? 210 LYS H CE 1 ATOM 3262 N NZ . LYS B 2 222 ? 68.016 32.999 18.103 1.00 64.83 ? 210 LYS H NZ 1 ATOM 3263 N N . VAL B 2 223 ? 64.258 38.887 16.972 1.00 52.99 ? 211 VAL H N 1 ATOM 3264 C CA . VAL B 2 223 ? 64.585 39.587 15.737 1.00 51.68 ? 211 VAL H CA 1 ATOM 3265 C C . VAL B 2 223 ? 65.939 39.147 15.188 1.00 55.81 ? 211 VAL H C 1 ATOM 3266 O O . VAL B 2 223 ? 66.981 39.372 15.807 1.00 55.12 ? 211 VAL H O 1 ATOM 3267 C CB . VAL B 2 223 ? 64.592 41.111 15.940 1.00 45.18 ? 211 VAL H CB 1 ATOM 3268 C CG1 . VAL B 2 223 ? 64.876 41.818 14.627 1.00 46.57 ? 211 VAL H CG1 1 ATOM 3269 C CG2 . VAL B 2 223 ? 63.266 41.565 16.517 1.00 42.55 ? 211 VAL H CG2 1 ATOM 3270 N N . GLU B 2 224 ? 65.910 38.515 14.020 1.00 57.85 ? 212 GLU H N 1 ATOM 3271 C CA . GLU B 2 224 ? 67.121 38.053 13.360 1.00 58.50 ? 212 GLU H CA 1 ATOM 3272 C C . GLU B 2 224 ? 67.315 38.781 12.034 1.00 61.06 ? 212 GLU H C 1 ATOM 3273 O O . GLU B 2 224 ? 66.342 39.166 11.387 1.00 62.04 ? 212 GLU H O 1 ATOM 3274 C CB . GLU B 2 224 ? 67.060 36.544 13.128 1.00 65.07 ? 212 GLU H CB 1 ATOM 3275 C CG . GLU B 2 224 ? 66.869 35.725 14.389 1.00 69.49 ? 212 GLU H CG 1 ATOM 3276 C CD . GLU B 2 224 ? 66.931 34.237 14.117 1.00 76.87 ? 212 GLU H CD 1 ATOM 3277 O OE1 . GLU B 2 224 ? 66.498 33.451 14.985 1.00 80.97 ? 212 GLU H OE1 1 ATOM 3278 O OE2 . GLU B 2 224 ? 67.415 33.855 13.031 1.00 80.06 ? 212 GLU H OE2 1 ATOM 3279 N N . PRO B 2 225 ? 68.578 38.978 11.627 1.00 65.07 ? 213 PRO H N 1 ATOM 3280 C CA . PRO B 2 225 ? 68.868 39.631 10.346 1.00 72.81 ? 213 PRO H CA 1 ATOM 3281 C C . PRO B 2 225 ? 68.357 38.817 9.158 1.00 84.35 ? 213 PRO H C 1 ATOM 3282 O O . PRO B 2 225 ? 68.335 37.588 9.224 1.00 81.95 ? 213 PRO H O 1 ATOM 3283 C CB . PRO B 2 225 ? 70.398 39.725 10.336 1.00 68.92 ? 213 PRO H CB 1 ATOM 3284 C CG . PRO B 2 225 ? 70.856 38.683 11.298 1.00 65.54 ? 213 PRO H CG 1 ATOM 3285 C CD . PRO B 2 225 ? 69.805 38.622 12.358 1.00 65.66 ? 213 PRO H CD 1 ATOM 3286 N N . LYS B 2 226 ? 67.948 39.498 8.092 1.00 97.58 ? 214 LYS H N 1 ATOM 3287 C CA . LYS B 2 226 ? 67.387 38.825 6.924 1.00 106.10 ? 214 LYS H CA 1 ATOM 3288 C C . LYS B 2 226 ? 68.353 38.835 5.742 1.00 112.61 ? 214 LYS H C 1 ATOM 3289 O O . LYS B 2 226 ? 68.895 39.880 5.379 1.00 115.76 ? 214 LYS H O 1 ATOM 3290 C CB . LYS B 2 226 ? 66.061 39.474 6.516 1.00 106.17 ? 214 LYS H CB 1 ATOM 3291 C CG . LYS B 2 226 ? 65.361 38.782 5.353 1.00 111.88 ? 214 LYS H CG 1 ATOM 3292 C CD . LYS B 2 226 ? 64.123 39.549 4.907 1.00 111.71 ? 214 LYS H CD 1 ATOM 3293 C CE . LYS B 2 226 ? 63.130 39.713 6.047 1.00 105.05 ? 214 LYS H CE 1 ATOM 3294 N NZ . LYS B 2 226 ? 61.937 40.502 5.636 1.00 103.26 ? 214 LYS H NZ 1 ATOM 3295 N N . SER B 2 227 ? 68.561 37.665 5.146 1.00 114.28 ? 215 SER H N 1 ATOM 3296 C CA . SER B 2 227 ? 69.418 37.540 3.974 1.00 115.04 ? 215 SER H CA 1 ATOM 3297 C C . SER B 2 227 ? 69.048 36.301 3.167 1.00 116.95 ? 215 SER H C 1 ATOM 3298 O O . SER B 2 227 ? 68.024 35.667 3.425 1.00 113.55 ? 215 SER H O 1 ATOM 3299 C CB . SER B 2 227 ? 70.892 37.486 4.384 1.00 113.96 ? 215 SER H CB 1 ATOM 3300 O OG . SER B 2 227 ? 71.143 36.385 5.241 1.00 113.51 ? 215 SER H OG 1 ATOM 3301 N N . ASP C 3 1 ? 32.033 83.307 30.304 1.00 55.19 ? 1 ASP L N 1 ATOM 3302 C CA . ASP C 3 1 ? 33.127 82.457 30.764 1.00 59.08 ? 1 ASP L CA 1 ATOM 3303 C C . ASP C 3 1 ? 34.486 83.132 30.615 1.00 59.23 ? 1 ASP L C 1 ATOM 3304 O O . ASP C 3 1 ? 34.779 83.749 29.592 1.00 61.55 ? 1 ASP L O 1 ATOM 3305 C CB . ASP C 3 1 ? 33.126 81.127 30.009 1.00 60.84 ? 1 ASP L CB 1 ATOM 3306 C CG . ASP C 3 1 ? 31.985 80.225 30.426 1.00 66.02 ? 1 ASP L CG 1 ATOM 3307 O OD1 . ASP C 3 1 ? 31.008 80.737 31.011 1.00 70.06 ? 1 ASP L OD1 1 ATOM 3308 O OD2 . ASP C 3 1 ? 32.066 79.006 30.169 1.00 67.97 ? 1 ASP L OD2 1 ATOM 3309 N N . ILE C 3 2 ? 35.315 82.999 31.645 1.00 56.98 ? 2 ILE L N 1 ATOM 3310 C CA . ILE C 3 2 ? 36.649 83.581 31.642 1.00 53.75 ? 2 ILE L CA 1 ATOM 3311 C C . ILE C 3 2 ? 37.570 82.828 30.685 1.00 53.32 ? 2 ILE L C 1 ATOM 3312 O O . ILE C 3 2 ? 37.805 81.628 30.841 1.00 46.35 ? 2 ILE L O 1 ATOM 3313 C CB . ILE C 3 2 ? 37.265 83.577 33.053 1.00 53.02 ? 2 ILE L CB 1 ATOM 3314 C CG1 . ILE C 3 2 ? 36.378 84.367 34.019 1.00 52.37 ? 2 ILE L CG1 1 ATOM 3315 C CG2 . ILE C 3 2 ? 38.679 84.144 33.018 1.00 47.05 ? 2 ILE L CG2 1 ATOM 3316 C CD1 . ILE C 3 2 ? 36.809 84.282 35.470 1.00 45.19 ? 2 ILE L CD1 1 ATOM 3317 N N . GLN C 3 3 ? 38.086 83.547 29.694 1.00 58.25 ? 3 GLN L N 1 ATOM 3318 C CA . GLN C 3 3 ? 38.977 82.969 28.696 1.00 58.03 ? 3 GLN L CA 1 ATOM 3319 C C . GLN C 3 3 ? 40.436 83.266 29.034 1.00 52.36 ? 3 GLN L C 1 ATOM 3320 O O . GLN C 3 3 ? 40.790 84.404 29.336 1.00 50.01 ? 3 GLN L O 1 ATOM 3321 C CB . GLN C 3 3 ? 38.635 83.508 27.305 1.00 65.84 ? 3 GLN L CB 1 ATOM 3322 C CG . GLN C 3 3 ? 39.339 82.784 26.174 1.00 77.09 ? 3 GLN L CG 1 ATOM 3323 C CD . GLN C 3 3 ? 39.074 81.293 26.199 1.00 81.94 ? 3 GLN L CD 1 ATOM 3324 O OE1 . GLN C 3 3 ? 39.883 80.516 26.708 1.00 80.90 ? 3 GLN L OE1 1 ATOM 3325 N NE2 . GLN C 3 3 ? 37.934 80.885 25.652 1.00 85.10 ? 3 GLN L NE2 1 ATOM 3326 N N . LEU C 3 4 ? 41.278 82.238 28.983 1.00 50.83 ? 4 LEU L N 1 ATOM 3327 C CA . LEU C 3 4 ? 42.700 82.395 29.276 1.00 47.85 ? 4 LEU L CA 1 ATOM 3328 C C . LEU C 3 4 ? 43.565 82.173 28.041 1.00 43.72 ? 4 LEU L C 1 ATOM 3329 O O . LEU C 3 4 ? 43.580 81.085 27.468 1.00 41.38 ? 4 LEU L O 1 ATOM 3330 C CB . LEU C 3 4 ? 43.136 81.429 30.381 1.00 48.43 ? 4 LEU L CB 1 ATOM 3331 C CG . LEU C 3 4 ? 42.663 81.700 31.807 1.00 42.41 ? 4 LEU L CG 1 ATOM 3332 C CD1 . LEU C 3 4 ? 43.189 80.620 32.731 1.00 39.07 ? 4 LEU L CD1 1 ATOM 3333 C CD2 . LEU C 3 4 ? 43.117 83.075 32.271 1.00 40.87 ? 4 LEU L CD2 1 ATOM 3334 N N . THR C 3 5 ? 44.293 83.210 27.644 1.00 42.58 ? 5 THR L N 1 ATOM 3335 C CA . THR C 3 5 ? 45.201 83.109 26.510 1.00 43.03 ? 5 THR L CA 1 ATOM 3336 C C . THR C 3 5 ? 46.640 82.956 26.987 1.00 44.04 ? 5 THR L C 1 ATOM 3337 O O . THR C 3 5 ? 47.241 83.898 27.504 1.00 41.92 ? 5 THR L O 1 ATOM 3338 C CB . THR C 3 5 ? 45.093 84.331 25.588 1.00 44.96 ? 5 THR L CB 1 ATOM 3339 O OG1 . THR C 3 5 ? 43.751 84.437 25.100 1.00 49.90 ? 5 THR L OG1 1 ATOM 3340 C CG2 . THR C 3 5 ? 46.044 84.194 24.412 1.00 46.77 ? 5 THR L CG2 1 ATOM 3341 N N . GLN C 3 6 ? 47.179 81.756 26.813 1.00 40.70 ? 6 GLN L N 1 ATOM 3342 C CA . GLN C 3 6 ? 48.537 81.452 27.235 1.00 37.71 ? 6 GLN L CA 1 ATOM 3343 C C . GLN C 3 6 ? 49.501 81.551 26.059 1.00 39.78 ? 6 GLN L C 1 ATOM 3344 O O . GLN C 3 6 ? 49.318 80.890 25.037 1.00 42.96 ? 6 GLN L O 1 ATOM 3345 C CB . GLN C 3 6 ? 48.593 80.057 27.858 1.00 37.68 ? 6 GLN L CB 1 ATOM 3346 C CG . GLN C 3 6 ? 49.904 79.722 28.535 1.00 35.32 ? 6 GLN L CG 1 ATOM 3347 C CD . GLN C 3 6 ? 49.847 78.401 29.271 1.00 37.79 ? 6 GLN L CD 1 ATOM 3348 O OE1 . GLN C 3 6 ? 48.767 77.889 29.568 1.00 38.81 ? 6 GLN L OE1 1 ATOM 3349 N NE2 . GLN C 3 6 ? 51.013 77.838 29.568 1.00 38.90 ? 6 GLN L NE2 1 ATOM 3350 N N . SER C 3 7 ? 50.524 82.387 26.204 1.00 38.13 ? 7 SER L N 1 ATOM 3351 C CA . SER C 3 7 ? 51.513 82.566 25.150 1.00 42.91 ? 7 SER L CA 1 ATOM 3352 C C . SER C 3 7 ? 52.934 82.582 25.720 1.00 44.71 ? 7 SER L C 1 ATOM 3353 O O . SER C 3 7 ? 53.155 83.064 26.834 1.00 43.95 ? 7 SER L O 1 ATOM 3354 C CB . SER C 3 7 ? 51.235 83.856 24.372 1.00 51.35 ? 7 SER L CB 1 ATOM 3355 O OG . SER C 3 7 ? 51.284 84.986 25.223 1.00 58.16 ? 7 SER L OG 1 ATOM 3356 N N . PRO C 3 8 ? 53.905 82.047 24.958 1.00 41.25 ? 8 PRO L N 1 ATOM 3357 C CA . PRO C 3 8 ? 53.712 81.435 23.638 1.00 42.21 ? 8 PRO L CA 1 ATOM 3358 C C . PRO C 3 8 ? 53.213 79.994 23.720 1.00 42.62 ? 8 PRO L C 1 ATOM 3359 O O . PRO C 3 8 ? 53.199 79.407 24.799 1.00 40.16 ? 8 PRO L O 1 ATOM 3360 C CB . PRO C 3 8 ? 55.111 81.493 23.024 1.00 41.00 ? 8 PRO L CB 1 ATOM 3361 C CG . PRO C 3 8 ? 56.022 81.393 24.193 1.00 40.97 ? 8 PRO L CG 1 ATOM 3362 C CD . PRO C 3 8 ? 55.328 82.089 25.339 1.00 40.76 ? 8 PRO L CD 1 ATOM 3363 N N . SER C 3 9 ? 52.802 79.444 22.582 1.00 46.58 ? 9 SER L N 1 ATOM 3364 C CA . SER C 3 9 ? 52.301 78.075 22.519 1.00 45.91 ? 9 SER L CA 1 ATOM 3365 C C . SER C 3 9 ? 53.426 77.069 22.736 1.00 41.67 ? 9 SER L C 1 ATOM 3366 O O . SER C 3 9 ? 53.223 76.007 23.319 1.00 39.22 ? 9 SER L O 1 ATOM 3367 C CB . SER C 3 9 ? 51.614 77.822 21.173 1.00 58.07 ? 9 SER L CB 1 ATOM 3368 O OG . SER C 3 9 ? 51.176 76.479 21.067 1.00 64.22 ? 9 SER L OG 1 ATOM 3369 N N . SER C 3 10 ? 54.615 77.412 22.256 1.00 41.88 ? 10 SER L N 1 ATOM 3370 C CA . SER C 3 10 ? 55.798 76.596 22.480 1.00 42.79 ? 10 SER L CA 1 ATOM 3371 C C . SER C 3 10 ? 57.054 77.445 22.359 1.00 44.31 ? 10 SER L C 1 ATOM 3372 O O . SER C 3 10 ? 57.054 78.470 21.679 1.00 50.10 ? 10 SER L O 1 ATOM 3373 C CB . SER C 3 10 ? 55.847 75.429 21.494 1.00 45.66 ? 10 SER L CB 1 ATOM 3374 O OG . SER C 3 10 ? 55.797 75.887 20.158 1.00 46.50 ? 10 SER L OG 1 ATOM 3375 N N . LEU C 3 11 ? 58.120 77.023 23.027 1.00 45.32 ? 11 LEU L N 1 ATOM 3376 C CA . LEU C 3 11 ? 59.405 77.700 22.896 1.00 50.68 ? 11 LEU L CA 1 ATOM 3377 C C . LEU C 3 11 ? 60.565 76.721 23.045 1.00 47.70 ? 11 LEU L C 1 ATOM 3378 O O . LEU C 3 11 ? 60.467 75.738 23.780 1.00 47.25 ? 11 LEU L O 1 ATOM 3379 C CB . LEU C 3 11 ? 59.525 78.833 23.923 1.00 49.59 ? 11 LEU L CB 1 ATOM 3380 C CG . LEU C 3 11 ? 59.445 78.501 25.415 1.00 50.04 ? 11 LEU L CG 1 ATOM 3381 C CD1 . LEU C 3 11 ? 60.828 78.255 26.005 1.00 50.95 ? 11 LEU L CD1 1 ATOM 3382 C CD2 . LEU C 3 11 ? 58.727 79.607 26.177 1.00 49.42 ? 11 LEU L CD2 1 ATOM 3383 N N . SER C 3 12 ? 61.650 76.992 22.325 1.00 46.43 ? 12 SER L N 1 ATOM 3384 C CA . SER C 3 12 ? 62.891 76.239 22.466 1.00 39.53 ? 12 SER L CA 1 ATOM 3385 C C . SER C 3 12 ? 63.884 77.035 23.302 1.00 49.04 ? 12 SER L C 1 ATOM 3386 O O . SER C 3 12 ? 64.045 78.240 23.105 1.00 42.57 ? 12 SER L O 1 ATOM 3387 C CB . SER C 3 12 ? 63.503 75.920 21.101 1.00 42.76 ? 12 SER L CB 1 ATOM 3388 O OG . SER C 3 12 ? 62.579 75.261 20.256 1.00 57.11 ? 12 SER L OG 1 ATOM 3389 N N . ALA C 3 13 ? 64.554 76.360 24.228 1.00 44.27 ? 13 ALA L N 1 ATOM 3390 C CA . ALA C 3 13 ? 65.484 77.030 25.122 1.00 42.88 ? 13 ALA L CA 1 ATOM 3391 C C . ALA C 3 13 ? 66.601 76.098 25.583 1.00 45.12 ? 13 ALA L C 1 ATOM 3392 O O . ALA C 3 13 ? 66.434 74.879 25.613 1.00 42.06 ? 13 ALA L O 1 ATOM 3393 C CB . ALA C 3 13 ? 64.736 77.595 26.319 1.00 37.59 ? 13 ALA L CB 1 ATOM 3394 N N . SER C 3 14 ? 67.741 76.684 25.936 1.00 45.74 ? 14 SER L N 1 ATOM 3395 C CA . SER C 3 14 ? 68.873 75.924 26.452 1.00 43.39 ? 14 SER L CA 1 ATOM 3396 C C . SER C 3 14 ? 68.853 75.889 27.972 1.00 41.57 ? 14 SER L C 1 ATOM 3397 O O . SER C 3 14 ? 68.190 76.701 28.609 1.00 43.96 ? 14 SER L O 1 ATOM 3398 C CB . SER C 3 14 ? 70.197 76.522 25.970 1.00 43.84 ? 14 SER L CB 1 ATOM 3399 O OG . SER C 3 14 ? 70.282 76.515 24.558 1.00 62.84 ? 14 SER L OG 1 ATOM 3400 N N . VAL C 3 15 ? 69.588 74.948 28.549 1.00 43.00 ? 15 VAL L N 1 ATOM 3401 C CA . VAL C 3 15 ? 69.748 74.889 29.995 1.00 43.75 ? 15 VAL L CA 1 ATOM 3402 C C . VAL C 3 15 ? 70.436 76.147 30.516 1.00 47.32 ? 15 VAL L C 1 ATOM 3403 O O . VAL C 3 15 ? 71.539 76.479 30.090 1.00 46.29 ? 15 VAL L O 1 ATOM 3404 C CB . VAL C 3 15 ? 70.561 73.652 30.421 1.00 42.57 ? 15 VAL L CB 1 ATOM 3405 C CG1 . VAL C 3 15 ? 71.000 73.772 31.870 1.00 34.84 ? 15 VAL L CG1 1 ATOM 3406 C CG2 . VAL C 3 15 ? 69.751 72.387 30.198 1.00 31.88 ? 15 VAL L CG2 1 ATOM 3407 N N . GLY C 3 16 ? 69.771 76.854 31.425 1.00 50.39 ? 16 GLY L N 1 ATOM 3408 C CA . GLY C 3 16 ? 70.377 77.997 32.083 1.00 40.63 ? 16 GLY L CA 1 ATOM 3409 C C . GLY C 3 16 ? 69.859 79.375 31.709 1.00 42.55 ? 16 GLY L C 1 ATOM 3410 O O . GLY C 3 16 ? 70.200 80.356 32.366 1.00 44.97 ? 16 GLY L O 1 ATOM 3411 N N . ASP C 3 17 ? 69.039 79.473 30.668 1.00 52.67 ? 17 ASP L N 1 ATOM 3412 C CA . ASP C 3 17 ? 68.579 80.791 30.233 1.00 62.94 ? 17 ASP L CA 1 ATOM 3413 C C . ASP C 3 17 ? 67.187 81.140 30.765 1.00 52.76 ? 17 ASP L C 1 ATOM 3414 O O . ASP C 3 17 ? 66.497 80.300 31.340 1.00 47.68 ? 17 ASP L O 1 ATOM 3415 C CB . ASP C 3 17 ? 68.608 80.897 28.703 1.00 72.06 ? 17 ASP L CB 1 ATOM 3416 C CG . ASP C 3 17 ? 67.952 79.723 28.018 1.00 71.62 ? 17 ASP L CG 1 ATOM 3417 O OD1 . ASP C 3 17 ? 66.940 79.216 28.540 1.00 76.61 ? 17 ASP L OD1 1 ATOM 3418 O OD2 . ASP C 3 17 ? 68.451 79.310 26.951 1.00 68.76 ? 17 ASP L OD2 1 ATOM 3419 N N . ARG C 3 18 ? 66.796 82.396 30.572 1.00 54.60 ? 18 ARG L N 1 ATOM 3420 C CA . ARG C 3 18 ? 65.538 82.922 31.095 1.00 49.08 ? 18 ARG L CA 1 ATOM 3421 C C . ARG C 3 18 ? 64.356 82.596 30.193 1.00 41.42 ? 18 ARG L C 1 ATOM 3422 O O . ARG C 3 18 ? 64.416 82.804 28.983 1.00 51.59 ? 18 ARG L O 1 ATOM 3423 C CB . ARG C 3 18 ? 65.640 84.438 31.276 1.00 56.96 ? 18 ARG L CB 1 ATOM 3424 C CG . ARG C 3 18 ? 64.349 85.093 31.722 1.00 56.84 ? 18 ARG L CG 1 ATOM 3425 C CD . ARG C 3 18 ? 64.270 85.171 33.231 1.00 52.88 ? 18 ARG L CD 1 ATOM 3426 N NE . ARG C 3 18 ? 65.104 86.246 33.756 1.00 57.70 ? 18 ARG L NE 1 ATOM 3427 C CZ . ARG C 3 18 ? 64.671 87.478 33.999 1.00 63.93 ? 18 ARG L CZ 1 ATOM 3428 N NH1 . ARG C 3 18 ? 63.405 87.796 33.773 1.00 54.68 ? 18 ARG L NH1 1 ATOM 3429 N NH2 . ARG C 3 18 ? 65.509 88.391 34.474 1.00 74.23 ? 18 ARG L NH2 1 ATOM 3430 N N . VAL C 3 19 ? 63.277 82.098 30.788 1.00 55.21 ? 19 VAL L N 1 ATOM 3431 C CA . VAL C 3 19 ? 62.075 81.747 30.038 1.00 51.59 ? 19 VAL L CA 1 ATOM 3432 C C . VAL C 3 19 ? 60.836 82.412 30.635 1.00 59.40 ? 19 VAL L C 1 ATOM 3433 O O . VAL C 3 19 ? 60.581 82.305 31.836 1.00 54.33 ? 19 VAL L O 1 ATOM 3434 C CB . VAL C 3 19 ? 61.867 80.217 29.999 1.00 58.57 ? 19 VAL L CB 1 ATOM 3435 C CG1 . VAL C 3 19 ? 60.485 79.872 29.479 1.00 45.14 ? 19 VAL L CG1 1 ATOM 3436 C CG2 . VAL C 3 19 ? 62.937 79.568 29.143 1.00 65.79 ? 19 VAL L CG2 1 ATOM 3437 N N . THR C 3 20 ? 60.068 83.094 29.788 1.00 59.62 ? 20 THR L N 1 ATOM 3438 C CA . THR C 3 20 ? 58.884 83.822 30.234 1.00 51.47 ? 20 THR L CA 1 ATOM 3439 C C . THR C 3 20 ? 57.614 83.341 29.525 1.00 46.23 ? 20 THR L C 1 ATOM 3440 O O . THR C 3 20 ? 57.541 83.334 28.298 1.00 50.15 ? 20 THR L O 1 ATOM 3441 C CB . THR C 3 20 ? 59.051 85.339 30.008 1.00 50.44 ? 20 THR L CB 1 ATOM 3442 O OG1 . THR C 3 20 ? 60.063 85.846 30.884 1.00 56.85 ? 20 THR L OG1 1 ATOM 3443 C CG2 . THR C 3 20 ? 57.754 86.074 30.284 1.00 61.24 ? 20 THR L CG2 1 ATOM 3444 N N . ILE C 3 21 ? 56.622 82.935 30.313 1.00 40.50 ? 21 ILE L N 1 ATOM 3445 C CA . ILE C 3 21 ? 55.323 82.519 29.792 1.00 40.94 ? 21 ILE L CA 1 ATOM 3446 C C . ILE C 3 21 ? 54.223 83.426 30.326 1.00 40.10 ? 21 ILE L C 1 ATOM 3447 O O . ILE C 3 21 ? 54.108 83.617 31.534 1.00 43.56 ? 21 ILE L O 1 ATOM 3448 C CB . ILE C 3 21 ? 54.986 81.071 30.179 1.00 43.12 ? 21 ILE L CB 1 ATOM 3449 C CG1 . ILE C 3 21 ? 56.104 80.120 29.748 1.00 46.06 ? 21 ILE L CG1 1 ATOM 3450 C CG2 . ILE C 3 21 ? 53.651 80.655 29.572 1.00 39.84 ? 21 ILE L CG2 1 ATOM 3451 C CD1 . ILE C 3 21 ? 55.916 78.703 30.252 1.00 44.95 ? 21 ILE L CD1 1 ATOM 3452 N N . THR C 3 22 ? 53.407 83.976 29.432 1.00 37.83 ? 22 THR L N 1 ATOM 3453 C CA . THR C 3 22 ? 52.360 84.901 29.842 1.00 37.53 ? 22 THR L CA 1 ATOM 3454 C C . THR C 3 22 ? 50.971 84.288 29.745 1.00 42.97 ? 22 THR L C 1 ATOM 3455 O O . THR C 3 22 ? 50.671 83.539 28.817 1.00 44.59 ? 22 THR L O 1 ATOM 3456 C CB . THR C 3 22 ? 52.382 86.186 29.000 1.00 47.83 ? 22 THR L CB 1 ATOM 3457 O OG1 . THR C 3 22 ? 52.158 85.860 27.624 1.00 50.25 ? 22 THR L OG1 1 ATOM 3458 C CG2 . THR C 3 22 ? 53.720 86.896 29.139 1.00 44.02 ? 22 THR L CG2 1 ATOM 3459 N N . CYS C 3 23 ? 50.126 84.616 30.717 1.00 42.81 ? 23 CYS L N 1 ATOM 3460 C CA . CYS C 3 23 ? 48.727 84.214 30.692 1.00 47.42 ? 23 CYS L CA 1 ATOM 3461 C C . CYS C 3 23 ? 47.837 85.441 30.854 1.00 45.29 ? 23 CYS L C 1 ATOM 3462 O O . CYS C 3 23 ? 48.042 86.251 31.756 1.00 44.00 ? 23 CYS L O 1 ATOM 3463 C CB . CYS C 3 23 ? 48.431 83.194 31.792 1.00 50.19 ? 23 CYS L CB 1 ATOM 3464 S SG . CYS C 3 23 ? 46.846 82.348 31.624 1.00 69.42 ? 23 CYS L SG 1 ATOM 3465 N N . ARG C 3 24 ? 46.853 85.580 29.974 1.00 47.99 ? 24 ARG L N 1 ATOM 3466 C CA . ARG C 3 24 ? 45.964 86.736 30.015 1.00 51.89 ? 24 ARG L CA 1 ATOM 3467 C C . ARG C 3 24 ? 44.495 86.330 30.065 1.00 46.01 ? 24 ARG L C 1 ATOM 3468 O O . ARG C 3 24 ? 44.016 85.562 29.235 1.00 42.92 ? 24 ARG L O 1 ATOM 3469 C CB . ARG C 3 24 ? 46.233 87.644 28.814 1.00 55.05 ? 24 ARG L CB 1 ATOM 3470 C CG . ARG C 3 24 ? 47.543 88.403 28.943 1.00 64.85 ? 24 ARG L CG 1 ATOM 3471 C CD . ARG C 3 24 ? 48.125 88.803 27.599 1.00 72.79 ? 24 ARG L CD 1 ATOM 3472 N NE . ARG C 3 24 ? 49.382 89.525 27.775 1.00 77.91 ? 24 ARG L NE 1 ATOM 3473 C CZ . ARG C 3 24 ? 50.299 89.676 26.826 1.00 83.98 ? 24 ARG L CZ 1 ATOM 3474 N NH1 . ARG C 3 24 ? 50.107 89.149 25.624 1.00 83.74 ? 24 ARG L NH1 1 ATOM 3475 N NH2 . ARG C 3 24 ? 51.414 90.350 27.081 1.00 88.22 ? 24 ARG L NH2 1 ATOM 3476 N N . ALA C 3 25 ? 43.789 86.858 31.059 1.00 44.95 ? 25 ALA L N 1 ATOM 3477 C CA . ALA C 3 25 ? 42.383 86.541 31.262 1.00 40.33 ? 25 ALA L CA 1 ATOM 3478 C C . ALA C 3 25 ? 41.489 87.525 30.524 1.00 45.96 ? 25 ALA L C 1 ATOM 3479 O O . ALA C 3 25 ? 41.839 88.693 30.363 1.00 44.98 ? 25 ALA L O 1 ATOM 3480 C CB . ALA C 3 25 ? 42.052 86.536 32.740 1.00 37.37 ? 25 ALA L CB 1 ATOM 3481 N N . SER C 3 26 ? 40.328 87.050 30.085 1.00 47.48 ? 26 SER L N 1 ATOM 3482 C CA . SER C 3 26 ? 39.385 87.889 29.356 1.00 48.64 ? 26 SER L CA 1 ATOM 3483 C C . SER C 3 26 ? 38.739 88.919 30.280 1.00 53.48 ? 26 SER L C 1 ATOM 3484 O O . SER C 3 26 ? 38.106 89.868 29.819 1.00 55.25 ? 26 SER L O 1 ATOM 3485 C CB . SER C 3 26 ? 38.313 87.028 28.683 1.00 48.31 ? 26 SER L CB 1 ATOM 3486 O OG . SER C 3 26 ? 37.596 86.260 29.632 1.00 48.76 ? 26 SER L OG 1 ATOM 3487 N N . GLN C 3 27 ? 38.901 88.725 31.586 1.00 52.92 ? 27 GLN L N 1 ATOM 3488 C CA . GLN C 3 27 ? 38.418 89.687 32.569 1.00 55.00 ? 27 GLN L CA 1 ATOM 3489 C C . GLN C 3 27 ? 39.198 89.569 33.871 1.00 52.99 ? 27 GLN L C 1 ATOM 3490 O O . GLN C 3 27 ? 39.906 88.588 34.090 1.00 53.79 ? 27 GLN L O 1 ATOM 3491 C CB . GLN C 3 27 ? 36.923 89.495 32.824 1.00 62.46 ? 27 GLN L CB 1 ATOM 3492 C CG . GLN C 3 27 ? 36.544 88.133 33.366 1.00 62.63 ? 27 GLN L CG 1 ATOM 3493 C CD . GLN C 3 27 ? 35.048 87.899 33.323 1.00 71.30 ? 27 GLN L CD 1 ATOM 3494 O OE1 . GLN C 3 27 ? 34.453 87.824 32.248 1.00 77.82 ? 27 GLN L OE1 1 ATOM 3495 N NE2 . GLN C 3 27 ? 34.430 87.793 34.494 1.00 71.15 ? 27 GLN L NE2 1 ATOM 3496 N N . GLY C 3 28 ? 39.066 90.576 34.728 1.00 51.33 ? 28 GLY L N 1 ATOM 3497 C CA . GLY C 3 28 ? 39.801 90.630 35.979 1.00 44.23 ? 28 GLY L CA 1 ATOM 3498 C C . GLY C 3 28 ? 39.542 89.440 36.881 1.00 44.36 ? 28 GLY L C 1 ATOM 3499 O O . GLY C 3 28 ? 38.397 89.050 37.100 1.00 46.88 ? 28 GLY L O 1 ATOM 3500 N N . ILE C 3 29 ? 40.615 88.855 37.402 1.00 42.88 ? 29 ILE L N 1 ATOM 3501 C CA . ILE C 3 29 ? 40.497 87.703 38.286 1.00 41.02 ? 29 ILE L CA 1 ATOM 3502 C C . ILE C 3 29 ? 41.369 87.870 39.519 1.00 45.99 ? 29 ILE L C 1 ATOM 3503 O O . ILE C 3 29 ? 41.717 86.886 40.180 1.00 47.98 ? 29 ILE L O 1 ATOM 3504 C CB . ILE C 3 29 ? 40.881 86.393 37.574 1.00 40.99 ? 29 ILE L CB 1 ATOM 3505 C CG1 . ILE C 3 29 ? 42.290 86.499 36.981 1.00 38.37 ? 29 ILE L CG1 1 ATOM 3506 C CG2 . ILE C 3 29 ? 39.862 86.054 36.496 1.00 40.39 ? 29 ILE L CG2 1 ATOM 3507 C CD1 . ILE C 3 29 ? 42.738 85.257 36.249 1.00 34.64 ? 29 ILE L CD1 1 ATOM 3508 N N . ARG C 3 30 ? 41.721 89.120 39.817 1.00 47.61 ? 30 ARG L N 1 ATOM 3509 C CA . ARG C 3 30 ? 42.514 89.453 41.000 1.00 49.55 ? 30 ARG L CA 1 ATOM 3510 C C . ARG C 3 30 ? 43.833 88.682 41.011 1.00 47.39 ? 30 ARG L C 1 ATOM 3511 O O . ARG C 3 30 ? 44.667 88.858 40.124 1.00 48.62 ? 30 ARG L O 1 ATOM 3512 C CB . ARG C 3 30 ? 41.709 89.175 42.274 1.00 54.43 ? 30 ARG L CB 1 ATOM 3513 C CG . ARG C 3 30 ? 40.333 89.841 42.274 1.00 62.90 ? 30 ARG L CG 1 ATOM 3514 C CD . ARG C 3 30 ? 39.528 89.490 43.516 1.00 70.62 ? 30 ARG L CD 1 ATOM 3515 N NE . ARG C 3 30 ? 40.167 89.975 44.736 1.00 78.44 ? 30 ARG L NE 1 ATOM 3516 C CZ . ARG C 3 30 ? 39.926 91.160 45.287 1.00 86.72 ? 30 ARG L CZ 1 ATOM 3517 N NH1 . ARG C 3 30 ? 39.055 91.990 44.729 1.00 90.76 ? 30 ARG L NH1 1 ATOM 3518 N NH2 . ARG C 3 30 ? 40.556 91.515 46.399 1.00 90.63 ? 30 ARG L NH2 1 ATOM 3519 N N . ASN C 3 31 ? 44.018 87.827 42.010 1.00 49.34 ? 31 ASN L N 1 ATOM 3520 C CA . ASN C 3 31 ? 45.202 86.975 42.071 1.00 48.27 ? 31 ASN L CA 1 ATOM 3521 C C . ASN C 3 31 ? 44.844 85.496 42.030 1.00 42.96 ? 31 ASN L C 1 ATOM 3522 O O . ASN C 3 31 ? 45.606 84.655 42.499 1.00 43.14 ? 31 ASN L O 1 ATOM 3523 C CB . ASN C 3 31 ? 46.014 87.270 43.332 1.00 55.94 ? 31 ASN L CB 1 ATOM 3524 C CG . ASN C 3 31 ? 46.742 88.596 43.261 1.00 67.71 ? 31 ASN L CG 1 ATOM 3525 O OD1 . ASN C 3 31 ? 47.232 88.994 42.202 1.00 71.99 ? 31 ASN L OD1 1 ATOM 3526 N ND2 . ASN C 3 31 ? 46.819 89.290 44.391 1.00 70.48 ? 31 ASN L ND2 1 ATOM 3527 N N . ASP C 3 32 ? 43.681 85.184 41.469 1.00 40.98 ? 32 ASP L N 1 ATOM 3528 C CA . ASP C 3 32 ? 43.194 83.810 41.447 1.00 41.08 ? 32 ASP L CA 1 ATOM 3529 C C . ASP C 3 32 ? 43.717 83.051 40.235 1.00 40.98 ? 32 ASP L C 1 ATOM 3530 O O . ASP C 3 32 ? 42.939 82.601 39.396 1.00 40.57 ? 32 ASP L O 1 ATOM 3531 C CB . ASP C 3 32 ? 41.665 83.785 41.463 1.00 37.99 ? 32 ASP L CB 1 ATOM 3532 C CG . ASP C 3 32 ? 41.085 84.450 42.697 1.00 45.75 ? 32 ASP L CG 1 ATOM 3533 O OD1 . ASP C 3 32 ? 40.126 85.236 42.552 1.00 54.48 ? 32 ASP L OD1 1 ATOM 3534 O OD2 . ASP C 3 32 ? 41.586 84.189 43.811 1.00 47.36 ? 32 ASP L OD2 1 ATOM 3535 N N . LEU C 3 33 ? 45.037 82.911 40.147 1.00 41.58 ? 33 LEU L N 1 ATOM 3536 C CA . LEU C 3 33 ? 45.647 82.164 39.054 1.00 35.38 ? 33 LEU L CA 1 ATOM 3537 C C . LEU C 3 33 ? 46.602 81.096 39.571 1.00 35.78 ? 33 LEU L C 1 ATOM 3538 O O . LEU C 3 33 ? 47.335 81.317 40.532 1.00 38.22 ? 33 LEU L O 1 ATOM 3539 C CB . LEU C 3 33 ? 46.391 83.099 38.102 1.00 38.11 ? 33 LEU L CB 1 ATOM 3540 C CG . LEU C 3 33 ? 46.813 82.432 36.790 1.00 39.92 ? 33 LEU L CG 1 ATOM 3541 C CD1 . LEU C 3 33 ? 45.746 82.636 35.726 1.00 46.13 ? 33 LEU L CD1 1 ATOM 3542 C CD2 . LEU C 3 33 ? 48.164 82.927 36.321 1.00 38.59 ? 33 LEU L CD2 1 ATOM 3543 N N . GLY C 3 34 ? 46.591 79.940 38.918 1.00 32.78 ? 34 GLY L N 1 ATOM 3544 C CA . GLY C 3 34 ? 47.489 78.855 39.260 1.00 30.78 ? 34 GLY L CA 1 ATOM 3545 C C . GLY C 3 34 ? 48.349 78.447 38.081 1.00 33.03 ? 34 GLY L C 1 ATOM 3546 O O . GLY C 3 34 ? 47.927 78.542 36.932 1.00 31.15 ? 34 GLY L O 1 ATOM 3547 N N . TRP C 3 35 ? 49.567 78.001 38.369 1.00 34.56 ? 35 TRP L N 1 ATOM 3548 C CA . TRP C 3 35 ? 50.462 77.491 37.334 1.00 35.48 ? 35 TRP L CA 1 ATOM 3549 C C . TRP C 3 35 ? 50.773 76.019 37.575 1.00 33.00 ? 35 TRP L C 1 ATOM 3550 O O . TRP C 3 35 ? 51.065 75.610 38.699 1.00 33.47 ? 35 TRP L O 1 ATOM 3551 C CB . TRP C 3 35 ? 51.765 78.296 37.286 1.00 31.10 ? 35 TRP L CB 1 ATOM 3552 C CG . TRP C 3 35 ? 51.620 79.700 36.775 1.00 31.91 ? 35 TRP L CG 1 ATOM 3553 C CD1 . TRP C 3 35 ? 51.535 80.840 37.520 1.00 33.56 ? 35 TRP L CD1 1 ATOM 3554 C CD2 . TRP C 3 35 ? 51.575 80.114 35.404 1.00 29.90 ? 35 TRP L CD2 1 ATOM 3555 N NE1 . TRP C 3 35 ? 51.433 81.936 36.700 1.00 31.84 ? 35 TRP L NE1 1 ATOM 3556 C CE2 . TRP C 3 35 ? 51.454 81.518 35.396 1.00 29.79 ? 35 TRP L CE2 1 ATOM 3557 C CE3 . TRP C 3 35 ? 51.623 79.433 34.183 1.00 30.46 ? 35 TRP L CE3 1 ATOM 3558 C CZ2 . TRP C 3 35 ? 51.379 82.255 34.214 1.00 32.35 ? 35 TRP L CZ2 1 ATOM 3559 C CZ3 . TRP C 3 35 ? 51.547 80.167 33.009 1.00 34.55 ? 35 TRP L CZ3 1 ATOM 3560 C CH2 . TRP C 3 35 ? 51.426 81.564 33.034 1.00 32.23 ? 35 TRP L CH2 1 ATOM 3561 N N . TYR C 3 36 ? 50.718 75.230 36.510 1.00 32.45 ? 36 TYR L N 1 ATOM 3562 C CA . TYR C 3 36 ? 50.986 73.801 36.603 1.00 30.92 ? 36 TYR L CA 1 ATOM 3563 C C . TYR C 3 36 ? 52.075 73.354 35.639 1.00 30.97 ? 36 TYR L C 1 ATOM 3564 O O . TYR C 3 36 ? 52.301 73.974 34.602 1.00 31.27 ? 36 TYR L O 1 ATOM 3565 C CB . TYR C 3 36 ? 49.713 72.998 36.338 1.00 30.06 ? 36 TYR L CB 1 ATOM 3566 C CG . TYR C 3 36 ? 48.627 73.226 37.357 1.00 34.55 ? 36 TYR L CG 1 ATOM 3567 C CD1 . TYR C 3 36 ? 47.744 74.291 37.230 1.00 36.24 ? 36 TYR L CD1 1 ATOM 3568 C CD2 . TYR C 3 36 ? 48.481 72.377 38.445 1.00 35.34 ? 36 TYR L CD2 1 ATOM 3569 C CE1 . TYR C 3 36 ? 46.747 74.503 38.162 1.00 33.34 ? 36 TYR L CE1 1 ATOM 3570 C CE2 . TYR C 3 36 ? 47.486 72.581 39.380 1.00 30.71 ? 36 TYR L CE2 1 ATOM 3571 C CZ . TYR C 3 36 ? 46.623 73.645 39.232 1.00 28.65 ? 36 TYR L CZ 1 ATOM 3572 O OH . TYR C 3 36 ? 45.631 73.856 40.162 1.00 34.20 ? 36 TYR L OH 1 ATOM 3573 N N . GLN C 3 37 ? 52.741 72.263 35.997 1.00 33.63 ? 37 GLN L N 1 ATOM 3574 C CA . GLN C 3 37 ? 53.731 71.630 35.138 1.00 29.67 ? 37 GLN L CA 1 ATOM 3575 C C . GLN C 3 37 ? 53.298 70.198 34.874 1.00 27.73 ? 37 GLN L C 1 ATOM 3576 O O . GLN C 3 37 ? 52.806 69.524 35.772 1.00 29.26 ? 37 GLN L O 1 ATOM 3577 C CB . GLN C 3 37 ? 55.117 71.669 35.790 1.00 28.16 ? 37 GLN L CB 1 ATOM 3578 C CG . GLN C 3 37 ? 56.221 71.029 34.971 1.00 29.54 ? 37 GLN L CG 1 ATOM 3579 C CD . GLN C 3 37 ? 57.482 70.812 35.782 1.00 41.82 ? 37 GLN L CD 1 ATOM 3580 O OE1 . GLN C 3 37 ? 57.498 70.016 36.723 1.00 31.71 ? 37 GLN L OE1 1 ATOM 3581 N NE2 . GLN C 3 37 ? 58.547 71.529 35.429 1.00 39.76 ? 37 GLN L NE2 1 ATOM 3582 N N . GLN C 3 38 ? 53.468 69.734 33.642 1.00 37.27 ? 38 GLN L N 1 ATOM 3583 C CA . GLN C 3 38 ? 53.104 68.360 33.314 1.00 36.15 ? 38 GLN L CA 1 ATOM 3584 C C . GLN C 3 38 ? 54.110 67.690 32.385 1.00 35.25 ? 38 GLN L C 1 ATOM 3585 O O . GLN C 3 38 ? 54.428 68.205 31.317 1.00 37.73 ? 38 GLN L O 1 ATOM 3586 C CB . GLN C 3 38 ? 51.706 68.309 32.688 1.00 34.62 ? 38 GLN L CB 1 ATOM 3587 C CG . GLN C 3 38 ? 51.192 66.902 32.462 1.00 33.07 ? 38 GLN L CG 1 ATOM 3588 C CD . GLN C 3 38 ? 49.922 66.872 31.643 1.00 35.94 ? 38 GLN L CD 1 ATOM 3589 O OE1 . GLN C 3 38 ? 49.627 67.812 30.910 1.00 38.79 ? 38 GLN L OE1 1 ATOM 3590 N NE2 . GLN C 3 38 ? 49.158 65.793 31.767 1.00 36.89 ? 38 GLN L NE2 1 ATOM 3591 N N . LYS C 3 39 ? 54.604 66.534 32.815 1.00 34.40 ? 39 LYS L N 1 ATOM 3592 C CA . LYS C 3 39 ? 55.475 65.697 32.000 1.00 36.84 ? 39 LYS L CA 1 ATOM 3593 C C . LYS C 3 39 ? 54.638 64.673 31.242 1.00 39.55 ? 39 LYS L C 1 ATOM 3594 O O . LYS C 3 39 ? 53.579 64.269 31.718 1.00 43.68 ? 39 LYS L O 1 ATOM 3595 C CB . LYS C 3 39 ? 56.509 64.974 32.867 1.00 38.24 ? 39 LYS L CB 1 ATOM 3596 C CG . LYS C 3 39 ? 57.314 65.867 33.791 1.00 40.69 ? 39 LYS L CG 1 ATOM 3597 C CD . LYS C 3 39 ? 58.465 66.522 33.065 1.00 41.53 ? 39 LYS L CD 1 ATOM 3598 C CE . LYS C 3 39 ? 59.649 66.694 33.996 1.00 43.99 ? 39 LYS L CE 1 ATOM 3599 N NZ . LYS C 3 39 ? 59.236 67.375 35.250 1.00 47.38 ? 39 LYS L NZ 1 ATOM 3600 N N . PRO C 3 40 ? 55.119 64.238 30.066 1.00 42.44 ? 40 PRO L N 1 ATOM 3601 C CA . PRO C 3 40 ? 54.410 63.225 29.278 1.00 41.69 ? 40 PRO L CA 1 ATOM 3602 C C . PRO C 3 40 ? 54.122 61.954 30.073 1.00 41.42 ? 40 PRO L C 1 ATOM 3603 O O . PRO C 3 40 ? 55.038 61.356 30.636 1.00 42.88 ? 40 PRO L O 1 ATOM 3604 C CB . PRO C 3 40 ? 55.381 62.938 28.128 1.00 40.13 ? 40 PRO L CB 1 ATOM 3605 C CG . PRO C 3 40 ? 56.168 64.187 27.987 1.00 37.48 ? 40 PRO L CG 1 ATOM 3606 C CD . PRO C 3 40 ? 56.337 64.709 29.383 1.00 40.29 ? 40 PRO L CD 1 ATOM 3607 N N . GLY C 3 41 ? 52.854 61.561 30.124 1.00 36.91 ? 41 GLY L N 1 ATOM 3608 C CA . GLY C 3 41 ? 52.464 60.334 30.794 1.00 35.66 ? 41 GLY L CA 1 ATOM 3609 C C . GLY C 3 41 ? 52.298 60.453 32.296 1.00 41.38 ? 41 GLY L C 1 ATOM 3610 O O . GLY C 3 41 ? 52.163 59.444 32.988 1.00 51.21 ? 41 GLY L O 1 ATOM 3611 N N . LYS C 3 42 ? 52.309 61.678 32.812 1.00 36.46 ? 42 LYS L N 1 ATOM 3612 C CA . LYS C 3 42 ? 52.123 61.887 34.245 1.00 36.39 ? 42 LYS L CA 1 ATOM 3613 C C . LYS C 3 42 ? 51.061 62.939 34.544 1.00 32.73 ? 42 LYS L C 1 ATOM 3614 O O . LYS C 3 42 ? 50.677 63.720 33.673 1.00 32.78 ? 42 LYS L O 1 ATOM 3615 C CB . LYS C 3 42 ? 53.444 62.286 34.906 1.00 42.39 ? 42 LYS L CB 1 ATOM 3616 C CG . LYS C 3 42 ? 54.457 61.160 34.990 1.00 52.75 ? 42 LYS L CG 1 ATOM 3617 C CD . LYS C 3 42 ? 55.646 61.560 35.844 1.00 60.87 ? 42 LYS L CD 1 ATOM 3618 C CE . LYS C 3 42 ? 56.563 60.376 36.102 1.00 73.52 ? 42 LYS L CE 1 ATOM 3619 N NZ . LYS C 3 42 ? 55.854 59.273 36.811 1.00 80.87 ? 42 LYS L NZ 1 ATOM 3620 N N . ALA C 3 43 ? 50.589 62.946 35.784 1.00 29.65 ? 43 ALA L N 1 ATOM 3621 C CA . ALA C 3 43 ? 49.602 63.920 36.223 1.00 32.66 ? 43 ALA L CA 1 ATOM 3622 C C . ALA C 3 43 ? 50.233 65.298 36.371 1.00 33.04 ? 43 ALA L C 1 ATOM 3623 O O . ALA C 3 43 ? 51.407 65.406 36.711 1.00 38.87 ? 43 ALA L O 1 ATOM 3624 C CB . ALA C 3 43 ? 48.977 63.480 37.536 1.00 32.56 ? 43 ALA L CB 1 ATOM 3625 N N . PRO C 3 44 ? 49.451 66.357 36.116 1.00 34.91 ? 44 PRO L N 1 ATOM 3626 C CA . PRO C 3 44 ? 49.931 67.727 36.319 1.00 35.47 ? 44 PRO L CA 1 ATOM 3627 C C . PRO C 3 44 ? 50.411 67.963 37.748 1.00 36.72 ? 44 PRO L C 1 ATOM 3628 O O . PRO C 3 44 ? 49.989 67.261 38.670 1.00 39.28 ? 44 PRO L O 1 ATOM 3629 C CB . PRO C 3 44 ? 48.697 68.583 36.012 1.00 34.77 ? 44 PRO L CB 1 ATOM 3630 C CG . PRO C 3 44 ? 47.863 67.735 35.112 1.00 30.13 ? 44 PRO L CG 1 ATOM 3631 C CD . PRO C 3 44 ? 48.080 66.325 35.574 1.00 33.86 ? 44 PRO L CD 1 ATOM 3632 N N . LYS C 3 45 ? 51.293 68.941 37.921 1.00 37.82 ? 45 LYS L N 1 ATOM 3633 C CA . LYS C 3 45 ? 51.843 69.261 39.232 1.00 35.73 ? 45 LYS L CA 1 ATOM 3634 C C . LYS C 3 45 ? 51.668 70.743 39.528 1.00 37.64 ? 45 LYS L C 1 ATOM 3635 O O . LYS C 3 45 ? 51.960 71.587 38.676 1.00 36.30 ? 45 LYS L O 1 ATOM 3636 C CB . LYS C 3 45 ? 53.318 68.875 39.297 1.00 35.18 ? 45 LYS L CB 1 ATOM 3637 C CG . LYS C 3 45 ? 54.040 69.323 40.553 1.00 42.08 ? 45 LYS L CG 1 ATOM 3638 C CD . LYS C 3 45 ? 55.498 68.870 40.521 1.00 43.81 ? 45 LYS L CD 1 ATOM 3639 C CE . LYS C 3 45 ? 56.234 69.240 41.801 1.00 45.43 ? 45 LYS L CE 1 ATOM 3640 N NZ . LYS C 3 45 ? 57.619 68.683 41.836 1.00 47.78 ? 45 LYS L NZ 1 ATOM 3641 N N . LEU C 3 46 ? 51.184 71.060 40.726 1.00 38.65 ? 46 LEU L N 1 ATOM 3642 C CA . LEU C 3 46 ? 51.003 72.452 41.131 1.00 38.24 ? 46 LEU L CA 1 ATOM 3643 C C . LEU C 3 46 ? 52.352 73.117 41.400 1.00 37.39 ? 46 LEU L C 1 ATOM 3644 O O . LEU C 3 46 ? 53.143 72.634 42.209 1.00 26.69 ? 46 LEU L O 1 ATOM 3645 C CB . LEU C 3 46 ? 50.110 72.547 42.373 1.00 33.24 ? 46 LEU L CB 1 ATOM 3646 C CG . LEU C 3 46 ? 49.844 73.960 42.906 1.00 30.94 ? 46 LEU L CG 1 ATOM 3647 C CD1 . LEU C 3 46 ? 49.198 74.829 41.839 1.00 25.91 ? 46 LEU L CD1 1 ATOM 3648 C CD2 . LEU C 3 46 ? 48.983 73.936 44.165 1.00 29.84 ? 46 LEU L CD2 1 ATOM 3649 N N . LEU C 3 47 ? 52.608 74.223 40.710 1.00 33.16 ? 47 LEU L N 1 ATOM 3650 C CA . LEU C 3 47 ? 53.838 74.982 40.899 1.00 32.15 ? 47 LEU L CA 1 ATOM 3651 C C . LEU C 3 47 ? 53.579 76.213 41.755 1.00 34.88 ? 47 LEU L C 1 ATOM 3652 O O . LEU C 3 47 ? 54.280 76.466 42.741 1.00 33.79 ? 47 LEU L O 1 ATOM 3653 C CB . LEU C 3 47 ? 54.426 75.419 39.555 1.00 30.37 ? 47 LEU L CB 1 ATOM 3654 C CG . LEU C 3 47 ? 54.910 74.372 38.555 1.00 34.04 ? 47 LEU L CG 1 ATOM 3655 C CD1 . LEU C 3 47 ? 55.330 75.053 37.263 1.00 38.75 ? 47 LEU L CD1 1 ATOM 3656 C CD2 . LEU C 3 47 ? 56.060 73.555 39.125 1.00 25.67 ? 47 LEU L CD2 1 ATOM 3657 N N . ILE C 3 48 ? 52.566 76.979 41.358 1.00 31.78 ? 48 ILE L N 1 ATOM 3658 C CA . ILE C 3 48 ? 52.279 78.267 41.970 1.00 29.57 ? 48 ILE L CA 1 ATOM 3659 C C . ILE C 3 48 ? 50.774 78.497 42.092 1.00 35.44 ? 48 ILE L C 1 ATOM 3660 O O . ILE C 3 48 ? 50.031 78.337 41.123 1.00 42.23 ? 48 ILE L O 1 ATOM 3661 C CB . ILE C 3 48 ? 52.913 79.420 41.154 1.00 31.65 ? 48 ILE L CB 1 ATOM 3662 C CG1 . ILE C 3 48 ? 54.444 79.368 41.248 1.00 35.66 ? 48 ILE L CG1 1 ATOM 3663 C CG2 . ILE C 3 48 ? 52.386 80.776 41.616 1.00 30.90 ? 48 ILE L CG2 1 ATOM 3664 C CD1 . ILE C 3 48 ? 55.151 80.358 40.355 1.00 36.13 ? 48 ILE L CD1 1 ATOM 3665 N N . TYR C 3 49 ? 50.330 78.866 43.288 1.00 36.80 ? 49 TYR L N 1 ATOM 3666 C CA . TYR C 3 49 ? 48.943 79.264 43.505 1.00 34.26 ? 49 TYR L CA 1 ATOM 3667 C C . TYR C 3 49 ? 48.896 80.730 43.911 1.00 38.59 ? 49 TYR L C 1 ATOM 3668 O O . TYR C 3 49 ? 49.926 81.311 44.259 1.00 38.22 ? 49 TYR L O 1 ATOM 3669 C CB . TYR C 3 49 ? 48.277 78.390 44.571 1.00 32.39 ? 49 TYR L CB 1 ATOM 3670 C CG . TYR C 3 49 ? 48.926 78.465 45.935 1.00 38.82 ? 49 TYR L CG 1 ATOM 3671 C CD1 . TYR C 3 49 ? 50.057 77.713 46.230 1.00 38.55 ? 49 TYR L CD1 1 ATOM 3672 C CD2 . TYR C 3 49 ? 48.402 79.276 46.933 1.00 40.03 ? 49 TYR L CD2 1 ATOM 3673 C CE1 . TYR C 3 49 ? 50.651 77.775 47.477 1.00 39.33 ? 49 TYR L CE1 1 ATOM 3674 C CE2 . TYR C 3 49 ? 48.990 79.343 48.182 1.00 37.59 ? 49 TYR L CE2 1 ATOM 3675 C CZ . TYR C 3 49 ? 50.114 78.590 48.448 1.00 43.19 ? 49 TYR L CZ 1 ATOM 3676 O OH . TYR C 3 49 ? 50.705 78.652 49.690 1.00 52.97 ? 49 TYR L OH 1 ATOM 3677 N N . ALA C 3 50 ? 47.704 81.321 43.860 1.00 39.41 ? 50 ALA L N 1 ATOM 3678 C CA . ALA C 3 50 ? 47.508 82.727 44.212 1.00 38.27 ? 50 ALA L CA 1 ATOM 3679 C C . ALA C 3 50 ? 48.453 83.645 43.435 1.00 37.88 ? 50 ALA L C 1 ATOM 3680 O O . ALA C 3 50 ? 48.988 84.605 43.988 1.00 42.44 ? 50 ALA L O 1 ATOM 3681 C CB . ALA C 3 50 ? 47.685 82.931 45.712 1.00 37.38 ? 50 ALA L CB 1 ATOM 3682 N N . ALA C 3 51 ? 48.658 83.312 42.161 1.00 39.01 ? 51 ALA L N 1 ATOM 3683 C CA . ALA C 3 51 ? 49.463 84.087 41.210 1.00 38.20 ? 51 ALA L CA 1 ATOM 3684 C C . ALA C 3 51 ? 50.971 84.088 41.496 1.00 36.98 ? 51 ALA L C 1 ATOM 3685 O O . ALA C 3 51 ? 51.772 84.015 40.566 1.00 34.52 ? 51 ALA L O 1 ATOM 3686 C CB . ALA C 3 51 ? 48.947 85.526 41.128 1.00 36.42 ? 51 ALA L CB 1 ATOM 3687 N N . SER C 3 52 ? 51.362 84.169 42.766 1.00 39.13 ? 52 SER L N 1 ATOM 3688 C CA . SER C 3 52 ? 52.778 84.323 43.101 1.00 40.06 ? 52 SER L CA 1 ATOM 3689 C C . SER C 3 52 ? 53.289 83.353 44.163 1.00 41.83 ? 52 SER L C 1 ATOM 3690 O O . SER C 3 52 ? 54.497 83.200 44.331 1.00 47.03 ? 52 SER L O 1 ATOM 3691 C CB . SER C 3 52 ? 53.052 85.756 43.567 1.00 39.99 ? 52 SER L CB 1 ATOM 3692 O OG . SER C 3 52 ? 52.306 86.066 44.734 1.00 39.18 ? 52 SER L OG 1 ATOM 3693 N N . SER C 3 53 ? 52.381 82.708 44.885 1.00 45.35 ? 53 SER L N 1 ATOM 3694 C CA . SER C 3 53 ? 52.790 81.842 45.987 1.00 44.21 ? 53 SER L CA 1 ATOM 3695 C C . SER C 3 53 ? 53.334 80.516 45.475 1.00 45.33 ? 53 SER L C 1 ATOM 3696 O O . SER C 3 53 ? 52.658 79.791 44.751 1.00 46.13 ? 53 SER L O 1 ATOM 3697 C CB . SER C 3 53 ? 51.625 81.600 46.948 1.00 46.98 ? 53 SER L CB 1 ATOM 3698 O OG . SER C 3 53 ? 51.226 82.808 47.574 1.00 52.34 ? 53 SER L OG 1 ATOM 3699 N N . LEU C 3 54 ? 54.567 80.209 45.857 1.00 44.01 ? 54 LEU L N 1 ATOM 3700 C CA . LEU C 3 54 ? 55.216 78.973 45.442 1.00 38.72 ? 54 LEU L CA 1 ATOM 3701 C C . LEU C 3 54 ? 54.696 77.800 46.270 1.00 41.65 ? 54 LEU L C 1 ATOM 3702 O O . LEU C 3 54 ? 54.564 77.895 47.494 1.00 38.40 ? 54 LEU L O 1 ATOM 3703 C CB . LEU C 3 54 ? 56.735 79.103 45.585 1.00 37.33 ? 54 LEU L CB 1 ATOM 3704 C CG . LEU C 3 54 ? 57.720 78.284 44.751 1.00 44.83 ? 54 LEU L CG 1 ATOM 3705 C CD1 . LEU C 3 54 ? 57.399 78.349 43.267 1.00 47.86 ? 54 LEU L CD1 1 ATOM 3706 C CD2 . LEU C 3 54 ? 59.128 78.797 45.013 1.00 43.75 ? 54 LEU L CD2 1 ATOM 3707 N N . GLN C 3 55 ? 54.384 76.701 45.593 1.00 43.72 ? 55 GLN L N 1 ATOM 3708 C CA . GLN C 3 55 ? 53.992 75.471 46.269 1.00 41.91 ? 55 GLN L CA 1 ATOM 3709 C C . GLN C 3 55 ? 55.184 74.883 47.019 1.00 42.87 ? 55 GLN L C 1 ATOM 3710 O O . GLN C 3 55 ? 56.321 74.953 46.550 1.00 44.13 ? 55 GLN L O 1 ATOM 3711 C CB . GLN C 3 55 ? 53.430 74.462 45.261 1.00 42.22 ? 55 GLN L CB 1 ATOM 3712 C CG . GLN C 3 55 ? 53.214 73.052 45.805 1.00 47.71 ? 55 GLN L CG 1 ATOM 3713 C CD . GLN C 3 55 ? 52.123 72.973 46.861 1.00 49.32 ? 55 GLN L CD 1 ATOM 3714 O OE1 . GLN C 3 55 ? 51.418 73.946 47.122 1.00 52.81 ? 55 GLN L OE1 1 ATOM 3715 N NE2 . GLN C 3 55 ? 51.979 71.804 47.471 1.00 48.14 ? 55 GLN L NE2 1 ATOM 3716 N N . SER C 3 56 ? 54.911 74.321 48.192 1.00 42.87 ? 56 SER L N 1 ATOM 3717 C CA . SER C 3 56 ? 55.935 73.719 49.038 1.00 45.92 ? 56 SER L CA 1 ATOM 3718 C C . SER C 3 56 ? 56.754 72.669 48.283 1.00 45.39 ? 56 SER L C 1 ATOM 3719 O O . SER C 3 56 ? 56.203 71.696 47.767 1.00 45.55 ? 56 SER L O 1 ATOM 3720 C CB . SER C 3 56 ? 55.285 73.096 50.276 1.00 50.17 ? 56 SER L CB 1 ATOM 3721 O OG . SER C 3 56 ? 56.255 72.543 51.149 1.00 62.21 ? 56 SER L OG 1 ATOM 3722 N N . GLY C 3 57 ? 58.066 72.880 48.209 1.00 43.18 ? 57 GLY L N 1 ATOM 3723 C CA . GLY C 3 57 ? 58.955 71.948 47.535 1.00 43.16 ? 57 GLY L CA 1 ATOM 3724 C C . GLY C 3 57 ? 59.419 72.393 46.159 1.00 43.46 ? 57 GLY L C 1 ATOM 3725 O O . GLY C 3 57 ? 60.505 72.023 45.715 1.00 50.44 ? 57 GLY L O 1 ATOM 3726 N N . VAL C 3 58 ? 58.594 73.181 45.479 1.00 39.98 ? 58 VAL L N 1 ATOM 3727 C CA . VAL C 3 58 ? 58.923 73.685 44.147 1.00 37.99 ? 58 VAL L CA 1 ATOM 3728 C C . VAL C 3 58 ? 60.081 74.678 44.217 1.00 40.84 ? 58 VAL L C 1 ATOM 3729 O O . VAL C 3 58 ? 60.037 75.626 45.003 1.00 42.77 ? 58 VAL L O 1 ATOM 3730 C CB . VAL C 3 58 ? 57.698 74.357 43.488 1.00 36.63 ? 58 VAL L CB 1 ATOM 3731 C CG1 . VAL C 3 58 ? 58.038 74.844 42.087 1.00 31.87 ? 58 VAL L CG1 1 ATOM 3732 C CG2 . VAL C 3 58 ? 56.519 73.394 43.451 1.00 34.40 ? 58 VAL L CG2 1 ATOM 3733 N N . PRO C 3 59 ? 61.127 74.455 43.402 1.00 41.43 ? 59 PRO L N 1 ATOM 3734 C CA . PRO C 3 59 ? 62.338 75.289 43.400 1.00 40.51 ? 59 PRO L CA 1 ATOM 3735 C C . PRO C 3 59 ? 62.042 76.777 43.232 1.00 37.05 ? 59 PRO L C 1 ATOM 3736 O O . PRO C 3 59 ? 61.074 77.138 42.568 1.00 35.16 ? 59 PRO L O 1 ATOM 3737 C CB . PRO C 3 59 ? 63.124 74.756 42.199 1.00 38.58 ? 59 PRO L CB 1 ATOM 3738 C CG . PRO C 3 59 ? 62.692 73.342 42.078 1.00 39.96 ? 59 PRO L CG 1 ATOM 3739 C CD . PRO C 3 59 ? 61.235 73.337 42.448 1.00 42.94 ? 59 PRO L CD 1 ATOM 3740 N N . SER C 3 60 ? 62.878 77.626 43.822 1.00 35.70 ? 60 SER L N 1 ATOM 3741 C CA . SER C 3 60 ? 62.650 79.067 43.792 1.00 36.90 ? 60 SER L CA 1 ATOM 3742 C C . SER C 3 60 ? 62.973 79.690 42.435 1.00 40.36 ? 60 SER L C 1 ATOM 3743 O O . SER C 3 60 ? 62.860 80.903 42.261 1.00 43.82 ? 60 SER L O 1 ATOM 3744 C CB . SER C 3 60 ? 63.476 79.757 44.879 1.00 37.66 ? 60 SER L CB 1 ATOM 3745 O OG . SER C 3 60 ? 64.867 79.563 44.663 1.00 47.80 ? 60 SER L OG 1 ATOM 3746 N N . ARG C 3 61 ? 63.374 78.867 41.474 1.00 41.96 ? 61 ARG L N 1 ATOM 3747 C CA . ARG C 3 61 ? 63.706 79.372 40.146 1.00 41.15 ? 61 ARG L CA 1 ATOM 3748 C C . ARG C 3 61 ? 62.422 79.683 39.378 1.00 43.39 ? 61 ARG L C 1 ATOM 3749 O O . ARG C 3 61 ? 62.445 80.416 38.386 1.00 45.02 ? 61 ARG L O 1 ATOM 3750 C CB . ARG C 3 61 ? 64.578 78.369 39.383 1.00 36.89 ? 61 ARG L CB 1 ATOM 3751 C CG . ARG C 3 61 ? 63.820 77.188 38.804 1.00 43.81 ? 61 ARG L CG 1 ATOM 3752 C CD . ARG C 3 61 ? 64.776 76.183 38.183 1.00 42.79 ? 61 ARG L CD 1 ATOM 3753 N NE . ARG C 3 61 ? 65.393 75.329 39.193 1.00 52.25 ? 61 ARG L NE 1 ATOM 3754 C CZ . ARG C 3 61 ? 65.200 74.018 39.282 1.00 51.20 ? 61 ARG L CZ 1 ATOM 3755 N NH1 . ARG C 3 61 ? 64.417 73.402 38.410 1.00 35.73 ? 61 ARG L NH1 1 ATOM 3756 N NH2 . ARG C 3 61 ? 65.803 73.319 40.235 1.00 57.21 ? 61 ARG L NH2 1 ATOM 3757 N N . PHE C 3 62 ? 61.306 79.125 39.851 1.00 39.03 ? 62 PHE L N 1 ATOM 3758 C CA . PHE C 3 62 ? 59.985 79.437 39.312 1.00 31.94 ? 62 PHE L CA 1 ATOM 3759 C C . PHE C 3 62 ? 59.384 80.659 39.999 1.00 35.81 ? 62 PHE L C 1 ATOM 3760 O O . PHE C 3 62 ? 59.285 80.709 41.226 1.00 34.36 ? 62 PHE L O 1 ATOM 3761 C CB . PHE C 3 62 ? 59.044 78.243 39.472 1.00 36.65 ? 62 PHE L CB 1 ATOM 3762 C CG . PHE C 3 62 ? 59.421 77.058 38.634 1.00 33.51 ? 62 PHE L CG 1 ATOM 3763 C CD1 . PHE C 3 62 ? 58.935 76.925 37.347 1.00 32.82 ? 62 PHE L CD1 1 ATOM 3764 C CD2 . PHE C 3 62 ? 60.264 76.079 39.131 1.00 38.45 ? 62 PHE L CD2 1 ATOM 3765 C CE1 . PHE C 3 62 ? 59.285 75.836 36.570 1.00 36.50 ? 62 PHE L CE1 1 ATOM 3766 C CE2 . PHE C 3 62 ? 60.618 74.988 38.359 1.00 36.63 ? 62 PHE L CE2 1 ATOM 3767 C CZ . PHE C 3 62 ? 60.127 74.868 37.076 1.00 33.97 ? 62 PHE L CZ 1 ATOM 3768 N N . SER C 3 63 ? 58.969 81.641 39.206 1.00 41.70 ? 63 SER L N 1 ATOM 3769 C CA . SER C 3 63 ? 58.439 82.887 39.752 1.00 39.10 ? 63 SER L CA 1 ATOM 3770 C C . SER C 3 63 ? 57.191 83.350 39.009 1.00 37.46 ? 63 SER L C 1 ATOM 3771 O O . SER C 3 63 ? 57.224 83.597 37.804 1.00 37.87 ? 63 SER L O 1 ATOM 3772 C CB . SER C 3 63 ? 59.504 83.982 39.704 1.00 39.68 ? 63 SER L CB 1 ATOM 3773 O OG . SER C 3 63 ? 58.988 85.215 40.176 1.00 41.85 ? 63 SER L OG 1 ATOM 3774 N N . GLY C 3 64 ? 56.088 83.470 39.735 1.00 38.21 ? 64 GLY L N 1 ATOM 3775 C CA . GLY C 3 64 ? 54.855 83.962 39.152 1.00 38.31 ? 64 GLY L CA 1 ATOM 3776 C C . GLY C 3 64 ? 54.567 85.375 39.609 1.00 34.03 ? 64 GLY L C 1 ATOM 3777 O O . GLY C 3 64 ? 54.790 85.713 40.766 1.00 40.01 ? 64 GLY L O 1 ATOM 3778 N N . SER C 3 65 ? 54.079 86.208 38.698 1.00 35.44 ? 65 SER L N 1 ATOM 3779 C CA . SER C 3 65 ? 53.682 87.566 39.052 1.00 38.65 ? 65 SER L CA 1 ATOM 3780 C C . SER C 3 65 ? 52.442 87.987 38.277 1.00 40.52 ? 65 SER L C 1 ATOM 3781 O O . SER C 3 65 ? 51.952 87.248 37.422 1.00 39.46 ? 65 SER L O 1 ATOM 3782 C CB . SER C 3 65 ? 54.820 88.553 38.791 1.00 39.51 ? 65 SER L CB 1 ATOM 3783 O OG . SER C 3 65 ? 55.158 88.580 37.417 1.00 47.14 ? 65 SER L OG 1 ATOM 3784 N N . GLY C 3 66 ? 51.939 89.178 38.584 1.00 39.62 ? 66 GLY L N 1 ATOM 3785 C CA . GLY C 3 66 ? 50.799 89.723 37.876 1.00 41.89 ? 66 GLY L CA 1 ATOM 3786 C C . GLY C 3 66 ? 49.551 89.789 38.730 1.00 47.14 ? 66 GLY L C 1 ATOM 3787 O O . GLY C 3 66 ? 49.415 89.055 39.708 1.00 49.65 ? 66 GLY L O 1 ATOM 3788 N N . SER C 3 67 ? 48.632 90.671 38.351 1.00 50.36 ? 67 SER L N 1 ATOM 3789 C CA . SER C 3 67 ? 47.398 90.859 39.100 1.00 50.63 ? 67 SER L CA 1 ATOM 3790 C C . SER C 3 67 ? 46.307 91.473 38.230 1.00 55.05 ? 67 SER L C 1 ATOM 3791 O O . SER C 3 67 ? 46.505 92.522 37.616 1.00 60.82 ? 67 SER L O 1 ATOM 3792 C CB . SER C 3 67 ? 47.652 91.737 40.326 1.00 52.31 ? 67 SER L CB 1 ATOM 3793 O OG . SER C 3 67 ? 46.460 91.941 41.062 1.00 61.48 ? 67 SER L OG 1 ATOM 3794 N N . GLY C 3 68 ? 45.155 90.811 38.179 1.00 53.53 ? 68 GLY L N 1 ATOM 3795 C CA . GLY C 3 68 ? 44.028 91.305 37.409 1.00 54.69 ? 68 GLY L CA 1 ATOM 3796 C C . GLY C 3 68 ? 43.807 90.542 36.115 1.00 54.61 ? 68 GLY L C 1 ATOM 3797 O O . GLY C 3 68 ? 43.000 89.616 36.062 1.00 54.71 ? 68 GLY L O 1 ATOM 3798 N N . THR C 3 69 ? 44.530 90.933 35.070 1.00 56.95 ? 69 THR L N 1 ATOM 3799 C CA . THR C 3 69 ? 44.371 90.328 33.751 1.00 46.25 ? 69 THR L CA 1 ATOM 3800 C C . THR C 3 69 ? 45.656 89.671 33.256 1.00 52.82 ? 69 THR L C 1 ATOM 3801 O O . THR C 3 69 ? 45.641 88.537 32.774 1.00 42.48 ? 69 THR L O 1 ATOM 3802 C CB . THR C 3 69 ? 43.921 91.373 32.713 1.00 56.59 ? 69 THR L CB 1 ATOM 3803 O OG1 . THR C 3 69 ? 42.545 91.703 32.933 1.00 67.11 ? 69 THR L OG1 1 ATOM 3804 C CG2 . THR C 3 69 ? 44.080 90.835 31.297 1.00 56.27 ? 69 THR L CG2 1 ATOM 3805 N N . ASP C 3 70 ? 46.765 90.394 33.376 1.00 50.19 ? 70 ASP L N 1 ATOM 3806 C CA . ASP C 3 70 ? 48.036 89.936 32.835 1.00 46.48 ? 70 ASP L CA 1 ATOM 3807 C C . ASP C 3 70 ? 48.866 89.213 33.886 1.00 43.72 ? 70 ASP L C 1 ATOM 3808 O O . ASP C 3 70 ? 49.219 89.785 34.916 1.00 46.92 ? 70 ASP L O 1 ATOM 3809 C CB . ASP C 3 70 ? 48.831 91.112 32.266 1.00 51.74 ? 70 ASP L CB 1 ATOM 3810 C CG . ASP C 3 70 ? 48.039 91.915 31.254 1.00 60.03 ? 70 ASP L CG 1 ATOM 3811 O OD1 . ASP C 3 70 ? 48.174 93.157 31.245 1.00 70.38 ? 70 ASP L OD1 1 ATOM 3812 O OD2 . ASP C 3 70 ? 47.281 91.307 30.471 1.00 55.49 ? 70 ASP L OD2 1 ATOM 3813 N N . PHE C 3 71 ? 49.178 87.953 33.617 1.00 36.52 ? 71 PHE L N 1 ATOM 3814 C CA . PHE C 3 71 ? 50.005 87.169 34.520 1.00 34.87 ? 71 PHE L CA 1 ATOM 3815 C C . PHE C 3 71 ? 51.177 86.543 33.777 1.00 36.69 ? 71 PHE L C 1 ATOM 3816 O O . PHE C 3 71 ? 51.105 86.288 32.574 1.00 33.60 ? 71 PHE L O 1 ATOM 3817 C CB . PHE C 3 71 ? 49.176 86.086 35.204 1.00 39.35 ? 71 PHE L CB 1 ATOM 3818 C CG . PHE C 3 71 ? 48.035 86.622 36.015 1.00 40.87 ? 71 PHE L CG 1 ATOM 3819 C CD1 . PHE C 3 71 ? 48.216 86.976 37.341 1.00 39.48 ? 71 PHE L CD1 1 ATOM 3820 C CD2 . PHE C 3 71 ? 46.780 86.778 35.449 1.00 43.29 ? 71 PHE L CD2 1 ATOM 3821 C CE1 . PHE C 3 71 ? 47.165 87.474 38.087 1.00 41.23 ? 71 PHE L CE1 1 ATOM 3822 C CE2 . PHE C 3 71 ? 45.730 87.275 36.190 1.00 44.08 ? 71 PHE L CE2 1 ATOM 3823 C CZ . PHE C 3 71 ? 45.924 87.623 37.511 1.00 43.70 ? 71 PHE L CZ 1 ATOM 3824 N N . THR C 3 72 ? 52.257 86.294 34.508 1.00 40.40 ? 72 THR L N 1 ATOM 3825 C CA . THR C 3 72 ? 53.488 85.808 33.909 1.00 40.39 ? 72 THR L CA 1 ATOM 3826 C C . THR C 3 72 ? 54.149 84.742 34.777 1.00 42.31 ? 72 THR L C 1 ATOM 3827 O O . THR C 3 72 ? 54.267 84.902 35.993 1.00 42.20 ? 72 THR L O 1 ATOM 3828 C CB . THR C 3 72 ? 54.472 86.972 33.671 1.00 43.50 ? 72 THR L CB 1 ATOM 3829 O OG1 . THR C 3 72 ? 54.024 87.753 32.557 1.00 46.13 ? 72 THR L OG1 1 ATOM 3830 C CG2 . THR C 3 72 ? 55.863 86.455 33.377 1.00 48.51 ? 72 THR L CG2 1 ATOM 3831 N N . LEU C 3 73 ? 54.550 83.641 34.147 1.00 43.30 ? 73 LEU L N 1 ATOM 3832 C CA . LEU C 3 73 ? 55.362 82.631 34.810 1.00 41.42 ? 73 LEU L CA 1 ATOM 3833 C C . LEU C 3 73 ? 56.793 82.737 34.310 1.00 43.50 ? 73 LEU L C 1 ATOM 3834 O O . LEU C 3 73 ? 57.072 82.485 33.137 1.00 41.12 ? 73 LEU L O 1 ATOM 3835 C CB . LEU C 3 73 ? 54.823 81.223 34.560 1.00 41.86 ? 73 LEU L CB 1 ATOM 3836 C CG . LEU C 3 73 ? 55.720 80.106 35.106 1.00 42.98 ? 73 LEU L CG 1 ATOM 3837 C CD1 . LEU C 3 73 ? 55.810 80.176 36.626 1.00 45.73 ? 73 LEU L CD1 1 ATOM 3838 C CD2 . LEU C 3 73 ? 55.250 78.728 34.650 1.00 33.51 ? 73 LEU L CD2 1 ATOM 3839 N N . THR C 3 74 ? 57.698 83.119 35.202 1.00 43.59 ? 74 THR L N 1 ATOM 3840 C CA . THR C 3 74 ? 59.093 83.289 34.835 1.00 41.00 ? 74 THR L CA 1 ATOM 3841 C C . THR C 3 74 ? 59.949 82.182 35.433 1.00 41.60 ? 74 THR L C 1 ATOM 3842 O O . THR C 3 74 ? 59.898 81.921 36.633 1.00 44.91 ? 74 THR L O 1 ATOM 3843 C CB . THR C 3 74 ? 59.630 84.651 35.295 1.00 47.44 ? 74 THR L CB 1 ATOM 3844 O OG1 . THR C 3 74 ? 58.858 85.696 34.690 1.00 53.26 ? 74 THR L OG1 1 ATOM 3845 C CG2 . THR C 3 74 ? 61.089 84.812 34.900 1.00 43.55 ? 74 THR L CG2 1 ATOM 3846 N N . ILE C 3 75 ? 60.728 81.524 34.584 1.00 40.30 ? 75 ILE L N 1 ATOM 3847 C CA . ILE C 3 75 ? 61.686 80.523 35.036 1.00 40.78 ? 75 ILE L CA 1 ATOM 3848 C C . ILE C 3 75 ? 63.092 81.052 34.794 1.00 44.24 ? 75 ILE L C 1 ATOM 3849 O O . ILE C 3 75 ? 63.515 81.201 33.653 1.00 46.89 ? 75 ILE L O 1 ATOM 3850 C CB . ILE C 3 75 ? 61.484 79.178 34.318 1.00 39.40 ? 75 ILE L CB 1 ATOM 3851 C CG1 . ILE C 3 75 ? 59.996 78.835 34.253 1.00 35.58 ? 75 ILE L CG1 1 ATOM 3852 C CG2 . ILE C 3 75 ? 62.259 78.081 35.028 1.00 42.73 ? 75 ILE L CG2 1 ATOM 3853 C CD1 . ILE C 3 75 ? 59.686 77.562 33.491 1.00 35.77 ? 75 ILE L CD1 1 ATOM 3854 N N . SER C 3 76 ? 63.809 81.333 35.878 1.00 48.47 ? 76 SER L N 1 ATOM 3855 C CA . SER C 3 76 ? 65.026 82.140 35.804 1.00 54.98 ? 76 SER L CA 1 ATOM 3856 C C . SER C 3 76 ? 66.225 81.440 35.157 1.00 65.65 ? 76 SER L C 1 ATOM 3857 O O . SER C 3 76 ? 66.940 82.045 34.361 1.00 80.24 ? 76 SER L O 1 ATOM 3858 C CB . SER C 3 76 ? 65.420 82.626 37.202 1.00 55.93 ? 76 SER L CB 1 ATOM 3859 O OG . SER C 3 76 ? 65.783 81.544 38.031 1.00 58.33 ? 76 SER L OG 1 ATOM 3860 N N . SER C 3 77 ? 66.480 80.188 35.516 1.00 56.45 ? 77 SER L N 1 ATOM 3861 C CA . SER C 3 77 ? 67.600 79.464 34.904 1.00 57.96 ? 77 SER L CA 1 ATOM 3862 C C . SER C 3 77 ? 67.253 77.996 34.700 1.00 51.87 ? 77 SER L C 1 ATOM 3863 O O . SER C 3 77 ? 67.402 77.177 35.608 1.00 49.70 ? 77 SER L O 1 ATOM 3864 C CB . SER C 3 77 ? 68.878 79.595 35.740 1.00 62.54 ? 77 SER L CB 1 ATOM 3865 O OG . SER C 3 77 ? 68.635 79.331 37.107 1.00 68.61 ? 77 SER L OG 1 ATOM 3866 N N . LEU C 3 78 ? 66.797 77.681 33.489 1.00 45.78 ? 78 LEU L N 1 ATOM 3867 C CA . LEU C 3 78 ? 66.236 76.371 33.164 1.00 44.37 ? 78 LEU L CA 1 ATOM 3868 C C . LEU C 3 78 ? 67.123 75.196 33.534 1.00 44.48 ? 78 LEU L C 1 ATOM 3869 O O . LEU C 3 78 ? 68.308 75.154 33.192 1.00 42.74 ? 78 LEU L O 1 ATOM 3870 C CB . LEU C 3 78 ? 65.930 76.277 31.672 1.00 51.33 ? 78 LEU L CB 1 ATOM 3871 C CG . LEU C 3 78 ? 64.581 76.770 31.172 1.00 54.09 ? 78 LEU L CG 1 ATOM 3872 C CD1 . LEU C 3 78 ? 64.394 76.291 29.749 1.00 63.29 ? 78 LEU L CD1 1 ATOM 3873 C CD2 . LEU C 3 78 ? 63.450 76.277 32.055 1.00 46.13 ? 78 LEU L CD2 1 ATOM 3874 N N . GLN C 3 79 ? 66.529 74.232 34.222 1.00 35.63 ? 79 GLN L N 1 ATOM 3875 C CA . GLN C 3 79 ? 67.212 72.989 34.532 1.00 43.61 ? 79 GLN L CA 1 ATOM 3876 C C . GLN C 3 79 ? 66.633 71.890 33.646 1.00 40.45 ? 79 GLN L C 1 ATOM 3877 O O . GLN C 3 79 ? 65.525 72.041 33.130 1.00 39.10 ? 79 GLN L O 1 ATOM 3878 C CB . GLN C 3 79 ? 67.066 72.652 36.017 1.00 41.77 ? 79 GLN L CB 1 ATOM 3879 C CG . GLN C 3 79 ? 67.666 73.697 36.950 1.00 43.34 ? 79 GLN L CG 1 ATOM 3880 C CD . GLN C 3 79 ? 69.162 73.860 36.768 1.00 54.19 ? 79 GLN L CD 1 ATOM 3881 O OE1 . GLN C 3 79 ? 69.641 74.936 36.410 1.00 60.44 ? 79 GLN L OE1 1 ATOM 3882 N NE2 . GLN C 3 79 ? 69.909 72.793 37.020 1.00 52.96 ? 79 GLN L NE2 1 ATOM 3883 N N . PRO C 3 80 ? 67.395 70.802 33.434 1.00 43.55 ? 80 PRO L N 1 ATOM 3884 C CA . PRO C 3 80 ? 66.944 69.657 32.636 1.00 41.26 ? 80 PRO L CA 1 ATOM 3885 C C . PRO C 3 80 ? 65.516 69.217 32.965 1.00 42.92 ? 80 PRO L C 1 ATOM 3886 O O . PRO C 3 80 ? 64.745 68.888 32.063 1.00 40.57 ? 80 PRO L O 1 ATOM 3887 C CB . PRO C 3 80 ? 67.942 68.559 33.009 1.00 45.00 ? 80 PRO L CB 1 ATOM 3888 C CG . PRO C 3 80 ? 69.176 69.282 33.506 1.00 46.92 ? 80 PRO L CG 1 ATOM 3889 C CD . PRO C 3 80 ? 68.844 70.740 33.698 1.00 49.91 ? 80 PRO L CD 1 ATOM 3890 N N . GLU C 3 81 ? 65.174 69.234 34.248 1.00 38.92 ? 81 GLU L N 1 ATOM 3891 C CA . GLU C 3 81 ? 63.881 68.751 34.713 1.00 36.85 ? 81 GLU L CA 1 ATOM 3892 C C . GLU C 3 81 ? 62.748 69.751 34.473 1.00 38.53 ? 81 GLU L C 1 ATOM 3893 O O . GLU C 3 81 ? 61.579 69.420 34.654 1.00 35.44 ? 81 GLU L O 1 ATOM 3894 C CB . GLU C 3 81 ? 63.958 68.399 36.202 1.00 40.16 ? 81 GLU L CB 1 ATOM 3895 C CG . GLU C 3 81 ? 64.528 69.501 37.099 1.00 48.94 ? 81 GLU L CG 1 ATOM 3896 C CD . GLU C 3 81 ? 66.055 69.487 37.191 1.00 65.48 ? 81 GLU L CD 1 ATOM 3897 O OE1 . GLU C 3 81 ? 66.717 68.858 36.337 1.00 61.91 ? 81 GLU L OE1 1 ATOM 3898 O OE2 . GLU C 3 81 ? 66.596 70.111 38.129 1.00 77.63 ? 81 GLU L OE2 1 ATOM 3899 N N . ASP C 3 82 ? 63.093 70.966 34.055 1.00 41.29 ? 82 ASP L N 1 ATOM 3900 C CA . ASP C 3 82 ? 62.092 72.008 33.825 1.00 38.98 ? 82 ASP L CA 1 ATOM 3901 C C . ASP C 3 82 ? 61.474 71.931 32.431 1.00 41.53 ? 82 ASP L C 1 ATOM 3902 O O . ASP C 3 82 ? 60.501 72.623 32.139 1.00 43.99 ? 82 ASP L O 1 ATOM 3903 C CB . ASP C 3 82 ? 62.703 73.395 34.030 1.00 34.52 ? 82 ASP L CB 1 ATOM 3904 C CG . ASP C 3 82 ? 63.216 73.603 35.436 1.00 37.12 ? 82 ASP L CG 1 ATOM 3905 O OD1 . ASP C 3 82 ? 62.722 72.919 36.358 1.00 36.35 ? 82 ASP L OD1 1 ATOM 3906 O OD2 . ASP C 3 82 ? 64.113 74.455 35.619 1.00 38.18 ? 82 ASP L OD2 1 ATOM 3907 N N . PHE C 3 83 ? 62.041 71.098 31.568 1.00 37.87 ? 83 PHE L N 1 ATOM 3908 C CA . PHE C 3 83 ? 61.528 70.976 30.213 1.00 37.09 ? 83 PHE L CA 1 ATOM 3909 C C . PHE C 3 83 ? 60.267 70.131 30.187 1.00 39.10 ? 83 PHE L C 1 ATOM 3910 O O . PHE C 3 83 ? 60.317 68.907 30.289 1.00 47.82 ? 83 PHE L O 1 ATOM 3911 C CB . PHE C 3 83 ? 62.591 70.394 29.289 1.00 36.21 ? 83 PHE L CB 1 ATOM 3912 C CG . PHE C 3 83 ? 63.753 71.313 29.074 1.00 41.15 ? 83 PHE L CG 1 ATOM 3913 C CD1 . PHE C 3 83 ? 64.897 71.196 29.846 1.00 41.64 ? 83 PHE L CD1 1 ATOM 3914 C CD2 . PHE C 3 83 ? 63.688 72.315 28.121 1.00 44.43 ? 83 PHE L CD2 1 ATOM 3915 C CE1 . PHE C 3 83 ? 65.963 72.050 29.658 1.00 48.92 ? 83 PHE L CE1 1 ATOM 3916 C CE2 . PHE C 3 83 ? 64.750 73.173 27.927 1.00 50.62 ? 83 PHE L CE2 1 ATOM 3917 C CZ . PHE C 3 83 ? 65.891 73.041 28.697 1.00 52.27 ? 83 PHE L CZ 1 ATOM 3918 N N . ALA C 3 84 ? 59.133 70.805 30.057 1.00 34.05 ? 84 ALA L N 1 ATOM 3919 C CA . ALA C 3 84 ? 57.837 70.144 30.048 1.00 35.95 ? 84 ALA L CA 1 ATOM 3920 C C . ALA C 3 84 ? 56.775 71.078 29.489 1.00 37.27 ? 84 ALA L C 1 ATOM 3921 O O . ALA C 3 84 ? 57.090 72.112 28.896 1.00 33.39 ? 84 ALA L O 1 ATOM 3922 C CB . ALA C 3 84 ? 57.459 69.693 31.448 1.00 31.48 ? 84 ALA L CB 1 ATOM 3923 N N . THR C 3 85 ? 55.514 70.710 29.682 1.00 32.81 ? 85 THR L N 1 ATOM 3924 C CA . THR C 3 85 ? 54.419 71.583 29.306 1.00 34.02 ? 85 THR L CA 1 ATOM 3925 C C . THR C 3 85 ? 53.912 72.322 30.545 1.00 34.41 ? 85 THR L C 1 ATOM 3926 O O . THR C 3 85 ? 53.785 71.736 31.621 1.00 34.32 ? 85 THR L O 1 ATOM 3927 C CB . THR C 3 85 ? 53.279 70.797 28.642 1.00 37.19 ? 85 THR L CB 1 ATOM 3928 O OG1 . THR C 3 85 ? 53.783 70.108 27.490 1.00 41.14 ? 85 THR L OG1 1 ATOM 3929 C CG2 . THR C 3 85 ? 52.162 71.729 28.213 1.00 39.12 ? 85 THR L CG2 1 ATOM 3930 N N . TYR C 3 86 ? 53.648 73.617 30.397 1.00 33.98 ? 86 TYR L N 1 ATOM 3931 C CA . TYR C 3 86 ? 53.143 74.422 31.507 1.00 31.99 ? 86 TYR L CA 1 ATOM 3932 C C . TYR C 3 86 ? 51.742 74.939 31.215 1.00 37.83 ? 86 TYR L C 1 ATOM 3933 O O . TYR C 3 86 ? 51.456 75.389 30.104 1.00 33.74 ? 86 TYR L O 1 ATOM 3934 C CB . TYR C 3 86 ? 54.096 75.581 31.807 1.00 30.12 ? 86 TYR L CB 1 ATOM 3935 C CG . TYR C 3 86 ? 55.439 75.096 32.301 1.00 31.26 ? 86 TYR L CG 1 ATOM 3936 C CD1 . TYR C 3 86 ? 56.461 74.798 31.409 1.00 33.74 ? 86 TYR L CD1 1 ATOM 3937 C CD2 . TYR C 3 86 ? 55.672 74.906 33.653 1.00 27.37 ? 86 TYR L CD2 1 ATOM 3938 C CE1 . TYR C 3 86 ? 57.681 74.340 31.854 1.00 36.49 ? 86 TYR L CE1 1 ATOM 3939 C CE2 . TYR C 3 86 ? 56.888 74.449 34.108 1.00 32.62 ? 86 TYR L CE2 1 ATOM 3940 C CZ . TYR C 3 86 ? 57.891 74.167 33.205 1.00 34.21 ? 86 TYR L CZ 1 ATOM 3941 O OH . TYR C 3 86 ? 59.109 73.711 33.657 1.00 29.70 ? 86 TYR L OH 1 ATOM 3942 N N . TYR C 3 87 ? 50.870 74.858 32.218 1.00 37.01 ? 87 TYR L N 1 ATOM 3943 C CA . TYR C 3 87 ? 49.483 75.279 32.060 1.00 38.01 ? 87 TYR L CA 1 ATOM 3944 C C . TYR C 3 87 ? 49.084 76.408 33.007 1.00 39.60 ? 87 TYR L C 1 ATOM 3945 O O . TYR C 3 87 ? 49.420 76.406 34.194 1.00 31.43 ? 87 TYR L O 1 ATOM 3946 C CB . TYR C 3 87 ? 48.533 74.095 32.266 1.00 37.27 ? 87 TYR L CB 1 ATOM 3947 C CG . TYR C 3 87 ? 48.541 73.079 31.146 1.00 37.20 ? 87 TYR L CG 1 ATOM 3948 C CD1 . TYR C 3 87 ? 47.842 73.307 29.967 1.00 33.39 ? 87 TYR L CD1 1 ATOM 3949 C CD2 . TYR C 3 87 ? 49.232 71.879 31.276 1.00 36.52 ? 87 TYR L CD2 1 ATOM 3950 C CE1 . TYR C 3 87 ? 47.843 72.377 28.945 1.00 36.52 ? 87 TYR L CE1 1 ATOM 3951 C CE2 . TYR C 3 87 ? 49.237 70.941 30.260 1.00 36.62 ? 87 TYR L CE2 1 ATOM 3952 C CZ . TYR C 3 87 ? 48.542 71.194 29.097 1.00 38.78 ? 87 TYR L CZ 1 ATOM 3953 O OH . TYR C 3 87 ? 48.548 70.260 28.086 1.00 43.75 ? 87 TYR L OH 1 ATOM 3954 N N . CYS C 3 88 ? 48.353 77.366 32.450 1.00 41.64 ? 88 CYS L N 1 ATOM 3955 C CA . CYS C 3 88 ? 47.692 78.423 33.202 1.00 39.65 ? 88 CYS L CA 1 ATOM 3956 C C . CYS C 3 88 ? 46.339 77.917 33.707 1.00 43.63 ? 88 CYS L C 1 ATOM 3957 O O . CYS C 3 88 ? 45.733 77.049 33.079 1.00 33.56 ? 88 CYS L O 1 ATOM 3958 C CB . CYS C 3 88 ? 47.501 79.654 32.306 1.00 31.50 ? 88 CYS L CB 1 ATOM 3959 S SG . CYS C 3 88 ? 47.627 81.236 33.132 1.00 106.10 ? 88 CYS L SG 1 ATOM 3960 N N . GLN C 3 89 ? 45.864 78.449 34.830 1.00 48.20 ? 89 GLN L N 1 ATOM 3961 C CA . GLN C 3 89 ? 44.509 78.148 35.297 1.00 42.42 ? 89 GLN L CA 1 ATOM 3962 C C . GLN C 3 89 ? 43.945 79.258 36.180 1.00 43.38 ? 89 GLN L C 1 ATOM 3963 O O . GLN C 3 89 ? 44.601 79.695 37.127 1.00 35.95 ? 89 GLN L O 1 ATOM 3964 C CB . GLN C 3 89 ? 44.470 76.827 36.070 1.00 38.00 ? 89 GLN L CB 1 ATOM 3965 C CG . GLN C 3 89 ? 43.051 76.364 36.377 1.00 41.76 ? 89 GLN L CG 1 ATOM 3966 C CD . GLN C 3 89 ? 42.961 75.489 37.613 1.00 51.16 ? 89 GLN L CD 1 ATOM 3967 O OE1 . GLN C 3 89 ? 43.836 75.520 38.476 1.00 55.82 ? 89 GLN L OE1 1 ATOM 3968 N NE2 . GLN C 3 89 ? 41.893 74.706 37.706 1.00 55.80 ? 89 GLN L NE2 1 ATOM 3969 N N . GLN C 3 90 ? 42.726 79.701 35.872 1.00 45.61 ? 90 GLN L N 1 ATOM 3970 C CA . GLN C 3 90 ? 42.052 80.710 36.684 1.00 40.96 ? 90 GLN L CA 1 ATOM 3971 C C . GLN C 3 90 ? 41.185 80.044 37.749 1.00 47.15 ? 90 GLN L C 1 ATOM 3972 O O . GLN C 3 90 ? 40.528 79.034 37.494 1.00 45.62 ? 90 GLN L O 1 ATOM 3973 C CB . GLN C 3 90 ? 41.214 81.651 35.808 1.00 45.19 ? 90 GLN L CB 1 ATOM 3974 C CG . GLN C 3 90 ? 40.042 80.999 35.079 1.00 45.71 ? 90 GLN L CG 1 ATOM 3975 C CD . GLN C 3 90 ? 38.744 81.070 35.866 1.00 49.08 ? 90 GLN L CD 1 ATOM 3976 O OE1 . GLN C 3 90 ? 38.640 81.804 36.849 1.00 48.59 ? 90 GLN L OE1 1 ATOM 3977 N NE2 . GLN C 3 90 ? 37.747 80.304 35.434 1.00 51.11 ? 90 GLN L NE2 1 ATOM 3978 N N . LEU C 3 91 ? 41.193 80.622 38.944 1.00 38.68 ? 91 LEU L N 1 ATOM 3979 C CA . LEU C 3 91 ? 40.538 80.034 40.109 1.00 34.87 ? 91 LEU L CA 1 ATOM 3980 C C . LEU C 3 91 ? 39.340 80.873 40.548 1.00 38.83 ? 91 LEU L C 1 ATOM 3981 O O . LEU C 3 91 ? 38.710 80.596 41.566 1.00 44.50 ? 91 LEU L O 1 ATOM 3982 C CB . LEU C 3 91 ? 41.534 79.905 41.267 1.00 40.35 ? 91 LEU L CB 1 ATOM 3983 C CG . LEU C 3 91 ? 42.637 78.834 41.312 1.00 48.78 ? 91 LEU L CG 1 ATOM 3984 C CD1 . LEU C 3 91 ? 43.282 78.528 39.963 1.00 43.19 ? 91 LEU L CD1 1 ATOM 3985 C CD2 . LEU C 3 91 ? 43.702 79.236 42.327 1.00 57.65 ? 91 LEU L CD2 1 ATOM 3986 N N . ASN C 3 92 ? 39.036 81.902 39.767 1.00 36.67 ? 92 ASN L N 1 ATOM 3987 C CA . ASN C 3 92 ? 38.079 82.928 40.163 1.00 37.77 ? 92 ASN L CA 1 ATOM 3988 C C . ASN C 3 92 ? 36.618 82.481 40.062 1.00 41.66 ? 92 ASN L C 1 ATOM 3989 O O . ASN C 3 92 ? 35.884 82.523 41.050 1.00 42.40 ? 92 ASN L O 1 ATOM 3990 C CB . ASN C 3 92 ? 38.301 84.186 39.316 1.00 39.05 ? 92 ASN L CB 1 ATOM 3991 C CG . ASN C 3 92 ? 37.385 85.328 39.709 1.00 41.82 ? 92 ASN L CG 1 ATOM 3992 O OD1 . ASN C 3 92 ? 36.276 85.454 39.189 1.00 46.02 ? 92 ASN L OD1 1 ATOM 3993 N ND2 . ASN C 3 92 ? 37.850 86.176 40.623 1.00 36.89 ? 92 ASN L ND2 1 ATOM 3994 N N . SER C 3 93 ? 36.203 82.049 38.874 1.00 38.58 ? 93 SER L N 1 ATOM 3995 C CA . SER C 3 93 ? 34.803 81.717 38.633 1.00 42.65 ? 93 SER L CA 1 ATOM 3996 C C . SER C 3 93 ? 34.621 80.426 37.836 1.00 46.26 ? 93 SER L C 1 ATOM 3997 O O . SER C 3 93 ? 35.554 79.941 37.194 1.00 45.52 ? 93 SER L O 1 ATOM 3998 C CB . SER C 3 93 ? 34.112 82.868 37.896 1.00 41.22 ? 93 SER L CB 1 ATOM 3999 O OG . SER C 3 93 ? 34.338 84.106 38.550 1.00 45.05 ? 93 SER L OG 1 ATOM 4000 N N . TYR C 3 94 ? 33.407 79.882 37.886 1.00 42.89 ? 94 TYR L N 1 ATOM 4001 C CA . TYR C 3 94 ? 33.038 78.727 37.074 1.00 38.98 ? 94 TYR L CA 1 ATOM 4002 C C . TYR C 3 94 ? 32.799 79.130 35.622 1.00 40.00 ? 94 TYR L C 1 ATOM 4003 O O . TYR C 3 94 ? 32.260 80.203 35.355 1.00 45.46 ? 94 TYR L O 1 ATOM 4004 C CB . TYR C 3 94 ? 31.782 78.058 37.628 1.00 40.02 ? 94 TYR L CB 1 ATOM 4005 C CG . TYR C 3 94 ? 31.996 77.294 38.911 1.00 41.59 ? 94 TYR L CG 1 ATOM 4006 C CD1 . TYR C 3 94 ? 33.161 76.572 39.128 1.00 42.03 ? 94 TYR L CD1 1 ATOM 4007 C CD2 . TYR C 3 94 ? 31.028 77.293 39.908 1.00 37.67 ? 94 TYR L CD2 1 ATOM 4008 C CE1 . TYR C 3 94 ? 33.354 75.869 40.301 1.00 42.30 ? 94 TYR L CE1 1 ATOM 4009 C CE2 . TYR C 3 94 ? 31.213 76.598 41.081 1.00 36.92 ? 94 TYR L CE2 1 ATOM 4010 C CZ . TYR C 3 94 ? 32.377 75.888 41.276 1.00 41.78 ? 94 TYR L CZ 1 ATOM 4011 O OH . TYR C 3 94 ? 32.561 75.191 42.449 1.00 47.04 ? 94 TYR L OH 1 ATOM 4012 N N . PRO C 3 95 ? 33.204 78.269 34.675 1.00 41.18 ? 95 PRO L N 1 ATOM 4013 C CA . PRO C 3 95 ? 33.939 77.030 34.944 1.00 38.00 ? 95 PRO L CA 1 ATOM 4014 C C . PRO C 3 95 ? 35.422 77.298 35.134 1.00 35.96 ? 95 PRO L C 1 ATOM 4015 O O . PRO C 3 95 ? 35.936 78.275 34.597 1.00 37.39 ? 95 PRO L O 1 ATOM 4016 C CB . PRO C 3 95 ? 33.691 76.201 33.685 1.00 36.21 ? 95 PRO L CB 1 ATOM 4017 C CG . PRO C 3 95 ? 33.580 77.229 32.609 1.00 34.10 ? 95 PRO L CG 1 ATOM 4018 C CD . PRO C 3 95 ? 32.882 78.412 33.243 1.00 35.27 ? 95 PRO L CD 1 ATOM 4019 N N . LEU C 3 96 ? 36.094 76.443 35.895 1.00 41.59 ? 96 LEU L N 1 ATOM 4020 C CA . LEU C 3 96 ? 37.529 76.573 36.096 1.00 43.19 ? 96 LEU L CA 1 ATOM 4021 C C . LEU C 3 96 ? 38.246 76.371 34.768 1.00 50.81 ? 96 LEU L C 1 ATOM 4022 O O . LEU C 3 96 ? 38.306 75.258 34.247 1.00 66.77 ? 96 LEU L O 1 ATOM 4023 C CB . LEU C 3 96 ? 38.017 75.569 37.141 1.00 43.92 ? 96 LEU L CB 1 ATOM 4024 C CG . LEU C 3 96 ? 37.320 75.676 38.500 1.00 43.13 ? 96 LEU L CG 1 ATOM 4025 C CD1 . LEU C 3 96 ? 37.767 74.574 39.447 1.00 44.66 ? 96 LEU L CD1 1 ATOM 4026 C CD2 . LEU C 3 96 ? 37.566 77.047 39.113 1.00 42.52 ? 96 LEU L CD2 1 ATOM 4027 N N . THR C 3 97 ? 38.782 77.453 34.216 1.00 45.01 ? 97 THR L N 1 ATOM 4028 C CA . THR C 3 97 ? 39.359 77.412 32.879 1.00 43.02 ? 97 THR L CA 1 ATOM 4029 C C . THR C 3 97 ? 40.885 77.325 32.914 1.00 43.33 ? 97 THR L C 1 ATOM 4030 O O . THR C 3 97 ? 41.545 78.045 33.665 1.00 41.76 ? 97 THR L O 1 ATOM 4031 C CB . THR C 3 97 ? 38.931 78.646 32.059 1.00 42.33 ? 97 THR L CB 1 ATOM 4032 O OG1 . THR C 3 97 ? 37.511 78.624 31.882 1.00 53.22 ? 97 THR L OG1 1 ATOM 4033 C CG2 . THR C 3 97 ? 39.591 78.648 30.691 1.00 46.68 ? 97 THR L CG2 1 ATOM 4034 N N . PHE C 3 98 ? 41.429 76.420 32.105 1.00 40.86 ? 98 PHE L N 1 ATOM 4035 C CA . PHE C 3 98 ? 42.869 76.276 31.932 1.00 36.08 ? 98 PHE L CA 1 ATOM 4036 C C . PHE C 3 98 ? 43.338 77.020 30.684 1.00 37.42 ? 98 PHE L C 1 ATOM 4037 O O . PHE C 3 98 ? 42.569 77.203 29.739 1.00 32.83 ? 98 PHE L O 1 ATOM 4038 C CB . PHE C 3 98 ? 43.261 74.801 31.819 1.00 34.38 ? 98 PHE L CB 1 ATOM 4039 C CG . PHE C 3 98 ? 43.227 74.053 33.120 1.00 41.28 ? 98 PHE L CG 1 ATOM 4040 C CD1 . PHE C 3 98 ? 44.366 73.950 33.903 1.00 37.84 ? 98 PHE L CD1 1 ATOM 4041 C CD2 . PHE C 3 98 ? 42.067 73.430 33.550 1.00 28.85 ? 98 PHE L CD2 1 ATOM 4042 C CE1 . PHE C 3 98 ? 44.344 73.251 35.101 1.00 38.38 ? 98 PHE L CE1 1 ATOM 4043 C CE2 . PHE C 3 98 ? 42.039 72.731 34.742 1.00 30.96 ? 98 PHE L CE2 1 ATOM 4044 C CZ . PHE C 3 98 ? 43.178 72.642 35.519 1.00 36.80 ? 98 PHE L CZ 1 ATOM 4045 N N . GLY C 3 99 ? 44.601 77.437 30.679 1.00 38.86 ? 99 GLY L N 1 ATOM 4046 C CA . GLY C 3 99 ? 45.190 78.028 29.492 1.00 30.67 ? 99 GLY L CA 1 ATOM 4047 C C . GLY C 3 99 ? 45.516 76.950 28.476 1.00 32.74 ? 99 GLY L C 1 ATOM 4048 O O . GLY C 3 99 ? 45.440 75.760 28.784 1.00 36.38 ? 99 GLY L O 1 ATOM 4049 N N . GLY C 3 100 ? 45.883 77.363 27.267 1.00 29.55 ? 100 GLY L N 1 ATOM 4050 C CA . GLY C 3 100 ? 46.173 76.430 26.193 1.00 28.68 ? 100 GLY L CA 1 ATOM 4051 C C . GLY C 3 100 ? 47.408 75.576 26.422 1.00 37.64 ? 100 GLY L C 1 ATOM 4052 O O . GLY C 3 100 ? 47.529 74.483 25.868 1.00 39.13 ? 100 GLY L O 1 ATOM 4053 N N . GLY C 3 101 ? 48.332 76.076 27.235 1.00 36.34 ? 101 GLY L N 1 ATOM 4054 C CA . GLY C 3 101 ? 49.541 75.340 27.541 1.00 38.73 ? 101 GLY L CA 1 ATOM 4055 C C . GLY C 3 101 ? 50.750 75.851 26.785 1.00 40.12 ? 101 GLY L C 1 ATOM 4056 O O . GLY C 3 101 ? 50.632 76.401 25.692 1.00 37.72 ? 101 GLY L O 1 ATOM 4057 N N . THR C 3 102 ? 51.923 75.668 27.377 1.00 43.57 ? 102 THR L N 1 ATOM 4058 C CA . THR C 3 102 ? 53.165 76.065 26.740 1.00 38.84 ? 102 THR L CA 1 ATOM 4059 C C . THR C 3 102 ? 54.153 74.915 26.783 1.00 45.23 ? 102 THR L C 1 ATOM 4060 O O . THR C 3 102 ? 54.516 74.427 27.851 1.00 49.83 ? 102 THR L O 1 ATOM 4061 C CB . THR C 3 102 ? 53.780 77.305 27.408 1.00 40.64 ? 102 THR L CB 1 ATOM 4062 O OG1 . THR C 3 102 ? 52.894 78.421 27.253 1.00 38.46 ? 102 THR L OG1 1 ATOM 4063 C CG2 . THR C 3 102 ? 55.123 77.641 26.772 1.00 43.46 ? 102 THR L CG2 1 ATOM 4064 N N . LYS C 3 103 ? 54.568 74.474 25.605 1.00 39.74 ? 103 LYS L N 1 ATOM 4065 C CA . LYS C 3 103 ? 55.525 73.390 25.488 1.00 42.38 ? 103 LYS L CA 1 ATOM 4066 C C . LYS C 3 103 ? 56.940 73.952 25.461 1.00 40.37 ? 103 LYS L C 1 ATOM 4067 O O . LYS C 3 103 ? 57.302 74.696 24.553 1.00 38.78 ? 103 LYS L O 1 ATOM 4068 C CB . LYS C 3 103 ? 55.240 72.564 24.231 1.00 42.28 ? 103 LYS L CB 1 ATOM 4069 C CG . LYS C 3 103 ? 56.186 71.400 24.007 1.00 49.71 ? 103 LYS L CG 1 ATOM 4070 C CD . LYS C 3 103 ? 56.098 70.380 25.126 1.00 59.58 ? 103 LYS L CD 1 ATOM 4071 C CE . LYS C 3 103 ? 56.785 69.083 24.732 1.00 62.27 ? 103 LYS L CE 1 ATOM 4072 N NZ . LYS C 3 103 ? 56.097 68.430 23.582 1.00 59.57 ? 103 LYS L NZ 1 ATOM 4073 N N . VAL C 3 104 ? 57.728 73.608 26.474 1.00 33.93 ? 104 VAL L N 1 ATOM 4074 C CA . VAL C 3 104 ? 59.116 74.037 26.537 1.00 34.40 ? 104 VAL L CA 1 ATOM 4075 C C . VAL C 3 104 ? 60.049 72.898 26.140 1.00 40.23 ? 104 VAL L C 1 ATOM 4076 O O . VAL C 3 104 ? 60.232 71.944 26.900 1.00 41.49 ? 104 VAL L O 1 ATOM 4077 C CB . VAL C 3 104 ? 59.492 74.535 27.943 1.00 38.71 ? 104 VAL L CB 1 ATOM 4078 C CG1 . VAL C 3 104 ? 60.945 74.971 27.977 1.00 36.59 ? 104 VAL L CG1 1 ATOM 4079 C CG2 . VAL C 3 104 ? 58.581 75.679 28.360 1.00 39.87 ? 104 VAL L CG2 1 ATOM 4080 N N . GLU C 3 105 ? 60.624 72.994 24.943 1.00 37.16 ? 105 GLU L N 1 ATOM 4081 C CA . GLU C 3 105 ? 61.563 71.985 24.468 1.00 41.98 ? 105 GLU L CA 1 ATOM 4082 C C . GLU C 3 105 ? 63.007 72.453 24.640 1.00 46.89 ? 105 GLU L C 1 ATOM 4083 O O . GLU C 3 105 ? 63.260 73.620 24.949 1.00 35.89 ? 105 GLU L O 1 ATOM 4084 C CB . GLU C 3 105 ? 61.303 71.644 22.998 1.00 44.72 ? 105 GLU L CB 1 ATOM 4085 C CG . GLU C 3 105 ? 61.842 72.684 22.024 1.00 49.46 ? 105 GLU L CG 1 ATOM 4086 C CD . GLU C 3 105 ? 62.312 72.084 20.707 1.00 46.29 ? 105 GLU L CD 1 ATOM 4087 O OE1 . GLU C 3 105 ? 61.823 71.001 20.325 1.00 42.90 ? 105 GLU L OE1 1 ATOM 4088 O OE2 . GLU C 3 105 ? 63.180 72.700 20.055 1.00 46.44 ? 105 GLU L OE2 1 ATOM 4089 N N . ILE C 3 106 ? 63.945 71.533 24.429 1.00 42.77 ? 106 ILE L N 1 ATOM 4090 C CA . ILE C 3 106 ? 65.366 71.834 24.544 1.00 41.45 ? 106 ILE L CA 1 ATOM 4091 C C . ILE C 3 106 ? 65.940 72.296 23.211 1.00 42.05 ? 106 ILE L C 1 ATOM 4092 O O . ILE C 3 106 ? 65.779 71.623 22.194 1.00 41.53 ? 106 ILE L O 1 ATOM 4093 C CB . ILE C 3 106 ? 66.174 70.609 25.012 1.00 44.63 ? 106 ILE L CB 1 ATOM 4094 C CG1 . ILE C 3 106 ? 65.490 69.915 26.193 1.00 40.32 ? 106 ILE L CG1 1 ATOM 4095 C CG2 . ILE C 3 106 ? 67.605 71.014 25.355 1.00 38.56 ? 106 ILE L CG2 1 ATOM 4096 C CD1 . ILE C 3 106 ? 66.097 68.570 26.534 1.00 38.90 ? 106 ILE L CD1 1 ATOM 4097 N N . LYS C 3 107 ? 66.621 73.436 23.221 1.00 47.76 ? 107 LYS L N 1 ATOM 4098 C CA . LYS C 3 107 ? 67.269 73.952 22.021 1.00 50.50 ? 107 LYS L CA 1 ATOM 4099 C C . LYS C 3 107 ? 68.663 73.351 21.836 1.00 52.79 ? 107 LYS L C 1 ATOM 4100 O O . LYS C 3 107 ? 69.531 73.518 22.691 1.00 60.38 ? 107 LYS L O 1 ATOM 4101 C CB . LYS C 3 107 ? 67.358 75.480 22.081 1.00 53.40 ? 107 LYS L CB 1 ATOM 4102 C CG . LYS C 3 107 ? 68.061 76.113 20.893 1.00 57.91 ? 107 LYS L CG 1 ATOM 4103 C CD . LYS C 3 107 ? 68.054 77.634 20.986 1.00 66.33 ? 107 LYS L CD 1 ATOM 4104 C CE . LYS C 3 107 ? 68.853 78.120 22.185 1.00 74.42 ? 107 LYS L CE 1 ATOM 4105 N NZ . LYS C 3 107 ? 68.872 79.606 22.290 1.00 81.14 ? 107 LYS L NZ 1 ATOM 4106 N N . ARG C 3 108 ? 68.868 72.648 20.723 1.00 48.37 ? 108 ARG L N 1 ATOM 4107 C CA . ARG C 3 108 ? 70.195 72.137 20.365 1.00 50.07 ? 108 ARG L CA 1 ATOM 4108 C C . ARG C 3 108 ? 70.535 72.446 18.906 1.00 48.27 ? 108 ARG L C 1 ATOM 4109 O O . ARG C 3 108 ? 69.780 73.130 18.218 1.00 48.96 ? 108 ARG L O 1 ATOM 4110 C CB . ARG C 3 108 ? 70.291 70.628 20.611 1.00 47.81 ? 108 ARG L CB 1 ATOM 4111 C CG . ARG C 3 108 ? 69.399 69.783 19.716 1.00 44.91 ? 108 ARG L CG 1 ATOM 4112 C CD . ARG C 3 108 ? 70.002 68.405 19.502 1.00 41.41 ? 108 ARG L CD 1 ATOM 4113 N NE . ARG C 3 108 ? 71.166 68.461 18.623 1.00 43.94 ? 108 ARG L NE 1 ATOM 4114 C CZ . ARG C 3 108 ? 72.070 67.494 18.504 1.00 39.85 ? 108 ARG L CZ 1 ATOM 4115 N NH1 . ARG C 3 108 ? 71.963 66.384 19.220 1.00 39.26 ? 108 ARG L NH1 1 ATOM 4116 N NH2 . ARG C 3 108 ? 73.091 67.644 17.672 1.00 41.59 ? 108 ARG L NH2 1 ATOM 4117 N N . THR C 3 109 ? 71.675 71.937 18.444 1.00 48.54 ? 109 THR L N 1 ATOM 4118 C CA . THR C 3 109 ? 72.121 72.155 17.069 1.00 47.50 ? 109 THR L CA 1 ATOM 4119 C C . THR C 3 109 ? 71.349 71.289 16.074 1.00 45.86 ? 109 THR L C 1 ATOM 4120 O O . THR C 3 109 ? 70.828 70.232 16.428 1.00 47.50 ? 109 THR L O 1 ATOM 4121 C CB . THR C 3 109 ? 73.628 71.865 16.906 1.00 51.82 ? 109 THR L CB 1 ATOM 4122 O OG1 . THR C 3 109 ? 73.900 70.499 17.248 1.00 49.39 ? 109 THR L OG1 1 ATOM 4123 C CG2 . THR C 3 109 ? 74.453 72.781 17.794 1.00 52.11 ? 109 THR L CG2 1 ATOM 4124 N N . VAL C 3 110 ? 71.288 71.746 14.827 1.00 54.70 ? 110 VAL L N 1 ATOM 4125 C CA . VAL C 3 110 ? 70.591 71.033 13.762 1.00 51.94 ? 110 VAL L CA 1 ATOM 4126 C C . VAL C 3 110 ? 71.240 69.682 13.466 1.00 52.20 ? 110 VAL L C 1 ATOM 4127 O O . VAL C 3 110 ? 72.380 69.617 13.015 1.00 58.22 ? 110 VAL L O 1 ATOM 4128 C CB . VAL C 3 110 ? 70.558 71.866 12.465 1.00 54.45 ? 110 VAL L CB 1 ATOM 4129 C CG1 . VAL C 3 110 ? 69.898 71.081 11.343 1.00 58.91 ? 110 VAL L CG1 1 ATOM 4130 C CG2 . VAL C 3 110 ? 69.843 73.188 12.699 1.00 53.04 ? 110 VAL L CG2 1 ATOM 4131 N N . ALA C 3 111 ? 70.506 68.605 13.720 1.00 50.53 ? 111 ALA L N 1 ATOM 4132 C CA . ALA C 3 111 ? 71.037 67.261 13.516 1.00 48.29 ? 111 ALA L CA 1 ATOM 4133 C C . ALA C 3 111 ? 70.288 66.524 12.415 1.00 52.01 ? 111 ALA L C 1 ATOM 4134 O O . ALA C 3 111 ? 69.065 66.404 12.455 1.00 57.59 ? 111 ALA L O 1 ATOM 4135 C CB . ALA C 3 111 ? 70.981 66.469 14.812 1.00 47.52 ? 111 ALA L CB 1 ATOM 4136 N N . ALA C 3 112 ? 71.032 66.036 11.429 1.00 52.53 ? 112 ALA L N 1 ATOM 4137 C CA . ALA C 3 112 ? 70.448 65.282 10.328 1.00 51.37 ? 112 ALA L CA 1 ATOM 4138 C C . ALA C 3 112 ? 69.964 63.915 10.803 1.00 52.66 ? 112 ALA L C 1 ATOM 4139 O O . ALA C 3 112 ? 70.568 63.315 11.691 1.00 55.53 ? 112 ALA L O 1 ATOM 4140 C CB . ALA C 3 112 ? 71.456 65.127 9.204 1.00 52.38 ? 112 ALA L CB 1 ATOM 4141 N N . PRO C 3 113 ? 68.863 63.420 10.217 1.00 52.34 ? 113 PRO L N 1 ATOM 4142 C CA . PRO C 3 113 ? 68.329 62.104 10.581 1.00 51.99 ? 113 PRO L CA 1 ATOM 4143 C C . PRO C 3 113 ? 69.090 60.946 9.940 1.00 57.54 ? 113 PRO L C 1 ATOM 4144 O O . PRO C 3 113 ? 69.500 61.040 8.786 1.00 61.93 ? 113 PRO L O 1 ATOM 4145 C CB . PRO C 3 113 ? 66.895 62.157 10.049 1.00 47.45 ? 113 PRO L CB 1 ATOM 4146 C CG . PRO C 3 113 ? 66.985 63.057 8.869 1.00 47.07 ? 113 PRO L CG 1 ATOM 4147 C CD . PRO C 3 113 ? 68.005 64.107 9.234 1.00 52.82 ? 113 PRO L CD 1 ATOM 4148 N N . SER C 3 114 ? 69.280 59.868 10.693 1.00 42.89 ? 114 SER L N 1 ATOM 4149 C CA . SER C 3 114 ? 69.737 58.614 10.113 1.00 44.12 ? 114 SER L CA 1 ATOM 4150 C C . SER C 3 114 ? 68.517 57.875 9.578 1.00 45.45 ? 114 SER L C 1 ATOM 4151 O O . SER C 3 114 ? 67.662 57.441 10.351 1.00 42.69 ? 114 SER L O 1 ATOM 4152 C CB . SER C 3 114 ? 70.475 57.757 11.143 1.00 48.12 ? 114 SER L CB 1 ATOM 4153 O OG . SER C 3 114 ? 71.597 58.438 11.669 1.00 54.32 ? 114 SER L OG 1 ATOM 4154 N N . VAL C 3 115 ? 68.430 57.739 8.259 1.00 44.83 ? 115 VAL L N 1 ATOM 4155 C CA . VAL C 3 115 ? 67.249 57.151 7.636 1.00 44.28 ? 115 VAL L CA 1 ATOM 4156 C C . VAL C 3 115 ? 67.448 55.676 7.297 1.00 47.48 ? 115 VAL L C 1 ATOM 4157 O O . VAL C 3 115 ? 68.318 55.322 6.497 1.00 43.67 ? 115 VAL L O 1 ATOM 4158 C CB . VAL C 3 115 ? 66.863 57.911 6.359 1.00 41.71 ? 115 VAL L CB 1 ATOM 4159 C CG1 . VAL C 3 115 ? 65.547 57.387 5.808 1.00 39.70 ? 115 VAL L CG1 1 ATOM 4160 C CG2 . VAL C 3 115 ? 66.768 59.402 6.647 1.00 41.24 ? 115 VAL L CG2 1 ATOM 4161 N N . PHE C 3 116 ? 66.633 54.822 7.913 1.00 47.57 ? 116 PHE L N 1 ATOM 4162 C CA . PHE C 3 116 ? 66.650 53.386 7.641 1.00 42.11 ? 116 PHE L CA 1 ATOM 4163 C C . PHE C 3 116 ? 65.281 52.924 7.160 1.00 42.48 ? 116 PHE L C 1 ATOM 4164 O O . PHE C 3 116 ? 64.266 53.571 7.437 1.00 44.67 ? 116 PHE L O 1 ATOM 4165 C CB . PHE C 3 116 ? 67.052 52.595 8.888 1.00 43.01 ? 116 PHE L CB 1 ATOM 4166 C CG . PHE C 3 116 ? 68.258 53.141 9.589 1.00 46.04 ? 116 PHE L CG 1 ATOM 4167 C CD1 . PHE C 3 116 ? 69.524 52.962 9.057 1.00 51.32 ? 116 PHE L CD1 1 ATOM 4168 C CD2 . PHE C 3 116 ? 68.128 53.833 10.781 1.00 45.39 ? 116 PHE L CD2 1 ATOM 4169 C CE1 . PHE C 3 116 ? 70.638 53.466 9.699 1.00 52.20 ? 116 PHE L CE1 1 ATOM 4170 C CE2 . PHE C 3 116 ? 69.238 54.339 11.429 1.00 46.74 ? 116 PHE L CE2 1 ATOM 4171 C CZ . PHE C 3 116 ? 70.493 54.155 10.888 1.00 47.88 ? 116 PHE L CZ 1 ATOM 4172 N N . ILE C 3 117 ? 65.250 51.804 6.445 1.00 41.23 ? 117 ILE L N 1 ATOM 4173 C CA . ILE C 3 117 ? 63.992 51.260 5.953 1.00 43.90 ? 117 ILE L CA 1 ATOM 4174 C C . ILE C 3 117 ? 63.910 49.757 6.235 1.00 50.34 ? 117 ILE L C 1 ATOM 4175 O O . ILE C 3 117 ? 64.918 49.046 6.187 1.00 49.51 ? 117 ILE L O 1 ATOM 4176 C CB . ILE C 3 117 ? 63.814 51.543 4.439 1.00 39.45 ? 117 ILE L CB 1 ATOM 4177 C CG1 . ILE C 3 117 ? 62.374 51.266 4.000 1.00 41.58 ? 117 ILE L CG1 1 ATOM 4178 C CG2 . ILE C 3 117 ? 64.822 50.751 3.604 1.00 37.59 ? 117 ILE L CG2 1 ATOM 4179 C CD1 . ILE C 3 117 ? 62.101 51.616 2.552 1.00 42.02 ? 117 ILE L CD1 1 ATOM 4180 N N . PHE C 3 118 ? 62.709 49.284 6.555 1.00 50.64 ? 118 PHE L N 1 ATOM 4181 C CA . PHE C 3 118 ? 62.498 47.877 6.877 1.00 36.40 ? 118 PHE L CA 1 ATOM 4182 C C . PHE C 3 118 ? 61.421 47.260 5.991 1.00 39.19 ? 118 PHE L C 1 ATOM 4183 O O . PHE C 3 118 ? 60.270 47.692 6.013 1.00 37.16 ? 118 PHE L O 1 ATOM 4184 C CB . PHE C 3 118 ? 62.110 47.710 8.347 1.00 36.04 ? 118 PHE L CB 1 ATOM 4185 C CG . PHE C 3 118 ? 63.123 48.256 9.313 1.00 44.73 ? 118 PHE L CG 1 ATOM 4186 C CD1 . PHE C 3 118 ? 64.139 47.449 9.801 1.00 49.05 ? 118 PHE L CD1 1 ATOM 4187 C CD2 . PHE C 3 118 ? 63.054 49.572 9.741 1.00 39.44 ? 118 PHE L CD2 1 ATOM 4188 C CE1 . PHE C 3 118 ? 65.071 47.948 10.694 1.00 45.45 ? 118 PHE L CE1 1 ATOM 4189 C CE2 . PHE C 3 118 ? 63.982 50.075 10.631 1.00 40.99 ? 118 PHE L CE2 1 ATOM 4190 C CZ . PHE C 3 118 ? 64.992 49.261 11.108 1.00 42.74 ? 118 PHE L CZ 1 ATOM 4191 N N . PRO C 3 119 ? 61.797 46.250 5.196 1.00 39.54 ? 119 PRO L N 1 ATOM 4192 C CA . PRO C 3 119 ? 60.820 45.488 4.414 1.00 45.15 ? 119 PRO L CA 1 ATOM 4193 C C . PRO C 3 119 ? 59.896 44.686 5.324 1.00 48.46 ? 119 PRO L C 1 ATOM 4194 O O . PRO C 3 119 ? 60.271 44.396 6.458 1.00 41.16 ? 119 PRO L O 1 ATOM 4195 C CB . PRO C 3 119 ? 61.696 44.564 3.558 1.00 43.66 ? 119 PRO L CB 1 ATOM 4196 C CG . PRO C 3 119 ? 63.028 45.230 3.521 1.00 51.37 ? 119 PRO L CG 1 ATOM 4197 C CD . PRO C 3 119 ? 63.179 45.869 4.865 1.00 45.92 ? 119 PRO L CD 1 ATOM 4198 N N . PRO C 3 120 ? 58.697 44.334 4.837 1.00 51.35 ? 120 PRO L N 1 ATOM 4199 C CA . PRO C 3 120 ? 57.771 43.550 5.660 1.00 42.64 ? 120 PRO L CA 1 ATOM 4200 C C . PRO C 3 120 ? 58.315 42.158 5.954 1.00 44.71 ? 120 PRO L C 1 ATOM 4201 O O . PRO C 3 120 ? 58.918 41.535 5.084 1.00 46.99 ? 120 PRO L O 1 ATOM 4202 C CB . PRO C 3 120 ? 56.506 43.480 4.799 1.00 43.47 ? 120 PRO L CB 1 ATOM 4203 C CG . PRO C 3 120 ? 56.990 43.673 3.402 1.00 54.22 ? 120 PRO L CG 1 ATOM 4204 C CD . PRO C 3 120 ? 58.145 44.622 3.502 1.00 42.95 ? 120 PRO L CD 1 ATOM 4205 N N . SER C 3 121 ? 58.109 41.687 7.178 1.00 49.08 ? 121 SER L N 1 ATOM 4206 C CA . SER C 3 121 ? 58.548 40.356 7.567 1.00 55.41 ? 121 SER L CA 1 ATOM 4207 C C . SER C 3 121 ? 57.766 39.293 6.804 1.00 64.17 ? 121 SER L C 1 ATOM 4208 O O . SER C 3 121 ? 56.632 39.529 6.389 1.00 67.28 ? 121 SER L O 1 ATOM 4209 C CB . SER C 3 121 ? 58.381 40.153 9.073 1.00 51.44 ? 121 SER L CB 1 ATOM 4210 O OG . SER C 3 121 ? 57.024 40.286 9.453 1.00 49.64 ? 121 SER L OG 1 ATOM 4211 N N . ASP C 3 122 ? 58.378 38.128 6.618 1.00 68.49 ? 122 ASP L N 1 ATOM 4212 C CA . ASP C 3 122 ? 57.703 37.006 5.975 1.00 73.93 ? 122 ASP L CA 1 ATOM 4213 C C . ASP C 3 122 ? 56.523 36.537 6.821 1.00 72.79 ? 122 ASP L C 1 ATOM 4214 O O . ASP C 3 122 ? 55.543 36.011 6.299 1.00 72.75 ? 122 ASP L O 1 ATOM 4215 C CB . ASP C 3 122 ? 58.678 35.850 5.737 1.00 86.18 ? 122 ASP L CB 1 ATOM 4216 C CG . ASP C 3 122 ? 59.716 36.166 4.674 1.00 94.20 ? 122 ASP L CG 1 ATOM 4217 O OD1 . ASP C 3 122 ? 60.913 35.893 4.906 1.00 99.87 ? 122 ASP L OD1 1 ATOM 4218 O OD2 . ASP C 3 122 ? 59.334 36.682 3.602 1.00 94.80 ? 122 ASP L OD2 1 ATOM 4219 N N . GLU C 3 123 ? 56.627 36.736 8.131 1.00 72.25 ? 123 GLU L N 1 ATOM 4220 C CA . GLU C 3 123 ? 55.562 36.373 9.060 1.00 69.41 ? 123 GLU L CA 1 ATOM 4221 C C . GLU C 3 123 ? 54.284 37.155 8.765 1.00 64.62 ? 123 GLU L C 1 ATOM 4222 O O . GLU C 3 123 ? 53.183 36.609 8.827 1.00 63.39 ? 123 GLU L O 1 ATOM 4223 C CB . GLU C 3 123 ? 56.010 36.615 10.505 1.00 68.62 ? 123 GLU L CB 1 ATOM 4224 C CG . GLU C 3 123 ? 54.969 36.263 11.557 1.00 71.06 ? 123 GLU L CG 1 ATOM 4225 C CD . GLU C 3 123 ? 55.455 36.529 12.971 1.00 80.66 ? 123 GLU L CD 1 ATOM 4226 O OE1 . GLU C 3 123 ? 56.670 36.763 13.149 1.00 82.79 ? 123 GLU L OE1 1 ATOM 4227 O OE2 . GLU C 3 123 ? 54.624 36.506 13.905 1.00 86.51 ? 123 GLU L OE2 1 ATOM 4228 N N . GLN C 3 124 ? 54.438 38.435 8.439 1.00 63.54 ? 124 GLN L N 1 ATOM 4229 C CA . GLN C 3 124 ? 53.295 39.288 8.138 1.00 62.81 ? 124 GLN L CA 1 ATOM 4230 C C . GLN C 3 124 ? 52.788 39.053 6.721 1.00 67.07 ? 124 GLN L C 1 ATOM 4231 O O . GLN C 3 124 ? 51.580 39.075 6.478 1.00 71.64 ? 124 GLN L O 1 ATOM 4232 C CB . GLN C 3 124 ? 53.654 40.764 8.320 1.00 59.02 ? 124 GLN L CB 1 ATOM 4233 C CG . GLN C 3 124 ? 52.469 41.707 8.143 1.00 56.33 ? 124 GLN L CG 1 ATOM 4234 C CD . GLN C 3 124 ? 52.868 43.169 8.182 1.00 53.85 ? 124 GLN L CD 1 ATOM 4235 O OE1 . GLN C 3 124 ? 53.987 43.531 7.820 1.00 50.57 ? 124 GLN L OE1 1 ATOM 4236 N NE2 . GLN C 3 124 ? 51.949 44.019 8.624 1.00 55.83 ? 124 GLN L NE2 1 ATOM 4237 N N . LEU C 3 125 ? 53.712 38.832 5.790 1.00 65.82 ? 125 LEU L N 1 ATOM 4238 C CA . LEU C 3 125 ? 53.351 38.623 4.392 1.00 66.48 ? 125 LEU L CA 1 ATOM 4239 C C . LEU C 3 125 ? 52.407 37.436 4.231 1.00 69.26 ? 125 LEU L C 1 ATOM 4240 O O . LEU C 3 125 ? 51.516 37.455 3.385 1.00 71.50 ? 125 LEU L O 1 ATOM 4241 C CB . LEU C 3 125 ? 54.603 38.419 3.534 1.00 66.89 ? 125 LEU L CB 1 ATOM 4242 C CG . LEU C 3 125 ? 55.470 39.655 3.274 1.00 64.47 ? 125 LEU L CG 1 ATOM 4243 C CD1 . LEU C 3 125 ? 56.691 39.303 2.434 1.00 58.45 ? 125 LEU L CD1 1 ATOM 4244 C CD2 . LEU C 3 125 ? 54.655 40.743 2.599 1.00 65.99 ? 125 LEU L CD2 1 ATOM 4245 N N . LYS C 3 126 ? 52.590 36.412 5.057 1.00 72.71 ? 126 LYS L N 1 ATOM 4246 C CA . LYS C 3 126 ? 51.771 35.211 4.953 1.00 76.97 ? 126 LYS L CA 1 ATOM 4247 C C . LYS C 3 126 ? 50.456 35.365 5.714 1.00 75.31 ? 126 LYS L C 1 ATOM 4248 O O . LYS C 3 126 ? 49.635 34.447 5.743 1.00 76.43 ? 126 LYS L O 1 ATOM 4249 C CB . LYS C 3 126 ? 52.546 33.989 5.456 1.00 83.78 ? 126 LYS L CB 1 ATOM 4250 C CG . LYS C 3 126 ? 53.898 33.802 4.775 1.00 91.87 ? 126 LYS L CG 1 ATOM 4251 C CD . LYS C 3 126 ? 53.810 34.020 3.265 1.00 94.14 ? 126 LYS L CD 1 ATOM 4252 C CE . LYS C 3 126 ? 55.178 34.323 2.667 1.00 91.69 ? 126 LYS L CE 1 ATOM 4253 N NZ . LYS C 3 126 ? 55.085 34.780 1.252 1.00 89.69 ? 126 LYS L NZ 1 ATOM 4254 N N . SER C 3 127 ? 50.259 36.532 6.321 1.00 71.27 ? 127 SER L N 1 ATOM 4255 C CA . SER C 3 127 ? 48.996 36.855 6.970 1.00 64.48 ? 127 SER L CA 1 ATOM 4256 C C . SER C 3 127 ? 48.086 37.622 6.016 1.00 62.39 ? 127 SER L C 1 ATOM 4257 O O . SER C 3 127 ? 46.907 37.829 6.298 1.00 61.77 ? 127 SER L O 1 ATOM 4258 C CB . SER C 3 127 ? 49.231 37.671 8.238 1.00 64.24 ? 127 SER L CB 1 ATOM 4259 O OG . SER C 3 127 ? 49.834 38.917 7.932 1.00 65.84 ? 127 SER L OG 1 ATOM 4260 N N . GLY C 3 128 ? 48.648 38.049 4.888 1.00 64.80 ? 128 GLY L N 1 ATOM 4261 C CA . GLY C 3 128 ? 47.890 38.758 3.872 1.00 66.76 ? 128 GLY L CA 1 ATOM 4262 C C . GLY C 3 128 ? 48.194 40.244 3.781 1.00 64.74 ? 128 GLY L C 1 ATOM 4263 O O . GLY C 3 128 ? 47.706 40.926 2.880 1.00 64.47 ? 128 GLY L O 1 ATOM 4264 N N . THR C 3 129 ? 49.007 40.748 4.705 1.00 60.70 ? 129 THR L N 1 ATOM 4265 C CA . THR C 3 129 ? 49.287 42.178 4.774 1.00 55.68 ? 129 THR L CA 1 ATOM 4266 C C . THR C 3 129 ? 50.789 42.459 4.671 1.00 55.05 ? 129 THR L C 1 ATOM 4267 O O . THR C 3 129 ? 51.613 41.633 5.059 1.00 58.33 ? 129 THR L O 1 ATOM 4268 C CB . THR C 3 129 ? 48.726 42.782 6.082 1.00 59.75 ? 129 THR L CB 1 ATOM 4269 O OG1 . THR C 3 129 ? 47.388 42.310 6.289 1.00 68.11 ? 129 THR L OG1 1 ATOM 4270 C CG2 . THR C 3 129 ? 48.713 44.302 6.025 1.00 55.66 ? 129 THR L CG2 1 ATOM 4271 N N . ALA C 3 130 ? 51.139 43.623 4.131 1.00 50.92 ? 130 ALA L N 1 ATOM 4272 C CA . ALA C 3 130 ? 52.537 44.023 4.012 1.00 51.15 ? 130 ALA L CA 1 ATOM 4273 C C . ALA C 3 130 ? 52.761 45.417 4.591 1.00 47.40 ? 130 ALA L C 1 ATOM 4274 O O . ALA C 3 130 ? 52.144 46.390 4.156 1.00 45.64 ? 130 ALA L O 1 ATOM 4275 C CB . ALA C 3 130 ? 52.982 43.979 2.561 1.00 52.62 ? 130 ALA L CB 1 ATOM 4276 N N . SER C 3 131 ? 53.647 45.506 5.577 1.00 45.93 ? 131 SER L N 1 ATOM 4277 C CA . SER C 3 131 ? 53.964 46.785 6.197 1.00 45.34 ? 131 SER L CA 1 ATOM 4278 C C . SER C 3 131 ? 55.441 47.121 6.033 1.00 46.30 ? 131 SER L C 1 ATOM 4279 O O . SER C 3 131 ? 56.314 46.359 6.450 1.00 50.20 ? 131 SER L O 1 ATOM 4280 C CB . SER C 3 131 ? 53.590 46.776 7.681 1.00 47.57 ? 131 SER L CB 1 ATOM 4281 O OG . SER C 3 131 ? 52.188 46.664 7.854 1.00 50.54 ? 131 SER L OG 1 ATOM 4282 N N . VAL C 3 132 ? 55.714 48.263 5.417 1.00 41.21 ? 132 VAL L N 1 ATOM 4283 C CA . VAL C 3 132 ? 57.081 48.738 5.278 1.00 44.98 ? 132 VAL L CA 1 ATOM 4284 C C . VAL C 3 132 ? 57.302 49.907 6.229 1.00 44.52 ? 132 VAL L C 1 ATOM 4285 O O . VAL C 3 132 ? 56.522 50.865 6.238 1.00 37.37 ? 132 VAL L O 1 ATOM 4286 C CB . VAL C 3 132 ? 57.394 49.169 3.835 1.00 49.84 ? 132 VAL L CB 1 ATOM 4287 C CG1 . VAL C 3 132 ? 58.865 49.531 3.701 1.00 51.07 ? 132 VAL L CG1 1 ATOM 4288 C CG2 . VAL C 3 132 ? 57.026 48.059 2.862 1.00 54.15 ? 132 VAL L CG2 1 ATOM 4289 N N . VAL C 3 133 ? 58.359 49.820 7.034 1.00 41.65 ? 133 VAL L N 1 ATOM 4290 C CA . VAL C 3 133 ? 58.640 50.849 8.027 1.00 42.91 ? 133 VAL L CA 1 ATOM 4291 C C . VAL C 3 133 ? 59.874 51.672 7.663 1.00 46.81 ? 133 VAL L C 1 ATOM 4292 O O . VAL C 3 133 ? 60.934 51.126 7.347 1.00 52.40 ? 133 VAL L O 1 ATOM 4293 C CB . VAL C 3 133 ? 58.843 50.243 9.425 1.00 41.50 ? 133 VAL L CB 1 ATOM 4294 C CG1 . VAL C 3 133 ? 59.040 51.346 10.453 1.00 37.46 ? 133 VAL L CG1 1 ATOM 4295 C CG2 . VAL C 3 133 ? 57.655 49.371 9.802 1.00 43.93 ? 133 VAL L CG2 1 ATOM 4296 N N . CYS C 3 134 ? 59.718 52.990 7.707 1.00 44.96 ? 134 CYS L N 1 ATOM 4297 C CA . CYS C 3 134 ? 60.811 53.923 7.460 1.00 43.76 ? 134 CYS L CA 1 ATOM 4298 C C . CYS C 3 134 ? 61.165 54.633 8.769 1.00 41.58 ? 134 CYS L C 1 ATOM 4299 O O . CYS C 3 134 ? 60.297 55.219 9.412 1.00 36.84 ? 134 CYS L O 1 ATOM 4300 C CB . CYS C 3 134 ? 60.414 54.929 6.376 1.00 36.34 ? 134 CYS L CB 1 ATOM 4301 S SG . CYS C 3 134 ? 61.702 56.087 5.864 1.00 43.31 ? 134 CYS L SG 1 ATOM 4302 N N . LEU C 3 135 ? 62.431 54.569 9.170 1.00 42.04 ? 135 LEU L N 1 ATOM 4303 C CA . LEU C 3 135 ? 62.856 55.150 10.445 1.00 35.71 ? 135 LEU L CA 1 ATOM 4304 C C . LEU C 3 135 ? 63.777 56.353 10.271 1.00 35.01 ? 135 LEU L C 1 ATOM 4305 O O . LEU C 3 135 ? 64.827 56.264 9.635 1.00 36.11 ? 135 LEU L O 1 ATOM 4306 C CB . LEU C 3 135 ? 63.557 54.097 11.308 1.00 35.56 ? 135 LEU L CB 1 ATOM 4307 C CG . LEU C 3 135 ? 64.299 54.620 12.545 1.00 35.66 ? 135 LEU L CG 1 ATOM 4308 C CD1 . LEU C 3 135 ? 63.336 55.250 13.535 1.00 29.97 ? 135 LEU L CD1 1 ATOM 4309 C CD2 . LEU C 3 135 ? 65.111 53.516 13.211 1.00 34.46 ? 135 LEU L CD2 1 ATOM 4310 N N . LEU C 3 136 ? 63.367 57.478 10.847 1.00 33.54 ? 136 LEU L N 1 ATOM 4311 C CA . LEU C 3 136 ? 64.202 58.670 10.915 1.00 34.90 ? 136 LEU L CA 1 ATOM 4312 C C . LEU C 3 136 ? 64.719 58.800 12.338 1.00 39.35 ? 136 LEU L C 1 ATOM 4313 O O . LEU C 3 136 ? 63.968 59.158 13.246 1.00 44.51 ? 136 LEU L O 1 ATOM 4314 C CB . LEU C 3 136 ? 63.422 59.926 10.517 1.00 34.16 ? 136 LEU L CB 1 ATOM 4315 C CG . LEU C 3 136 ? 63.135 60.227 9.044 1.00 40.20 ? 136 LEU L CG 1 ATOM 4316 C CD1 . LEU C 3 136 ? 62.341 59.115 8.369 1.00 41.93 ? 136 LEU L CD1 1 ATOM 4317 C CD2 . LEU C 3 136 ? 62.391 61.548 8.938 1.00 40.73 ? 136 LEU L CD2 1 ATOM 4318 N N . ASN C 3 137 ? 65.999 58.511 12.533 1.00 40.67 ? 137 ASN L N 1 ATOM 4319 C CA . ASN C 3 137 ? 66.544 58.389 13.879 1.00 40.84 ? 137 ASN L CA 1 ATOM 4320 C C . ASN C 3 137 ? 67.390 59.579 14.328 1.00 43.23 ? 137 ASN L C 1 ATOM 4321 O O . ASN C 3 137 ? 68.319 59.993 13.631 1.00 41.99 ? 137 ASN L O 1 ATOM 4322 C CB . ASN C 3 137 ? 67.375 57.110 13.976 1.00 44.93 ? 137 ASN L CB 1 ATOM 4323 C CG . ASN C 3 137 ? 67.530 56.626 15.399 1.00 54.88 ? 137 ASN L CG 1 ATOM 4324 O OD1 . ASN C 3 137 ? 66.592 56.692 16.192 1.00 58.07 ? 137 ASN L OD1 1 ATOM 4325 N ND2 . ASN C 3 137 ? 68.723 56.145 15.736 1.00 60.42 ? 137 ASN L ND2 1 ATOM 4326 N N . ASN C 3 138 ? 67.045 60.119 15.497 1.00 44.54 ? 138 ASN L N 1 ATOM 4327 C CA . ASN C 3 138 ? 67.840 61.136 16.191 1.00 42.68 ? 138 ASN L CA 1 ATOM 4328 C C . ASN C 3 138 ? 68.151 62.386 15.372 1.00 38.82 ? 138 ASN L C 1 ATOM 4329 O O . ASN C 3 138 ? 69.300 62.634 15.012 1.00 39.14 ? 138 ASN L O 1 ATOM 4330 C CB . ASN C 3 138 ? 69.147 60.517 16.687 1.00 47.58 ? 138 ASN L CB 1 ATOM 4331 C CG . ASN C 3 138 ? 68.915 59.320 17.589 1.00 58.48 ? 138 ASN L CG 1 ATOM 4332 O OD1 . ASN C 3 138 ? 67.909 59.248 18.296 1.00 57.50 ? 138 ASN L OD1 1 ATOM 4333 N ND2 . ASN C 3 138 ? 69.843 58.370 17.565 1.00 68.36 ? 138 ASN L ND2 1 ATOM 4334 N N . PHE C 3 139 ? 67.118 63.178 15.100 1.00 40.60 ? 139 PHE L N 1 ATOM 4335 C CA . PHE C 3 139 ? 67.269 64.414 14.340 1.00 35.79 ? 139 PHE L CA 1 ATOM 4336 C C . PHE C 3 139 ? 66.752 65.622 15.117 1.00 35.21 ? 139 PHE L C 1 ATOM 4337 O O . PHE C 3 139 ? 66.032 65.479 16.106 1.00 35.34 ? 139 PHE L O 1 ATOM 4338 C CB . PHE C 3 139 ? 66.543 64.308 12.995 1.00 34.32 ? 139 PHE L CB 1 ATOM 4339 C CG . PHE C 3 139 ? 65.082 63.961 13.115 1.00 34.52 ? 139 PHE L CG 1 ATOM 4340 C CD1 . PHE C 3 139 ? 64.668 62.637 13.106 1.00 34.03 ? 139 PHE L CD1 1 ATOM 4341 C CD2 . PHE C 3 139 ? 64.125 64.957 13.232 1.00 34.63 ? 139 PHE L CD2 1 ATOM 4342 C CE1 . PHE C 3 139 ? 63.326 62.312 13.215 1.00 36.03 ? 139 PHE L CE1 1 ATOM 4343 C CE2 . PHE C 3 139 ? 62.782 64.640 13.343 1.00 39.55 ? 139 PHE L CE2 1 ATOM 4344 C CZ . PHE C 3 139 ? 62.382 63.315 13.334 1.00 38.16 ? 139 PHE L CZ 1 ATOM 4345 N N . TYR C 3 140 ? 67.132 66.809 14.656 1.00 35.44 ? 140 TYR L N 1 ATOM 4346 C CA . TYR C 3 140 ? 66.657 68.063 15.229 1.00 34.03 ? 140 TYR L CA 1 ATOM 4347 C C . TYR C 3 140 ? 66.766 69.172 14.186 1.00 41.04 ? 140 TYR L C 1 ATOM 4348 O O . TYR C 3 140 ? 67.786 69.280 13.504 1.00 47.58 ? 140 TYR L O 1 ATOM 4349 C CB . TYR C 3 140 ? 67.448 68.433 16.488 1.00 37.91 ? 140 TYR L CB 1 ATOM 4350 C CG . TYR C 3 140 ? 66.912 69.668 17.183 1.00 38.77 ? 140 TYR L CG 1 ATOM 4351 C CD1 . TYR C 3 140 ? 65.918 69.567 18.148 1.00 36.45 ? 140 TYR L CD1 1 ATOM 4352 C CD2 . TYR C 3 140 ? 67.381 70.937 16.854 1.00 37.13 ? 140 TYR L CD2 1 ATOM 4353 C CE1 . TYR C 3 140 ? 65.414 70.689 18.773 1.00 36.13 ? 140 TYR L CE1 1 ATOM 4354 C CE2 . TYR C 3 140 ? 66.880 72.065 17.475 1.00 39.29 ? 140 TYR L CE2 1 ATOM 4355 C CZ . TYR C 3 140 ? 65.898 71.936 18.434 1.00 38.65 ? 140 TYR L CZ 1 ATOM 4356 O OH . TYR C 3 140 ? 65.397 73.057 19.056 1.00 41.69 ? 140 TYR L OH 1 ATOM 4357 N N . PRO C 3 141 ? 65.727 70.018 14.068 1.00 42.74 ? 141 PRO L N 1 ATOM 4358 C CA . PRO C 3 141 ? 64.494 70.035 14.866 1.00 38.81 ? 141 PRO L CA 1 ATOM 4359 C C . PRO C 3 141 ? 63.515 68.936 14.467 1.00 38.32 ? 141 PRO L C 1 ATOM 4360 O O . PRO C 3 141 ? 63.833 68.128 13.597 1.00 38.86 ? 141 PRO L O 1 ATOM 4361 C CB . PRO C 3 141 ? 63.914 71.417 14.570 1.00 39.58 ? 141 PRO L CB 1 ATOM 4362 C CG . PRO C 3 141 ? 64.391 71.725 13.199 1.00 41.70 ? 141 PRO L CG 1 ATOM 4363 C CD . PRO C 3 141 ? 65.760 71.120 13.089 1.00 40.41 ? 141 PRO L CD 1 ATOM 4364 N N . ARG C 3 142 ? 62.344 68.901 15.095 1.00 43.29 ? 142 ARG L N 1 ATOM 4365 C CA . ARG C 3 142 ? 61.431 67.782 14.884 1.00 46.80 ? 142 ARG L CA 1 ATOM 4366 C C . ARG C 3 142 ? 60.650 67.890 13.578 1.00 44.63 ? 142 ARG L C 1 ATOM 4367 O O . ARG C 3 142 ? 60.118 66.895 13.092 1.00 43.16 ? 142 ARG L O 1 ATOM 4368 C CB . ARG C 3 142 ? 60.459 67.647 16.057 1.00 47.05 ? 142 ARG L CB 1 ATOM 4369 C CG . ARG C 3 142 ? 59.498 68.795 16.230 1.00 52.96 ? 142 ARG L CG 1 ATOM 4370 C CD . ARG C 3 142 ? 58.358 68.377 17.138 1.00 62.04 ? 142 ARG L CD 1 ATOM 4371 N NE . ARG C 3 142 ? 57.533 67.342 16.522 1.00 66.12 ? 142 ARG L NE 1 ATOM 4372 C CZ . ARG C 3 142 ? 56.481 66.777 17.106 1.00 69.85 ? 142 ARG L CZ 1 ATOM 4373 N NH1 . ARG C 3 142 ? 56.128 67.141 18.331 1.00 81.35 ? 142 ARG L NH1 1 ATOM 4374 N NH2 . ARG C 3 142 ? 55.784 65.847 16.468 1.00 61.76 ? 142 ARG L NH2 1 ATOM 4375 N N . GLU C 3 143 ? 60.585 69.088 13.008 1.00 44.20 ? 143 GLU L N 1 ATOM 4376 C CA . GLU C 3 143 ? 59.903 69.270 11.731 1.00 49.94 ? 143 GLU L CA 1 ATOM 4377 C C . GLU C 3 143 ? 60.596 68.463 10.633 1.00 49.93 ? 143 GLU L C 1 ATOM 4378 O O . GLU C 3 143 ? 61.778 68.659 10.348 1.00 48.52 ? 143 GLU L O 1 ATOM 4379 C CB . GLU C 3 143 ? 59.841 70.752 11.350 1.00 56.53 ? 143 GLU L CB 1 ATOM 4380 C CG . GLU C 3 143 ? 58.950 71.596 12.255 1.00 66.43 ? 143 GLU L CG 1 ATOM 4381 C CD . GLU C 3 143 ? 59.607 71.940 13.580 1.00 71.95 ? 143 GLU L CD 1 ATOM 4382 O OE1 . GLU C 3 143 ? 60.849 71.861 13.668 1.00 63.39 ? 143 GLU L OE1 1 ATOM 4383 O OE2 . GLU C 3 143 ? 58.881 72.292 14.535 1.00 81.15 ? 143 GLU L OE2 1 ATOM 4384 N N . ALA C 3 144 ? 59.851 67.542 10.032 1.00 48.37 ? 144 ALA L N 1 ATOM 4385 C CA . ALA C 3 144 ? 60.392 66.660 9.006 1.00 46.46 ? 144 ALA L CA 1 ATOM 4386 C C . ALA C 3 144 ? 59.282 66.152 8.097 1.00 49.15 ? 144 ALA L C 1 ATOM 4387 O O . ALA C 3 144 ? 58.153 65.960 8.541 1.00 52.85 ? 144 ALA L O 1 ATOM 4388 C CB . ALA C 3 144 ? 61.131 65.492 9.647 1.00 38.64 ? 144 ALA L CB 1 ATOM 4389 N N . LYS C 3 145 ? 59.602 65.938 6.824 1.00 50.59 ? 145 LYS L N 1 ATOM 4390 C CA . LYS C 3 145 ? 58.626 65.414 5.875 1.00 50.78 ? 145 LYS L CA 1 ATOM 4391 C C . LYS C 3 145 ? 59.046 64.049 5.342 1.00 50.76 ? 145 LYS L C 1 ATOM 4392 O O . LYS C 3 145 ? 60.168 63.873 4.865 1.00 47.07 ? 145 LYS L O 1 ATOM 4393 C CB . LYS C 3 145 ? 58.420 66.387 4.709 1.00 52.03 ? 145 LYS L CB 1 ATOM 4394 C CG . LYS C 3 145 ? 57.404 65.904 3.678 1.00 51.14 ? 145 LYS L CG 1 ATOM 4395 C CD . LYS C 3 145 ? 57.208 66.913 2.552 1.00 58.93 ? 145 LYS L CD 1 ATOM 4396 C CE . LYS C 3 145 ? 58.466 67.064 1.712 1.00 62.67 ? 145 LYS L CE 1 ATOM 4397 N NZ . LYS C 3 145 ? 58.284 68.031 0.593 1.00 64.56 ? 145 LYS L NZ 1 ATOM 4398 N N . VAL C 3 146 ? 58.135 63.085 5.433 1.00 54.21 ? 146 VAL L N 1 ATOM 4399 C CA . VAL C 3 146 ? 58.359 61.758 4.880 1.00 53.06 ? 146 VAL L CA 1 ATOM 4400 C C . VAL C 3 146 ? 57.333 61.472 3.793 1.00 54.97 ? 146 VAL L C 1 ATOM 4401 O O . VAL C 3 146 ? 56.138 61.700 3.981 1.00 60.33 ? 146 VAL L O 1 ATOM 4402 C CB . VAL C 3 146 ? 58.276 60.667 5.961 1.00 52.79 ? 146 VAL L CB 1 ATOM 4403 C CG1 . VAL C 3 146 ? 58.538 59.295 5.356 1.00 51.98 ? 146 VAL L CG1 1 ATOM 4404 C CG2 . VAL C 3 146 ? 59.262 60.954 7.077 1.00 58.99 ? 146 VAL L CG2 1 ATOM 4405 N N . GLN C 3 147 ? 57.801 60.984 2.651 1.00 53.00 ? 147 GLN L N 1 ATOM 4406 C CA . GLN C 3 147 ? 56.905 60.624 1.563 1.00 52.35 ? 147 GLN L CA 1 ATOM 4407 C C . GLN C 3 147 ? 57.264 59.267 0.978 1.00 51.78 ? 147 GLN L C 1 ATOM 4408 O O . GLN C 3 147 ? 58.423 58.999 0.664 1.00 53.47 ? 147 GLN L O 1 ATOM 4409 C CB . GLN C 3 147 ? 56.926 61.695 0.472 1.00 59.35 ? 147 GLN L CB 1 ATOM 4410 C CG . GLN C 3 147 ? 56.138 62.942 0.834 1.00 69.58 ? 147 GLN L CG 1 ATOM 4411 C CD . GLN C 3 147 ? 56.117 63.965 -0.280 1.00 80.54 ? 147 GLN L CD 1 ATOM 4412 O OE1 . GLN C 3 147 ? 57.066 64.077 -1.055 1.00 87.58 ? 147 GLN L OE1 1 ATOM 4413 N NE2 . GLN C 3 147 ? 55.027 64.718 -0.369 1.00 82.55 ? 147 GLN L NE2 1 ATOM 4414 N N . TRP C 3 148 ? 56.257 58.413 0.842 1.00 52.12 ? 148 TRP L N 1 ATOM 4415 C CA . TRP C 3 148 ? 56.443 57.090 0.263 1.00 47.52 ? 148 TRP L CA 1 ATOM 4416 C C . TRP C 3 148 ? 56.248 57.111 -1.246 1.00 46.40 ? 148 TRP L C 1 ATOM 4417 O O . TRP C 3 148 ? 55.325 57.748 -1.755 1.00 50.23 ? 148 TRP L O 1 ATOM 4418 C CB . TRP C 3 148 ? 55.477 56.087 0.892 1.00 43.01 ? 148 TRP L CB 1 ATOM 4419 C CG . TRP C 3 148 ? 55.762 55.787 2.326 1.00 38.25 ? 148 TRP L CG 1 ATOM 4420 C CD1 . TRP C 3 148 ? 55.241 56.420 3.415 1.00 35.19 ? 148 TRP L CD1 1 ATOM 4421 C CD2 . TRP C 3 148 ? 56.630 54.768 2.831 1.00 37.81 ? 148 TRP L CD2 1 ATOM 4422 N NE1 . TRP C 3 148 ? 55.732 55.861 4.567 1.00 34.24 ? 148 TRP L NE1 1 ATOM 4423 C CE2 . TRP C 3 148 ? 56.587 54.843 4.236 1.00 37.34 ? 148 TRP L CE2 1 ATOM 4424 C CE3 . TRP C 3 148 ? 57.440 53.799 2.231 1.00 42.87 ? 148 TRP L CE3 1 ATOM 4425 C CZ2 . TRP C 3 148 ? 57.323 53.986 5.050 1.00 41.70 ? 148 TRP L CZ2 1 ATOM 4426 C CZ3 . TRP C 3 148 ? 58.173 52.950 3.041 1.00 41.85 ? 148 TRP L CZ3 1 ATOM 4427 C CH2 . TRP C 3 148 ? 58.109 53.049 4.435 1.00 41.35 ? 148 TRP L CH2 1 ATOM 4428 N N . LYS C 3 149 ? 57.120 56.404 -1.953 1.00 46.47 ? 149 LYS L N 1 ATOM 4429 C CA . LYS C 3 149 ? 57.004 56.266 -3.397 1.00 51.35 ? 149 LYS L CA 1 ATOM 4430 C C . LYS C 3 149 ? 57.099 54.803 -3.805 1.00 55.87 ? 149 LYS L C 1 ATOM 4431 O O . LYS C 3 149 ? 58.126 54.157 -3.599 1.00 60.30 ? 149 LYS L O 1 ATOM 4432 C CB . LYS C 3 149 ? 58.083 57.085 -4.109 1.00 56.22 ? 149 LYS L CB 1 ATOM 4433 C CG . LYS C 3 149 ? 57.892 58.588 -4.009 1.00 58.58 ? 149 LYS L CG 1 ATOM 4434 C CD . LYS C 3 149 ? 58.919 59.325 -4.846 1.00 65.95 ? 149 LYS L CD 1 ATOM 4435 C CE . LYS C 3 149 ? 58.663 60.820 -4.840 1.00 75.27 ? 149 LYS L CE 1 ATOM 4436 N NZ . LYS C 3 149 ? 59.601 61.538 -5.744 1.00 88.21 ? 149 LYS L NZ 1 ATOM 4437 N N . VAL C 3 150 ? 56.018 54.282 -4.375 1.00 57.56 ? 150 VAL L N 1 ATOM 4438 C CA . VAL C 3 150 ? 56.001 52.915 -4.881 1.00 57.28 ? 150 VAL L CA 1 ATOM 4439 C C . VAL C 3 150 ? 56.117 52.930 -6.400 1.00 60.42 ? 150 VAL L C 1 ATOM 4440 O O . VAL C 3 150 ? 55.235 53.444 -7.084 1.00 63.67 ? 150 VAL L O 1 ATOM 4441 C CB . VAL C 3 150 ? 54.720 52.171 -4.467 1.00 53.06 ? 150 VAL L CB 1 ATOM 4442 C CG1 . VAL C 3 150 ? 54.688 50.797 -5.093 1.00 53.58 ? 150 VAL L CG1 1 ATOM 4443 C CG2 . VAL C 3 150 ? 54.628 52.067 -2.954 1.00 47.77 ? 150 VAL L CG2 1 ATOM 4444 N N . ASP C 3 151 ? 57.208 52.365 -6.913 1.00 66.30 ? 151 ASP L N 1 ATOM 4445 C CA . ASP C 3 151 ? 57.554 52.453 -8.333 1.00 75.33 ? 151 ASP L CA 1 ATOM 4446 C C . ASP C 3 151 ? 57.632 53.912 -8.768 1.00 80.04 ? 151 ASP L C 1 ATOM 4447 O O . ASP C 3 151 ? 57.104 54.287 -9.816 1.00 87.93 ? 151 ASP L O 1 ATOM 4448 C CB . ASP C 3 151 ? 56.544 51.696 -9.202 1.00 78.63 ? 151 ASP L CB 1 ATOM 4449 C CG . ASP C 3 151 ? 56.643 50.193 -9.039 1.00 75.76 ? 151 ASP L CG 1 ATOM 4450 O OD1 . ASP C 3 151 ? 57.770 49.686 -8.857 1.00 75.33 ? 151 ASP L OD1 1 ATOM 4451 O OD2 . ASP C 3 151 ? 55.592 49.521 -9.095 1.00 73.73 ? 151 ASP L OD2 1 ATOM 4452 N N . ASN C 3 152 ? 58.283 54.724 -7.939 1.00 76.82 ? 152 ASN L N 1 ATOM 4453 C CA . ASN C 3 152 ? 58.432 56.163 -8.157 1.00 78.80 ? 152 ASN L CA 1 ATOM 4454 C C . ASN C 3 152 ? 57.093 56.902 -8.235 1.00 79.14 ? 152 ASN L C 1 ATOM 4455 O O . ASN C 3 152 ? 57.034 58.050 -8.677 1.00 84.80 ? 152 ASN L O 1 ATOM 4456 C CB . ASN C 3 152 ? 59.254 56.431 -9.423 1.00 86.03 ? 152 ASN L CB 1 ATOM 4457 C CG . ASN C 3 152 ? 59.856 57.824 -9.442 1.00 93.14 ? 152 ASN L CG 1 ATOM 4458 O OD1 . ASN C 3 152 ? 59.978 58.473 -8.401 1.00 94.13 ? 152 ASN L OD1 1 ATOM 4459 N ND2 . ASN C 3 152 ? 60.232 58.292 -10.626 1.00 99.98 ? 152 ASN L ND2 1 ATOM 4460 N N . ALA C 3 153 ? 56.021 56.247 -7.798 1.00 70.66 ? 153 ALA L N 1 ATOM 4461 C CA . ALA C 3 153 ? 54.710 56.882 -7.740 1.00 64.32 ? 153 ALA L CA 1 ATOM 4462 C C . ALA C 3 153 ? 54.393 57.298 -6.308 1.00 60.95 ? 153 ALA L C 1 ATOM 4463 O O . ALA C 3 153 ? 54.336 56.457 -5.410 1.00 57.10 ? 153 ALA L O 1 ATOM 4464 C CB . ALA C 3 153 ? 53.638 55.952 -8.275 1.00 58.23 ? 153 ALA L CB 1 ATOM 4465 N N . LEU C 3 154 ? 54.188 58.597 -6.105 1.00 64.22 ? 154 LEU L N 1 ATOM 4466 C CA . LEU C 3 154 ? 53.948 59.149 -4.774 1.00 61.81 ? 154 LEU L CA 1 ATOM 4467 C C . LEU C 3 154 ? 52.704 58.555 -4.126 1.00 62.30 ? 154 LEU L C 1 ATOM 4468 O O . LEU C 3 154 ? 51.640 58.486 -4.741 1.00 67.17 ? 154 LEU L O 1 ATOM 4469 C CB . LEU C 3 154 ? 53.821 60.672 -4.840 1.00 67.01 ? 154 LEU L CB 1 ATOM 4470 C CG . LEU C 3 154 ? 53.565 61.379 -3.506 1.00 70.61 ? 154 LEU L CG 1 ATOM 4471 C CD1 . LEU C 3 154 ? 54.720 61.156 -2.537 1.00 67.14 ? 154 LEU L CD1 1 ATOM 4472 C CD2 . LEU C 3 154 ? 53.319 62.865 -3.724 1.00 80.62 ? 154 LEU L CD2 1 ATOM 4473 N N . GLN C 3 155 ? 52.851 58.133 -2.876 1.00 59.37 ? 155 GLN L N 1 ATOM 4474 C CA . GLN C 3 155 ? 51.773 57.471 -2.158 1.00 53.59 ? 155 GLN L CA 1 ATOM 4475 C C . GLN C 3 155 ? 51.042 58.448 -1.243 1.00 54.90 ? 155 GLN L C 1 ATOM 4476 O O . GLN C 3 155 ? 51.584 59.492 -0.877 1.00 57.66 ? 155 GLN L O 1 ATOM 4477 C CB . GLN C 3 155 ? 52.325 56.289 -1.356 1.00 50.89 ? 155 GLN L CB 1 ATOM 4478 C CG . GLN C 3 155 ? 51.540 54.996 -1.524 1.00 55.17 ? 155 GLN L CG 1 ATOM 4479 C CD . GLN C 3 155 ? 51.684 54.382 -2.906 1.00 54.91 ? 155 GLN L CD 1 ATOM 4480 O OE1 . GLN C 3 155 ? 52.469 54.847 -3.733 1.00 55.66 ? 155 GLN L OE1 1 ATOM 4481 N NE2 . GLN C 3 155 ? 50.924 53.322 -3.158 1.00 59.96 ? 155 GLN L NE2 1 ATOM 4482 N N . SER C 3 156 ? 49.810 58.108 -0.880 1.00 59.88 ? 156 SER L N 1 ATOM 4483 C CA . SER C 3 156 ? 48.980 58.994 -0.071 1.00 59.22 ? 156 SER L CA 1 ATOM 4484 C C . SER C 3 156 ? 47.807 58.258 0.568 1.00 59.94 ? 156 SER L C 1 ATOM 4485 O O . SER C 3 156 ? 47.065 57.547 -0.108 1.00 72.34 ? 156 SER L O 1 ATOM 4486 C CB . SER C 3 156 ? 48.458 60.156 -0.922 1.00 63.48 ? 156 SER L CB 1 ATOM 4487 O OG . SER C 3 156 ? 47.581 60.986 -0.180 1.00 65.21 ? 156 SER L OG 1 ATOM 4488 N N . GLY C 3 157 ? 47.646 58.434 1.874 1.00 54.03 ? 157 GLY L N 1 ATOM 4489 C CA . GLY C 3 157 ? 46.498 57.893 2.579 1.00 55.07 ? 157 GLY L CA 1 ATOM 4490 C C . GLY C 3 157 ? 46.716 56.512 3.165 1.00 53.38 ? 157 GLY L C 1 ATOM 4491 O O . GLY C 3 157 ? 45.883 56.019 3.923 1.00 58.99 ? 157 GLY L O 1 ATOM 4492 N N . ASN C 3 158 ? 47.833 55.884 2.818 1.00 46.71 ? 158 ASN L N 1 ATOM 4493 C CA . ASN C 3 158 ? 48.116 54.538 3.299 1.00 48.41 ? 158 ASN L CA 1 ATOM 4494 C C . ASN C 3 158 ? 49.395 54.471 4.125 1.00 48.71 ? 158 ASN L C 1 ATOM 4495 O O . ASN C 3 158 ? 50.061 53.438 4.178 1.00 48.43 ? 158 ASN L O 1 ATOM 4496 C CB . ASN C 3 158 ? 48.202 53.565 2.123 1.00 47.22 ? 158 ASN L CB 1 ATOM 4497 C CG . ASN C 3 158 ? 49.329 53.899 1.172 1.00 50.54 ? 158 ASN L CG 1 ATOM 4498 O OD1 . ASN C 3 158 ? 49.845 55.017 1.172 1.00 51.92 ? 158 ASN L OD1 1 ATOM 4499 N ND2 . ASN C 3 158 ? 49.718 52.929 0.350 1.00 50.16 ? 158 ASN L ND2 1 ATOM 4500 N N . SER C 3 159 ? 49.735 55.585 4.764 1.00 50.03 ? 159 SER L N 1 ATOM 4501 C CA . SER C 3 159 ? 50.884 55.633 5.657 1.00 46.70 ? 159 SER L CA 1 ATOM 4502 C C . SER C 3 159 ? 50.538 56.423 6.910 1.00 49.39 ? 159 SER L C 1 ATOM 4503 O O . SER C 3 159 ? 49.729 57.350 6.863 1.00 54.18 ? 159 SER L O 1 ATOM 4504 C CB . SER C 3 159 ? 52.095 56.257 4.961 1.00 43.52 ? 159 SER L CB 1 ATOM 4505 O OG . SER C 3 159 ? 51.895 57.643 4.741 1.00 45.91 ? 159 SER L OG 1 ATOM 4506 N N . GLN C 3 160 ? 51.144 56.045 8.030 1.00 45.10 ? 160 GLN L N 1 ATOM 4507 C CA . GLN C 3 160 ? 50.950 56.760 9.284 1.00 42.89 ? 160 GLN L CA 1 ATOM 4508 C C . GLN C 3 160 ? 52.280 56.912 10.005 1.00 44.62 ? 160 GLN L C 1 ATOM 4509 O O . GLN C 3 160 ? 53.164 56.068 9.870 1.00 44.40 ? 160 GLN L O 1 ATOM 4510 C CB . GLN C 3 160 ? 49.935 56.038 10.169 1.00 44.84 ? 160 GLN L CB 1 ATOM 4511 C CG . GLN C 3 160 ? 48.504 56.145 9.671 1.00 50.20 ? 160 GLN L CG 1 ATOM 4512 C CD . GLN C 3 160 ? 47.510 55.505 10.615 1.00 59.75 ? 160 GLN L CD 1 ATOM 4513 O OE1 . GLN C 3 160 ? 47.515 54.289 10.811 1.00 68.76 ? 160 GLN L OE1 1 ATOM 4514 N NE2 . GLN C 3 160 ? 46.648 56.322 11.210 1.00 60.81 ? 160 GLN L NE2 1 ATOM 4515 N N . GLU C 3 161 ? 52.425 57.989 10.769 1.00 42.80 ? 161 GLU L N 1 ATOM 4516 C CA . GLU C 3 161 ? 53.690 58.257 11.435 1.00 37.54 ? 161 GLU L CA 1 ATOM 4517 C C . GLU C 3 161 ? 53.515 58.780 12.852 1.00 38.89 ? 161 GLU L C 1 ATOM 4518 O O . GLU C 3 161 ? 52.464 59.314 13.211 1.00 37.42 ? 161 GLU L O 1 ATOM 4519 C CB . GLU C 3 161 ? 54.514 59.254 10.623 1.00 38.24 ? 161 GLU L CB 1 ATOM 4520 C CG . GLU C 3 161 ? 53.983 60.673 10.665 1.00 42.09 ? 161 GLU L CG 1 ATOM 4521 C CD . GLU C 3 161 ? 54.827 61.626 9.850 1.00 48.48 ? 161 GLU L CD 1 ATOM 4522 O OE1 . GLU C 3 161 ? 55.485 61.164 8.894 1.00 51.55 ? 161 GLU L OE1 1 ATOM 4523 O OE2 . GLU C 3 161 ? 54.842 62.833 10.168 1.00 56.17 ? 161 GLU L OE2 1 ATOM 4524 N N . SER C 3 162 ? 54.559 58.617 13.656 1.00 37.67 ? 162 SER L N 1 ATOM 4525 C CA . SER C 3 162 ? 54.580 59.172 15.001 1.00 42.86 ? 162 SER L CA 1 ATOM 4526 C C . SER C 3 162 ? 55.992 59.590 15.386 1.00 42.51 ? 162 SER L C 1 ATOM 4527 O O . SER C 3 162 ? 56.980 58.993 14.947 1.00 38.30 ? 162 SER L O 1 ATOM 4528 C CB . SER C 3 162 ? 54.030 58.170 16.017 1.00 44.07 ? 162 SER L CB 1 ATOM 4529 O OG . SER C 3 162 ? 54.877 57.046 16.135 1.00 43.80 ? 162 SER L OG 1 ATOM 4530 N N . VAL C 3 163 ? 56.073 60.629 16.207 1.00 41.36 ? 163 VAL L N 1 ATOM 4531 C CA . VAL C 3 163 ? 57.348 61.155 16.658 1.00 33.09 ? 163 VAL L CA 1 ATOM 4532 C C . VAL C 3 163 ? 57.469 60.948 18.159 1.00 38.38 ? 163 VAL L C 1 ATOM 4533 O O . VAL C 3 163 ? 56.528 61.223 18.906 1.00 48.11 ? 163 VAL L O 1 ATOM 4534 C CB . VAL C 3 163 ? 57.486 62.651 16.316 1.00 36.86 ? 163 VAL L CB 1 ATOM 4535 C CG1 . VAL C 3 163 ? 58.844 63.181 16.755 1.00 39.86 ? 163 VAL L CG1 1 ATOM 4536 C CG2 . VAL C 3 163 ? 57.274 62.877 14.826 1.00 36.03 ? 163 VAL L CG2 1 ATOM 4537 N N . THR C 3 164 ? 58.615 60.446 18.604 1.00 35.97 ? 164 THR L N 1 ATOM 4538 C CA . THR C 3 164 ? 58.851 60.269 20.031 1.00 35.36 ? 164 THR L CA 1 ATOM 4539 C C . THR C 3 164 ? 58.976 61.626 20.705 1.00 36.18 ? 164 THR L C 1 ATOM 4540 O O . THR C 3 164 ? 59.205 62.636 20.038 1.00 37.84 ? 164 THR L O 1 ATOM 4541 C CB . THR C 3 164 ? 60.121 59.449 20.306 1.00 38.19 ? 164 THR L CB 1 ATOM 4542 O OG1 . THR C 3 164 ? 61.216 59.995 19.559 1.00 39.32 ? 164 THR L OG1 1 ATOM 4543 C CG2 . THR C 3 164 ? 59.919 57.999 19.905 1.00 42.02 ? 164 THR L CG2 1 ATOM 4544 N N . GLU C 3 165 ? 58.811 61.651 22.023 1.00 35.22 ? 165 GLU L N 1 ATOM 4545 C CA . GLU C 3 165 ? 59.093 62.857 22.791 1.00 38.56 ? 165 GLU L CA 1 ATOM 4546 C C . GLU C 3 165 ? 60.576 63.182 22.677 1.00 38.53 ? 165 GLU L C 1 ATOM 4547 O O . GLU C 3 165 ? 61.393 62.286 22.465 1.00 39.97 ? 165 GLU L O 1 ATOM 4548 C CB . GLU C 3 165 ? 58.703 62.682 24.260 1.00 43.58 ? 165 GLU L CB 1 ATOM 4549 C CG . GLU C 3 165 ? 57.249 62.318 24.491 1.00 52.01 ? 165 GLU L CG 1 ATOM 4550 C CD . GLU C 3 165 ? 56.297 63.418 24.074 1.00 63.88 ? 165 GLU L CD 1 ATOM 4551 O OE1 . GLU C 3 165 ? 56.694 64.602 24.119 1.00 67.53 ? 165 GLU L OE1 1 ATOM 4552 O OE2 . GLU C 3 165 ? 55.150 63.097 23.697 1.00 74.45 ? 165 GLU L OE2 1 ATOM 4553 N N . GLN C 3 166 ? 60.921 64.457 22.816 1.00 41.33 ? 166 GLN L N 1 ATOM 4554 C CA . GLN C 3 166 ? 62.316 64.873 22.759 1.00 40.71 ? 166 GLN L CA 1 ATOM 4555 C C . GLN C 3 166 ? 63.141 64.126 23.804 1.00 44.56 ? 166 GLN L C 1 ATOM 4556 O O . GLN C 3 166 ? 62.762 64.056 24.971 1.00 44.79 ? 166 GLN L O 1 ATOM 4557 C CB . GLN C 3 166 ? 62.447 66.386 22.963 1.00 39.85 ? 166 GLN L CB 1 ATOM 4558 C CG . GLN C 3 166 ? 63.851 66.916 22.689 1.00 38.29 ? 166 GLN L CG 1 ATOM 4559 C CD . GLN C 3 166 ? 63.978 68.407 22.931 1.00 47.85 ? 166 GLN L CD 1 ATOM 4560 O OE1 . GLN C 3 166 ? 63.251 68.986 23.741 1.00 47.86 ? 166 GLN L OE1 1 ATOM 4561 N NE2 . GLN C 3 166 ? 64.912 69.037 22.230 1.00 51.97 ? 166 GLN L NE2 1 ATOM 4562 N N . ASP C 3 167 ? 64.262 63.561 23.366 1.00 46.61 ? 167 ASP L N 1 ATOM 4563 C CA . ASP C 3 167 ? 65.155 62.822 24.250 1.00 40.83 ? 167 ASP L CA 1 ATOM 4564 C C . ASP C 3 167 ? 65.795 63.765 25.263 1.00 45.66 ? 167 ASP L C 1 ATOM 4565 O O . ASP C 3 167 ? 66.272 64.837 24.906 1.00 50.99 ? 167 ASP L O 1 ATOM 4566 C CB . ASP C 3 167 ? 66.228 62.097 23.436 1.00 40.22 ? 167 ASP L CB 1 ATOM 4567 C CG . ASP C 3 167 ? 66.958 61.040 24.241 1.00 47.12 ? 167 ASP L CG 1 ATOM 4568 O OD1 . ASP C 3 167 ? 66.866 59.852 23.872 1.00 57.33 ? 167 ASP L OD1 1 ATOM 4569 O OD2 . ASP C 3 167 ? 67.631 61.392 25.233 1.00 49.34 ? 167 ASP L OD2 1 ATOM 4570 N N . SER C 3 168 ? 65.808 63.366 26.529 1.00 46.51 ? 168 SER L N 1 ATOM 4571 C CA . SER C 3 168 ? 66.344 64.228 27.575 1.00 50.44 ? 168 SER L CA 1 ATOM 4572 C C . SER C 3 168 ? 67.875 64.229 27.625 1.00 52.19 ? 168 SER L C 1 ATOM 4573 O O . SER C 3 168 ? 68.471 64.965 28.409 1.00 52.91 ? 168 SER L O 1 ATOM 4574 C CB . SER C 3 168 ? 65.783 63.816 28.938 1.00 54.67 ? 168 SER L CB 1 ATOM 4575 O OG . SER C 3 168 ? 66.149 62.488 29.262 1.00 57.92 ? 168 SER L OG 1 ATOM 4576 N N . LYS C 3 169 ? 68.512 63.421 26.782 1.00 54.61 ? 169 LYS L N 1 ATOM 4577 C CA . LYS C 3 169 ? 69.971 63.288 26.823 1.00 59.94 ? 169 LYS L CA 1 ATOM 4578 C C . LYS C 3 169 ? 70.686 63.996 25.672 1.00 55.93 ? 169 LYS L C 1 ATOM 4579 O O . LYS C 3 169 ? 71.672 64.704 25.892 1.00 62.77 ? 169 LYS L O 1 ATOM 4580 C CB . LYS C 3 169 ? 70.369 61.813 26.827 1.00 60.56 ? 169 LYS L CB 1 ATOM 4581 C CG . LYS C 3 169 ? 69.766 61.001 27.955 1.00 58.35 ? 169 LYS L CG 1 ATOM 4582 C CD . LYS C 3 169 ? 70.160 61.545 29.310 1.00 61.56 ? 169 LYS L CD 1 ATOM 4583 C CE . LYS C 3 169 ? 69.595 60.683 30.427 1.00 71.21 ? 169 LYS L CE 1 ATOM 4584 N NZ . LYS C 3 169 ? 70.090 59.279 30.354 1.00 75.79 ? 169 LYS L NZ 1 ATOM 4585 N N . ASP C 3 170 ? 70.207 63.789 24.448 1.00 46.89 ? 170 ASP L N 1 ATOM 4586 C CA . ASP C 3 170 ? 70.823 64.408 23.277 1.00 47.92 ? 170 ASP L CA 1 ATOM 4587 C C . ASP C 3 170 ? 69.876 65.374 22.567 1.00 51.80 ? 170 ASP L C 1 ATOM 4588 O O . ASP C 3 170 ? 70.210 65.917 21.513 1.00 47.42 ? 170 ASP L O 1 ATOM 4589 C CB . ASP C 3 170 ? 71.321 63.335 22.298 1.00 43.82 ? 170 ASP L CB 1 ATOM 4590 C CG . ASP C 3 170 ? 70.234 62.357 21.876 1.00 46.32 ? 170 ASP L CG 1 ATOM 4591 O OD1 . ASP C 3 170 ? 69.063 62.766 21.723 1.00 43.95 ? 170 ASP L OD1 1 ATOM 4592 O OD2 . ASP C 3 170 ? 70.560 61.166 21.690 1.00 49.27 ? 170 ASP L OD2 1 ATOM 4593 N N . SER C 3 171 ? 68.690 65.558 23.146 1.00 56.75 ? 171 SER L N 1 ATOM 4594 C CA . SER C 3 171 ? 67.724 66.562 22.699 1.00 39.36 ? 171 SER L CA 1 ATOM 4595 C C . SER C 3 171 ? 67.209 66.331 21.279 1.00 43.99 ? 171 SER L C 1 ATOM 4596 O O . SER C 3 171 ? 66.782 67.273 20.608 1.00 36.29 ? 171 SER L O 1 ATOM 4597 C CB . SER C 3 171 ? 68.334 67.962 22.796 1.00 41.40 ? 171 SER L CB 1 ATOM 4598 O OG . SER C 3 171 ? 68.758 68.242 24.116 1.00 49.73 ? 171 SER L OG 1 ATOM 4599 N N . THR C 3 172 ? 67.227 65.081 20.826 1.00 34.79 ? 172 THR L N 1 ATOM 4600 C CA . THR C 3 172 ? 66.794 64.775 19.468 1.00 35.27 ? 172 THR L CA 1 ATOM 4601 C C . THR C 3 172 ? 65.399 64.167 19.420 1.00 40.75 ? 172 THR L C 1 ATOM 4602 O O . THR C 3 172 ? 64.825 63.793 20.444 1.00 42.44 ? 172 THR L O 1 ATOM 4603 C CB . THR C 3 172 ? 67.764 63.805 18.762 1.00 41.89 ? 172 THR L CB 1 ATOM 4604 O OG1 . THR C 3 172 ? 67.697 62.515 19.379 1.00 39.59 ? 172 THR L OG1 1 ATOM 4605 C CG2 . THR C 3 172 ? 69.191 64.330 18.823 1.00 33.83 ? 172 THR L CG2 1 ATOM 4606 N N . TYR C 3 173 ? 64.866 64.081 18.207 1.00 39.92 ? 173 TYR L N 1 ATOM 4607 C CA . TYR C 3 173 ? 63.591 63.437 17.947 1.00 32.46 ? 173 TYR L CA 1 ATOM 4608 C C . TYR C 3 173 ? 63.794 62.269 16.999 1.00 31.84 ? 173 TYR L C 1 ATOM 4609 O O . TYR C 3 173 ? 64.767 62.234 16.248 1.00 37.92 ? 173 TYR L O 1 ATOM 4610 C CB . TYR C 3 173 ? 62.595 64.423 17.339 1.00 34.72 ? 173 TYR L CB 1 ATOM 4611 C CG . TYR C 3 173 ? 62.231 65.574 18.238 1.00 38.75 ? 173 TYR L CG 1 ATOM 4612 C CD1 . TYR C 3 173 ? 61.081 65.532 19.014 1.00 37.62 ? 173 TYR L CD1 1 ATOM 4613 C CD2 . TYR C 3 173 ? 63.027 66.709 18.306 1.00 43.10 ? 173 TYR L CD2 1 ATOM 4614 C CE1 . TYR C 3 173 ? 60.737 66.583 19.834 1.00 42.31 ? 173 TYR L CE1 1 ATOM 4615 C CE2 . TYR C 3 173 ? 62.688 67.769 19.126 1.00 46.51 ? 173 TYR L CE2 1 ATOM 4616 C CZ . TYR C 3 173 ? 61.541 67.699 19.888 1.00 45.80 ? 173 TYR L CZ 1 ATOM 4617 O OH . TYR C 3 173 ? 61.191 68.745 20.710 1.00 50.57 ? 173 TYR L OH 1 ATOM 4618 N N . SER C 3 174 ? 62.871 61.317 17.027 1.00 34.25 ? 174 SER L N 1 ATOM 4619 C CA . SER C 3 174 ? 62.889 60.221 16.067 1.00 33.00 ? 174 SER L CA 1 ATOM 4620 C C . SER C 3 174 ? 61.494 60.002 15.500 1.00 38.22 ? 174 SER L C 1 ATOM 4621 O O . SER C 3 174 ? 60.491 60.197 16.189 1.00 43.15 ? 174 SER L O 1 ATOM 4622 C CB . SER C 3 174 ? 63.417 58.939 16.706 1.00 26.28 ? 174 SER L CB 1 ATOM 4623 O OG . SER C 3 174 ? 64.794 59.057 16.995 1.00 27.77 ? 174 SER L OG 1 ATOM 4624 N N . LEU C 3 175 ? 61.435 59.605 14.235 1.00 39.17 ? 175 LEU L N 1 ATOM 4625 C CA . LEU C 3 175 ? 60.162 59.437 13.551 1.00 38.93 ? 175 LEU L CA 1 ATOM 4626 C C . LEU C 3 175 ? 60.063 58.043 12.949 1.00 40.00 ? 175 LEU L C 1 ATOM 4627 O O . LEU C 3 175 ? 61.032 57.514 12.404 1.00 38.60 ? 175 LEU L O 1 ATOM 4628 C CB . LEU C 3 175 ? 60.000 60.511 12.470 1.00 37.00 ? 175 LEU L CB 1 ATOM 4629 C CG . LEU C 3 175 ? 58.639 60.747 11.808 1.00 33.68 ? 175 LEU L CG 1 ATOM 4630 C CD1 . LEU C 3 175 ? 58.522 62.201 11.383 1.00 33.52 ? 175 LEU L CD1 1 ATOM 4631 C CD2 . LEU C 3 175 ? 58.442 59.834 10.607 1.00 29.66 ? 175 LEU L CD2 1 ATOM 4632 N N . SER C 3 176 ? 58.884 57.447 13.063 1.00 41.85 ? 176 SER L N 1 ATOM 4633 C CA . SER C 3 176 ? 58.612 56.156 12.447 1.00 40.63 ? 176 SER L CA 1 ATOM 4634 C C . SER C 3 176 ? 57.373 56.259 11.573 1.00 42.61 ? 176 SER L C 1 ATOM 4635 O O . SER C 3 176 ? 56.323 56.703 12.032 1.00 37.95 ? 176 SER L O 1 ATOM 4636 C CB . SER C 3 176 ? 58.422 55.070 13.509 1.00 38.38 ? 176 SER L CB 1 ATOM 4637 O OG . SER C 3 176 ? 58.031 53.842 12.916 1.00 34.19 ? 176 SER L OG 1 ATOM 4638 N N . SER C 3 177 ? 57.502 55.861 10.311 1.00 42.48 ? 177 SER L N 1 ATOM 4639 C CA . SER C 3 177 ? 56.374 55.888 9.387 1.00 42.18 ? 177 SER L CA 1 ATOM 4640 C C . SER C 3 177 ? 56.099 54.499 8.819 1.00 40.01 ? 177 SER L C 1 ATOM 4641 O O . SER C 3 177 ? 57.019 53.792 8.406 1.00 40.70 ? 177 SER L O 1 ATOM 4642 C CB . SER C 3 177 ? 56.629 56.880 8.254 1.00 45.89 ? 177 SER L CB 1 ATOM 4643 O OG . SER C 3 177 ? 55.510 56.941 7.387 1.00 52.65 ? 177 SER L OG 1 ATOM 4644 N N . THR C 3 178 ? 54.827 54.116 8.797 1.00 40.54 ? 178 THR L N 1 ATOM 4645 C CA . THR C 3 178 ? 54.437 52.779 8.359 1.00 44.65 ? 178 THR L CA 1 ATOM 4646 C C . THR C 3 178 ? 53.538 52.796 7.122 1.00 45.98 ? 178 THR L C 1 ATOM 4647 O O . THR C 3 178 ? 52.412 53.290 7.165 1.00 47.05 ? 178 THR L O 1 ATOM 4648 C CB . THR C 3 178 ? 53.708 52.017 9.483 1.00 46.44 ? 178 THR L CB 1 ATOM 4649 O OG1 . THR C 3 178 ? 54.553 51.939 10.637 1.00 52.58 ? 178 THR L OG1 1 ATOM 4650 C CG2 . THR C 3 178 ? 53.348 50.610 9.028 1.00 43.72 ? 178 THR L CG2 1 ATOM 4651 N N . LEU C 3 179 ? 54.048 52.243 6.025 1.00 46.37 ? 179 LEU L N 1 ATOM 4652 C CA . LEU C 3 179 ? 53.274 52.080 4.799 1.00 49.00 ? 179 LEU L CA 1 ATOM 4653 C C . LEU C 3 179 ? 52.626 50.699 4.778 1.00 45.39 ? 179 LEU L C 1 ATOM 4654 O O . LEU C 3 179 ? 53.313 49.688 4.893 1.00 47.41 ? 179 LEU L O 1 ATOM 4655 C CB . LEU C 3 179 ? 54.166 52.270 3.569 1.00 50.03 ? 179 LEU L CB 1 ATOM 4656 C CG . LEU C 3 179 ? 53.474 52.254 2.204 1.00 51.69 ? 179 LEU L CG 1 ATOM 4657 C CD1 . LEU C 3 179 ? 52.669 53.525 2.000 1.00 47.69 ? 179 LEU L CD1 1 ATOM 4658 C CD2 . LEU C 3 179 ? 54.485 52.066 1.082 1.00 56.35 ? 179 LEU L CD2 1 ATOM 4659 N N . THR C 3 180 ? 51.307 50.654 4.628 1.00 49.51 ? 180 THR L N 1 ATOM 4660 C CA . THR C 3 180 ? 50.586 49.388 4.713 1.00 53.58 ? 180 THR L CA 1 ATOM 4661 C C . THR C 3 180 ? 49.799 49.058 3.445 1.00 54.11 ? 180 THR L C 1 ATOM 4662 O O . THR C 3 180 ? 48.913 49.807 3.035 1.00 56.24 ? 180 THR L O 1 ATOM 4663 C CB . THR C 3 180 ? 49.617 49.381 5.913 1.00 57.34 ? 180 THR L CB 1 ATOM 4664 O OG1 . THR C 3 180 ? 50.349 49.634 7.120 1.00 56.53 ? 180 THR L OG1 1 ATOM 4665 C CG2 . THR C 3 180 ? 48.916 48.039 6.023 1.00 55.95 ? 180 THR L CG2 1 ATOM 4666 N N . LEU C 3 181 ? 50.137 47.927 2.834 1.00 56.04 ? 181 LEU L N 1 ATOM 4667 C CA . LEU C 3 181 ? 49.430 47.429 1.659 1.00 58.56 ? 181 LEU L CA 1 ATOM 4668 C C . LEU C 3 181 ? 49.038 45.971 1.857 1.00 60.61 ? 181 LEU L C 1 ATOM 4669 O O . LEU C 3 181 ? 49.476 45.329 2.811 1.00 62.17 ? 181 LEU L O 1 ATOM 4670 C CB . LEU C 3 181 ? 50.289 47.572 0.402 1.00 61.97 ? 181 LEU L CB 1 ATOM 4671 C CG . LEU C 3 181 ? 50.496 48.984 -0.145 1.00 70.89 ? 181 LEU L CG 1 ATOM 4672 C CD1 . LEU C 3 181 ? 51.364 48.945 -1.394 1.00 74.30 ? 181 LEU L CD1 1 ATOM 4673 C CD2 . LEU C 3 181 ? 49.157 49.649 -0.438 1.00 78.54 ? 181 LEU L CD2 1 ATOM 4674 N N . SER C 3 182 ? 48.211 45.451 0.956 1.00 60.77 ? 182 SER L N 1 ATOM 4675 C CA . SER C 3 182 ? 47.818 44.050 1.015 1.00 61.12 ? 182 SER L CA 1 ATOM 4676 C C . SER C 3 182 ? 48.907 43.174 0.414 1.00 60.90 ? 182 SER L C 1 ATOM 4677 O O . SER C 3 182 ? 49.808 43.668 -0.259 1.00 61.92 ? 182 SER L O 1 ATOM 4678 C CB . SER C 3 182 ? 46.495 43.823 0.280 1.00 66.15 ? 182 SER L CB 1 ATOM 4679 O OG . SER C 3 182 ? 46.643 44.029 -1.114 1.00 69.12 ? 182 SER L OG 1 ATOM 4680 N N . LYS C 3 183 ? 48.815 41.873 0.667 1.00 63.71 ? 183 LYS L N 1 ATOM 4681 C CA . LYS C 3 183 ? 49.736 40.897 0.093 1.00 65.22 ? 183 LYS L CA 1 ATOM 4682 C C . LYS C 3 183 ? 49.752 40.960 -1.434 1.00 68.32 ? 183 LYS L C 1 ATOM 4683 O O . LYS C 3 183 ? 50.815 40.915 -2.053 1.00 68.92 ? 183 LYS L O 1 ATOM 4684 C CB . LYS C 3 183 ? 49.357 39.488 0.557 1.00 71.14 ? 183 LYS L CB 1 ATOM 4685 C CG . LYS C 3 183 ? 50.092 38.361 -0.143 1.00 73.63 ? 183 LYS L CG 1 ATOM 4686 C CD . LYS C 3 183 ? 51.554 38.321 0.251 1.00 73.13 ? 183 LYS L CD 1 ATOM 4687 C CE . LYS C 3 183 ? 52.188 37.003 -0.161 1.00 77.23 ? 183 LYS L CE 1 ATOM 4688 N NZ . LYS C 3 183 ? 51.481 35.838 0.441 1.00 76.52 ? 183 LYS L NZ 1 ATOM 4689 N N . ALA C 3 184 ? 48.569 41.072 -2.032 1.00 69.79 ? 184 ALA L N 1 ATOM 4690 C CA . ALA C 3 184 ? 48.441 41.098 -3.486 1.00 73.71 ? 184 ALA L CA 1 ATOM 4691 C C . ALA C 3 184 ? 49.003 42.382 -4.088 1.00 77.79 ? 184 ALA L C 1 ATOM 4692 O O . ALA C 3 184 ? 49.762 42.339 -5.056 1.00 84.82 ? 184 ALA L O 1 ATOM 4693 C CB . ALA C 3 184 ? 46.985 40.924 -3.888 1.00 76.42 ? 184 ALA L CB 1 ATOM 4694 N N . ASP C 3 185 ? 48.625 43.521 -3.516 1.00 74.49 ? 185 ASP L N 1 ATOM 4695 C CA . ASP C 3 185 ? 49.077 44.815 -4.017 1.00 72.81 ? 185 ASP L CA 1 ATOM 4696 C C . ASP C 3 185 ? 50.579 44.995 -3.829 1.00 69.36 ? 185 ASP L C 1 ATOM 4697 O O . ASP C 3 185 ? 51.236 45.659 -4.630 1.00 70.19 ? 185 ASP L O 1 ATOM 4698 C CB . ASP C 3 185 ? 48.320 45.951 -3.327 1.00 72.52 ? 185 ASP L CB 1 ATOM 4699 C CG . ASP C 3 185 ? 46.885 46.062 -3.800 1.00 83.97 ? 185 ASP L CG 1 ATOM 4700 O OD1 . ASP C 3 185 ? 46.320 45.038 -4.237 1.00 86.74 ? 185 ASP L OD1 1 ATOM 4701 O OD2 . ASP C 3 185 ? 46.322 47.175 -3.738 1.00 91.43 ? 185 ASP L OD2 1 ATOM 4702 N N . TYR C 3 186 ? 51.118 44.399 -2.770 1.00 65.23 ? 186 TYR L N 1 ATOM 4703 C CA . TYR C 3 186 ? 52.547 44.477 -2.497 1.00 59.87 ? 186 TYR L CA 1 ATOM 4704 C C . TYR C 3 186 ? 53.359 43.784 -3.586 1.00 64.78 ? 186 TYR L C 1 ATOM 4705 O O . TYR C 3 186 ? 54.366 44.316 -4.053 1.00 64.09 ? 186 TYR L O 1 ATOM 4706 C CB . TYR C 3 186 ? 52.867 43.864 -1.132 1.00 54.97 ? 186 TYR L CB 1 ATOM 4707 C CG . TYR C 3 186 ? 54.345 43.811 -0.814 1.00 53.59 ? 186 TYR L CG 1 ATOM 4708 C CD1 . TYR C 3 186 ? 55.051 44.965 -0.507 1.00 51.08 ? 186 TYR L CD1 1 ATOM 4709 C CD2 . TYR C 3 186 ? 55.030 42.603 -0.810 1.00 56.21 ? 186 TYR L CD2 1 ATOM 4710 C CE1 . TYR C 3 186 ? 56.401 44.921 -0.213 1.00 57.07 ? 186 TYR L CE1 1 ATOM 4711 C CE2 . TYR C 3 186 ? 56.379 42.547 -0.516 1.00 58.14 ? 186 TYR L CE2 1 ATOM 4712 C CZ . TYR C 3 186 ? 57.060 43.708 -0.219 1.00 62.87 ? 186 TYR L CZ 1 ATOM 4713 O OH . TYR C 3 186 ? 58.405 43.656 0.073 1.00 65.65 ? 186 TYR L OH 1 ATOM 4714 N N . GLU C 3 187 ? 52.911 42.602 -3.995 1.00 73.45 ? 187 GLU L N 1 ATOM 4715 C CA . GLU C 3 187 ? 53.627 41.818 -4.997 1.00 79.61 ? 187 GLU L CA 1 ATOM 4716 C C . GLU C 3 187 ? 53.475 42.388 -6.406 1.00 83.72 ? 187 GLU L C 1 ATOM 4717 O O . GLU C 3 187 ? 54.237 42.039 -7.308 1.00 83.60 ? 187 GLU L O 1 ATOM 4718 C CB . GLU C 3 187 ? 53.150 40.368 -4.968 1.00 81.90 ? 187 GLU L CB 1 ATOM 4719 C CG . GLU C 3 187 ? 53.449 39.657 -3.664 1.00 83.73 ? 187 GLU L CG 1 ATOM 4720 C CD . GLU C 3 187 ? 53.046 38.199 -3.692 1.00 94.31 ? 187 GLU L CD 1 ATOM 4721 O OE1 . GLU C 3 187 ? 52.123 37.849 -4.458 1.00 100.43 ? 187 GLU L OE1 1 ATOM 4722 O OE2 . GLU C 3 187 ? 53.659 37.401 -2.953 1.00 97.32 ? 187 GLU L OE2 1 ATOM 4723 N N . LYS C 3 188 ? 52.494 43.266 -6.590 1.00 86.15 ? 188 LYS L N 1 ATOM 4724 C CA . LYS C 3 188 ? 52.275 43.911 -7.881 1.00 85.65 ? 188 LYS L CA 1 ATOM 4725 C C . LYS C 3 188 ? 53.408 44.861 -8.247 1.00 81.20 ? 188 LYS L C 1 ATOM 4726 O O . LYS C 3 188 ? 53.651 45.125 -9.424 1.00 84.42 ? 188 LYS L O 1 ATOM 4727 C CB . LYS C 3 188 ? 50.953 44.681 -7.883 1.00 84.78 ? 188 LYS L CB 1 ATOM 4728 C CG . LYS C 3 188 ? 49.738 43.861 -8.276 1.00 86.06 ? 188 LYS L CG 1 ATOM 4729 C CD . LYS C 3 188 ? 48.549 44.766 -8.555 1.00 89.49 ? 188 LYS L CD 1 ATOM 4730 C CE . LYS C 3 188 ? 47.382 43.989 -9.138 1.00 98.27 ? 188 LYS L CE 1 ATOM 4731 N NZ . LYS C 3 188 ? 46.276 44.891 -9.564 1.00 103.75 ? 188 LYS L NZ 1 ATOM 4732 N N . HIS C 3 189 ? 54.100 45.375 -7.238 1.00 74.39 ? 189 HIS L N 1 ATOM 4733 C CA . HIS C 3 189 ? 55.069 46.439 -7.465 1.00 75.65 ? 189 HIS L CA 1 ATOM 4734 C C . HIS C 3 189 ? 56.504 46.032 -7.148 1.00 73.69 ? 189 HIS L C 1 ATOM 4735 O O . HIS C 3 189 ? 56.750 44.977 -6.568 1.00 76.13 ? 189 HIS L O 1 ATOM 4736 C CB . HIS C 3 189 ? 54.679 47.666 -6.649 1.00 70.56 ? 189 HIS L CB 1 ATOM 4737 C CG . HIS C 3 189 ? 53.277 48.127 -6.894 1.00 73.23 ? 189 HIS L CG 1 ATOM 4738 N ND1 . HIS C 3 189 ? 52.872 48.678 -8.092 1.00 78.67 ? 189 HIS L ND1 1 ATOM 4739 C CD2 . HIS C 3 189 ? 52.182 48.114 -6.098 1.00 69.92 ? 189 HIS L CD2 1 ATOM 4740 C CE1 . HIS C 3 189 ? 51.590 48.985 -8.022 1.00 78.47 ? 189 HIS L CE1 1 ATOM 4741 N NE2 . HIS C 3 189 ? 51.147 48.654 -6.823 1.00 75.34 ? 189 HIS L NE2 1 ATOM 4742 N N . LYS C 3 190 ? 57.443 46.892 -7.529 1.00 70.49 ? 190 LYS L N 1 ATOM 4743 C CA . LYS C 3 190 ? 58.864 46.563 -7.482 1.00 68.87 ? 190 LYS L CA 1 ATOM 4744 C C . LYS C 3 190 ? 59.626 47.334 -6.408 1.00 66.48 ? 190 LYS L C 1 ATOM 4745 O O . LYS C 3 190 ? 60.081 46.756 -5.420 1.00 64.86 ? 190 LYS L O 1 ATOM 4746 C CB . LYS C 3 190 ? 59.497 46.832 -8.849 1.00 75.51 ? 190 LYS L CB 1 ATOM 4747 C CG . LYS C 3 190 ? 60.986 46.546 -8.927 1.00 79.19 ? 190 LYS L CG 1 ATOM 4748 C CD . LYS C 3 190 ? 61.562 47.047 -10.243 1.00 87.32 ? 190 LYS L CD 1 ATOM 4749 C CE . LYS C 3 190 ? 60.780 46.508 -11.433 1.00 92.12 ? 190 LYS L CE 1 ATOM 4750 N NZ . LYS C 3 190 ? 61.256 47.083 -12.722 1.00 97.69 ? 190 LYS L NZ 1 ATOM 4751 N N . VAL C 3 191 ? 59.765 48.640 -6.614 1.00 66.93 ? 191 VAL L N 1 ATOM 4752 C CA . VAL C 3 191 ? 60.571 49.478 -5.734 1.00 63.55 ? 191 VAL L CA 1 ATOM 4753 C C . VAL C 3 191 ? 59.731 50.172 -4.664 1.00 60.81 ? 191 VAL L C 1 ATOM 4754 O O . VAL C 3 191 ? 58.698 50.772 -4.958 1.00 60.26 ? 191 VAL L O 1 ATOM 4755 C CB . VAL C 3 191 ? 61.338 50.548 -6.534 1.00 62.62 ? 191 VAL L CB 1 ATOM 4756 C CG1 . VAL C 3 191 ? 62.312 51.289 -5.634 1.00 57.69 ? 191 VAL L CG1 1 ATOM 4757 C CG2 . VAL C 3 191 ? 62.072 49.909 -7.699 1.00 64.32 ? 191 VAL L CG2 1 ATOM 4758 N N . TYR C 3 192 ? 60.187 50.079 -3.419 1.00 58.03 ? 192 TYR L N 1 ATOM 4759 C CA . TYR C 3 192 ? 59.544 50.762 -2.305 1.00 56.37 ? 192 TYR L CA 1 ATOM 4760 C C . TYR C 3 192 ? 60.532 51.720 -1.651 1.00 54.45 ? 192 TYR L C 1 ATOM 4761 O O . TYR C 3 192 ? 61.608 51.308 -1.224 1.00 58.20 ? 192 TYR L O 1 ATOM 4762 C CB . TYR C 3 192 ? 59.013 49.753 -1.285 1.00 54.29 ? 192 TYR L CB 1 ATOM 4763 C CG . TYR C 3 192 ? 57.901 48.891 -1.829 1.00 57.36 ? 192 TYR L CG 1 ATOM 4764 C CD1 . TYR C 3 192 ? 58.179 47.729 -2.540 1.00 63.15 ? 192 TYR L CD1 1 ATOM 4765 C CD2 . TYR C 3 192 ? 56.572 49.245 -1.644 1.00 54.89 ? 192 TYR L CD2 1 ATOM 4766 C CE1 . TYR C 3 192 ? 57.164 46.943 -3.047 1.00 62.70 ? 192 TYR L CE1 1 ATOM 4767 C CE2 . TYR C 3 192 ? 55.547 48.464 -2.148 1.00 60.62 ? 192 TYR L CE2 1 ATOM 4768 C CZ . TYR C 3 192 ? 55.850 47.314 -2.848 1.00 62.06 ? 192 TYR L CZ 1 ATOM 4769 O OH . TYR C 3 192 ? 54.837 46.532 -3.351 1.00 63.06 ? 192 TYR L OH 1 ATOM 4770 N N . ALA C 3 193 ? 60.162 52.996 -1.577 1.00 50.78 ? 193 ALA L N 1 ATOM 4771 C CA . ALA C 3 193 ? 61.068 54.026 -1.080 1.00 50.74 ? 193 ALA L CA 1 ATOM 4772 C C . ALA C 3 193 ? 60.370 55.049 -0.193 1.00 52.37 ? 193 ALA L C 1 ATOM 4773 O O . ALA C 3 193 ? 59.203 55.373 -0.404 1.00 57.12 ? 193 ALA L O 1 ATOM 4774 C CB . ALA C 3 193 ? 61.737 54.731 -2.245 1.00 53.84 ? 193 ALA L CB 1 ATOM 4775 N N . CYS C 3 194 ? 61.091 55.559 0.800 1.00 49.08 ? 194 CYS L N 1 ATOM 4776 C CA . CYS C 3 194 ? 60.613 56.703 1.565 1.00 46.04 ? 194 CYS L CA 1 ATOM 4777 C C . CYS C 3 194 ? 61.552 57.880 1.340 1.00 47.22 ? 194 CYS L C 1 ATOM 4778 O O . CYS C 3 194 ? 62.771 57.741 1.437 1.00 49.85 ? 194 CYS L O 1 ATOM 4779 C CB . CYS C 3 194 ? 60.499 56.374 3.058 1.00 40.65 ? 194 CYS L CB 1 ATOM 4780 S SG . CYS C 3 194 ? 62.033 55.888 3.870 1.00 71.57 ? 194 CYS L SG 1 ATOM 4781 N N . GLU C 3 195 ? 60.981 59.032 1.010 1.00 49.91 ? 195 GLU L N 1 ATOM 4782 C CA . GLU C 3 195 ? 61.776 60.229 0.778 1.00 51.75 ? 195 GLU L CA 1 ATOM 4783 C C . GLU C 3 195 ? 61.730 61.124 2.006 1.00 49.72 ? 195 GLU L C 1 ATOM 4784 O O . GLU C 3 195 ? 60.662 61.368 2.563 1.00 47.51 ? 195 GLU L O 1 ATOM 4785 C CB . GLU C 3 195 ? 61.276 60.983 -0.453 1.00 53.76 ? 195 GLU L CB 1 ATOM 4786 C CG . GLU C 3 195 ? 62.154 62.154 -0.850 1.00 59.84 ? 195 GLU L CG 1 ATOM 4787 C CD . GLU C 3 195 ? 61.592 62.923 -2.024 1.00 66.54 ? 195 GLU L CD 1 ATOM 4788 O OE1 . GLU C 3 195 ? 60.352 62.965 -2.165 1.00 67.88 ? 195 GLU L OE1 1 ATOM 4789 O OE2 . GLU C 3 195 ? 62.389 63.479 -2.809 1.00 74.28 ? 195 GLU L OE2 1 ATOM 4790 N N . VAL C 3 196 ? 62.893 61.610 2.425 1.00 48.23 ? 196 VAL L N 1 ATOM 4791 C CA . VAL C 3 196 ? 62.985 62.372 3.662 1.00 41.41 ? 196 VAL L CA 1 ATOM 4792 C C . VAL C 3 196 ? 63.496 63.788 3.428 1.00 44.79 ? 196 VAL L C 1 ATOM 4793 O O . VAL C 3 196 ? 64.577 63.991 2.880 1.00 49.34 ? 196 VAL L O 1 ATOM 4794 C CB . VAL C 3 196 ? 63.897 61.662 4.679 1.00 38.66 ? 196 VAL L CB 1 ATOM 4795 C CG1 . VAL C 3 196 ? 64.102 62.532 5.910 1.00 41.06 ? 196 VAL L CG1 1 ATOM 4796 C CG2 . VAL C 3 196 ? 63.313 60.307 5.057 1.00 33.95 ? 196 VAL L CG2 1 ATOM 4797 N N . THR C 3 197 ? 62.698 64.765 3.844 1.00 49.26 ? 197 THR L N 1 ATOM 4798 C CA . THR C 3 197 ? 63.084 66.167 3.765 1.00 50.45 ? 197 THR L CA 1 ATOM 4799 C C . THR C 3 197 ? 63.291 66.731 5.165 1.00 49.51 ? 197 THR L C 1 ATOM 4800 O O . THR C 3 197 ? 62.369 66.736 5.981 1.00 46.67 ? 197 THR L O 1 ATOM 4801 C CB . THR C 3 197 ? 62.026 67.004 3.022 1.00 54.37 ? 197 THR L CB 1 ATOM 4802 O OG1 . THR C 3 197 ? 61.848 66.481 1.701 1.00 62.79 ? 197 THR L OG1 1 ATOM 4803 C CG2 . THR C 3 197 ? 62.460 68.460 2.933 1.00 55.44 ? 197 THR L CG2 1 ATOM 4804 N N . HIS C 3 198 ? 64.506 67.194 5.445 1.00 49.80 ? 198 HIS L N 1 ATOM 4805 C CA . HIS C 3 198 ? 64.832 67.744 6.758 1.00 46.53 ? 198 HIS L CA 1 ATOM 4806 C C . HIS C 3 198 ? 65.837 68.886 6.645 1.00 45.30 ? 198 HIS L C 1 ATOM 4807 O O . HIS C 3 198 ? 66.609 68.952 5.688 1.00 44.41 ? 198 HIS L O 1 ATOM 4808 C CB . HIS C 3 198 ? 65.380 66.651 7.680 1.00 45.62 ? 198 HIS L CB 1 ATOM 4809 C CG . HIS C 3 198 ? 65.564 67.095 9.099 1.00 45.68 ? 198 HIS L CG 1 ATOM 4810 N ND1 . HIS C 3 198 ? 66.804 67.339 9.649 1.00 43.41 ? 198 HIS L ND1 1 ATOM 4811 C CD2 . HIS C 3 198 ? 64.662 67.349 10.077 1.00 45.55 ? 198 HIS L CD2 1 ATOM 4812 C CE1 . HIS C 3 198 ? 66.659 67.718 10.906 1.00 42.89 ? 198 HIS L CE1 1 ATOM 4813 N NE2 . HIS C 3 198 ? 65.369 67.734 11.190 1.00 43.38 ? 198 HIS L NE2 1 ATOM 4814 N N . GLN C 3 199 ? 65.820 69.776 7.634 1.00 47.54 ? 199 GLN L N 1 ATOM 4815 C CA . GLN C 3 199 ? 66.669 70.964 7.633 1.00 48.49 ? 199 GLN L CA 1 ATOM 4816 C C . GLN C 3 199 ? 68.157 70.618 7.633 1.00 43.52 ? 199 GLN L C 1 ATOM 4817 O O . GLN C 3 199 ? 68.974 71.360 7.092 1.00 45.25 ? 199 GLN L O 1 ATOM 4818 C CB . GLN C 3 199 ? 66.334 71.844 8.839 1.00 50.18 ? 199 GLN L CB 1 ATOM 4819 C CG . GLN C 3 199 ? 67.066 73.171 8.876 1.00 56.28 ? 199 GLN L CG 1 ATOM 4820 C CD . GLN C 3 199 ? 66.616 74.050 10.025 1.00 62.80 ? 199 GLN L CD 1 ATOM 4821 O OE1 . GLN C 3 199 ? 65.572 73.812 10.633 1.00 58.17 ? 199 GLN L OE1 1 ATOM 4822 N NE2 . GLN C 3 199 ? 67.406 75.074 10.330 1.00 68.90 ? 199 GLN L NE2 1 ATOM 4823 N N . GLY C 3 200 ? 68.501 69.485 8.236 1.00 42.99 ? 200 GLY L N 1 ATOM 4824 C CA . GLY C 3 200 ? 69.882 69.045 8.315 1.00 38.78 ? 200 GLY L CA 1 ATOM 4825 C C . GLY C 3 200 ? 70.339 68.320 7.065 1.00 46.10 ? 200 GLY L C 1 ATOM 4826 O O . GLY C 3 200 ? 71.496 67.924 6.949 1.00 49.01 ? 200 GLY L O 1 ATOM 4827 N N . LEU C 3 201 ? 69.417 68.143 6.125 1.00 51.74 ? 201 LEU L N 1 ATOM 4828 C CA . LEU C 3 201 ? 69.725 67.499 4.855 1.00 50.54 ? 201 LEU L CA 1 ATOM 4829 C C . LEU C 3 201 ? 69.842 68.536 3.745 1.00 48.33 ? 201 LEU L C 1 ATOM 4830 O O . LEU C 3 201 ? 68.939 69.349 3.546 1.00 48.58 ? 201 LEU L O 1 ATOM 4831 C CB . LEU C 3 201 ? 68.656 66.462 4.503 1.00 53.11 ? 201 LEU L CB 1 ATOM 4832 C CG . LEU C 3 201 ? 68.918 64.989 4.837 1.00 49.15 ? 201 LEU L CG 1 ATOM 4833 C CD1 . LEU C 3 201 ? 69.851 64.822 6.023 1.00 46.86 ? 201 LEU L CD1 1 ATOM 4834 C CD2 . LEU C 3 201 ? 67.603 64.249 5.067 1.00 47.49 ? 201 LEU L CD2 1 ATOM 4835 N N . SER C 3 202 ? 70.964 68.503 3.031 1.00 50.52 ? 202 SER L N 1 ATOM 4836 C CA . SER C 3 202 ? 71.217 69.435 1.938 1.00 56.45 ? 202 SER L CA 1 ATOM 4837 C C . SER C 3 202 ? 70.202 69.245 0.820 1.00 54.66 ? 202 SER L C 1 ATOM 4838 O O . SER C 3 202 ? 69.870 70.183 0.097 1.00 58.56 ? 202 SER L O 1 ATOM 4839 C CB . SER C 3 202 ? 72.635 69.252 1.396 1.00 66.70 ? 202 SER L CB 1 ATOM 4840 O OG . SER C 3 202 ? 73.587 69.287 2.443 1.00 69.52 ? 202 SER L OG 1 ATOM 4841 N N . SER C 3 203 ? 69.717 68.018 0.686 1.00 51.48 ? 203 SER L N 1 ATOM 4842 C CA . SER C 3 203 ? 68.707 67.688 -0.306 1.00 56.49 ? 203 SER L CA 1 ATOM 4843 C C . SER C 3 203 ? 67.897 66.494 0.190 1.00 51.72 ? 203 SER L C 1 ATOM 4844 O O . SER C 3 203 ? 68.373 65.739 1.039 1.00 49.47 ? 203 SER L O 1 ATOM 4845 C CB . SER C 3 203 ? 69.358 67.388 -1.661 1.00 67.11 ? 203 SER L CB 1 ATOM 4846 O OG . SER C 3 203 ? 70.248 66.291 -1.570 1.00 67.55 ? 203 SER L OG 1 ATOM 4847 N N . PRO C 3 204 ? 66.661 66.337 -0.313 1.00 50.86 ? 204 PRO L N 1 ATOM 4848 C CA . PRO C 3 204 ? 65.828 65.190 0.067 1.00 50.65 ? 204 PRO L CA 1 ATOM 4849 C C . PRO C 3 204 ? 66.529 63.853 -0.170 1.00 52.63 ? 204 PRO L C 1 ATOM 4850 O O . PRO C 3 204 ? 67.018 63.601 -1.272 1.00 59.47 ? 204 PRO L O 1 ATOM 4851 C CB . PRO C 3 204 ? 64.606 65.334 -0.840 1.00 49.98 ? 204 PRO L CB 1 ATOM 4852 C CG . PRO C 3 204 ? 64.514 66.797 -1.093 1.00 51.18 ? 204 PRO L CG 1 ATOM 4853 C CD . PRO C 3 204 ? 65.929 67.289 -1.168 1.00 49.98 ? 204 PRO L CD 1 ATOM 4854 N N . VAL C 3 205 ? 66.579 63.013 0.858 1.00 47.44 ? 205 VAL L N 1 ATOM 4855 C CA . VAL C 3 205 ? 67.266 61.730 0.766 1.00 50.01 ? 205 VAL L CA 1 ATOM 4856 C C . VAL C 3 205 ? 66.267 60.587 0.612 1.00 49.81 ? 205 VAL L C 1 ATOM 4857 O O . VAL C 3 205 ? 65.217 60.578 1.254 1.00 49.05 ? 205 VAL L O 1 ATOM 4858 C CB . VAL C 3 205 ? 68.161 61.483 2.003 1.00 53.14 ? 205 VAL L CB 1 ATOM 4859 C CG1 . VAL C 3 205 ? 68.838 60.122 1.924 1.00 52.67 ? 205 VAL L CG1 1 ATOM 4860 C CG2 . VAL C 3 205 ? 69.203 62.583 2.123 1.00 55.60 ? 205 VAL L CG2 1 ATOM 4861 N N . THR C 3 206 ? 66.596 59.631 -0.252 1.00 52.78 ? 206 THR L N 1 ATOM 4862 C CA . THR C 3 206 ? 65.731 58.483 -0.492 1.00 54.98 ? 206 THR L CA 1 ATOM 4863 C C . THR C 3 206 ? 66.402 57.168 -0.103 1.00 55.07 ? 206 THR L C 1 ATOM 4864 O O . THR C 3 206 ? 67.478 56.835 -0.603 1.00 59.50 ? 206 THR L O 1 ATOM 4865 C CB . THR C 3 206 ? 65.306 58.402 -1.970 1.00 56.31 ? 206 THR L CB 1 ATOM 4866 O OG1 . THR C 3 206 ? 64.473 59.522 -2.292 1.00 57.88 ? 206 THR L OG1 1 ATOM 4867 C CG2 . THR C 3 206 ? 64.542 57.117 -2.237 1.00 56.89 ? 206 THR L CG2 1 ATOM 4868 N N . LYS C 3 207 ? 65.761 56.430 0.799 1.00 53.59 ? 207 LYS L N 1 ATOM 4869 C CA . LYS C 3 207 ? 66.166 55.064 1.107 1.00 56.45 ? 207 LYS L CA 1 ATOM 4870 C C . LYS C 3 207 ? 65.146 54.102 0.513 1.00 58.82 ? 207 LYS L C 1 ATOM 4871 O O . LYS C 3 207 ? 63.944 54.256 0.724 1.00 63.73 ? 207 LYS L O 1 ATOM 4872 C CB . LYS C 3 207 ? 66.292 54.846 2.614 1.00 59.08 ? 207 LYS L CB 1 ATOM 4873 C CG . LYS C 3 207 ? 67.426 55.625 3.263 1.00 67.21 ? 207 LYS L CG 1 ATOM 4874 C CD . LYS C 3 207 ? 68.771 55.276 2.638 1.00 74.50 ? 207 LYS L CD 1 ATOM 4875 C CE . LYS C 3 207 ? 69.883 56.159 3.185 1.00 77.08 ? 207 LYS L CE 1 ATOM 4876 N NZ . LYS C 3 207 ? 71.176 55.892 2.500 1.00 81.19 ? 207 LYS L NZ 1 ATOM 4877 N N . SER C 3 208 ? 65.625 53.112 -0.232 1.00 55.68 ? 208 SER L N 1 ATOM 4878 C CA . SER C 3 208 ? 64.733 52.218 -0.958 1.00 47.66 ? 208 SER L CA 1 ATOM 4879 C C . SER C 3 208 ? 65.213 50.774 -0.971 1.00 44.61 ? 208 SER L C 1 ATOM 4880 O O . SER C 3 208 ? 66.332 50.467 -0.563 1.00 44.79 ? 208 SER L O 1 ATOM 4881 C CB . SER C 3 208 ? 64.562 52.702 -2.397 1.00 48.40 ? 208 SER L CB 1 ATOM 4882 O OG . SER C 3 208 ? 65.797 52.689 -3.089 1.00 55.38 ? 208 SER L OG 1 ATOM 4883 N N . PHE C 3 209 ? 64.350 49.892 -1.458 1.00 46.41 ? 209 PHE L N 1 ATOM 4884 C CA . PHE C 3 209 ? 64.690 48.491 -1.630 1.00 49.65 ? 209 PHE L CA 1 ATOM 4885 C C . PHE C 3 209 ? 63.810 47.867 -2.704 1.00 52.08 ? 209 PHE L C 1 ATOM 4886 O O . PHE C 3 209 ? 62.744 48.389 -3.028 1.00 51.46 ? 209 PHE L O 1 ATOM 4887 C CB . PHE C 3 209 ? 64.540 47.731 -0.310 1.00 54.41 ? 209 PHE L CB 1 ATOM 4888 C CG . PHE C 3 209 ? 63.113 47.519 0.115 1.00 55.14 ? 209 PHE L CG 1 ATOM 4889 C CD1 . PHE C 3 209 ? 62.460 46.329 -0.170 1.00 59.53 ? 209 PHE L CD1 1 ATOM 4890 C CD2 . PHE C 3 209 ? 62.427 48.504 0.802 1.00 51.47 ? 209 PHE L CD2 1 ATOM 4891 C CE1 . PHE C 3 209 ? 61.147 46.128 0.220 1.00 58.51 ? 209 PHE L CE1 1 ATOM 4892 C CE2 . PHE C 3 209 ? 61.117 48.309 1.196 1.00 54.20 ? 209 PHE L CE2 1 ATOM 4893 C CZ . PHE C 3 209 ? 60.476 47.120 0.904 1.00 55.75 ? 209 PHE L CZ 1 ATOM 4894 N N . ASN C 3 210 ? 64.267 46.750 -3.258 1.00 61.66 ? 210 ASN L N 1 ATOM 4895 C CA . ASN C 3 210 ? 63.474 45.988 -4.212 1.00 62.50 ? 210 ASN L CA 1 ATOM 4896 C C . ASN C 3 210 ? 62.982 44.689 -3.591 1.00 62.98 ? 210 ASN L C 1 ATOM 4897 O O . ASN C 3 210 ? 63.640 44.124 -2.717 1.00 67.64 ? 210 ASN L O 1 ATOM 4898 C CB . ASN C 3 210 ? 64.284 45.689 -5.475 1.00 67.60 ? 210 ASN L CB 1 ATOM 4899 C CG . ASN C 3 210 ? 64.623 46.938 -6.262 1.00 69.14 ? 210 ASN L CG 1 ATOM 4900 O OD1 . ASN C 3 210 ? 63.895 47.325 -7.175 1.00 69.85 ? 210 ASN L OD1 1 ATOM 4901 N ND2 . ASN C 3 210 ? 65.735 47.576 -5.913 1.00 69.48 ? 210 ASN L ND2 1 ATOM 4902 N N . ARG C 3 211 ? 61.820 44.224 -4.036 1.00 59.79 ? 211 ARG L N 1 ATOM 4903 C CA . ARG C 3 211 ? 61.290 42.947 -3.577 1.00 62.17 ? 211 ARG L CA 1 ATOM 4904 C C . ARG C 3 211 ? 62.240 41.807 -3.933 1.00 64.74 ? 211 ARG L C 1 ATOM 4905 O O . ARG C 3 211 ? 62.181 41.256 -5.032 1.00 68.73 ? 211 ARG L O 1 ATOM 4906 C CB . ARG C 3 211 ? 59.908 42.693 -4.177 1.00 63.59 ? 211 ARG L CB 1 ATOM 4907 C CG . ARG C 3 211 ? 58.764 43.280 -3.368 1.00 62.58 ? 211 ARG L CG 1 ATOM 4908 C CD . ARG C 3 211 ? 57.431 43.127 -4.088 1.00 64.63 ? 211 ARG L CD 1 ATOM 4909 N NE . ARG C 3 211 ? 57.190 41.762 -4.552 1.00 69.95 ? 211 ARG L NE 1 ATOM 4910 C CZ . ARG C 3 211 ? 57.274 41.376 -5.822 1.00 74.08 ? 211 ARG L CZ 1 ATOM 4911 N NH1 . ARG C 3 211 ? 57.594 42.251 -6.766 1.00 73.42 ? 211 ARG L NH1 1 ATOM 4912 N NH2 . ARG C 3 211 ? 57.036 40.114 -6.150 1.00 79.76 ? 211 ARG L NH2 1 ATOM 4913 N N . GLY C 3 212 ? 63.119 41.468 -2.996 1.00 67.07 ? 212 GLY L N 1 ATOM 4914 C CA . GLY C 3 212 ? 64.110 40.429 -3.209 1.00 70.54 ? 212 GLY L CA 1 ATOM 4915 C C . GLY C 3 212 ? 65.323 40.601 -2.314 1.00 71.76 ? 212 GLY L C 1 ATOM 4916 O O . GLY C 3 212 ? 66.110 41.532 -2.490 1.00 68.88 ? 212 GLY L O 1 ATOM 4917 N N . VAL D 1 15 ? 48.210 -21.493 130.421 1.00 105.87 ? 381 VAL B N 1 ATOM 4918 C CA . VAL D 1 15 ? 48.287 -20.297 129.590 1.00 103.29 ? 381 VAL B CA 1 ATOM 4919 C C . VAL D 1 15 ? 49.402 -20.435 128.558 1.00 97.48 ? 381 VAL B C 1 ATOM 4920 O O . VAL D 1 15 ? 50.526 -20.805 128.896 1.00 97.29 ? 381 VAL B O 1 ATOM 4921 C CB . VAL D 1 15 ? 48.527 -19.034 130.439 1.00 102.82 ? 381 VAL B CB 1 ATOM 4922 C CG1 . VAL D 1 15 ? 48.516 -17.791 129.561 1.00 97.64 ? 381 VAL B CG1 1 ATOM 4923 C CG2 . VAL D 1 15 ? 47.476 -18.927 131.535 1.00 111.51 ? 381 VAL B CG2 1 ATOM 4924 N N . GLU D 1 16 ? 49.088 -20.142 127.300 1.00 88.95 ? 382 GLU B N 1 ATOM 4925 C CA . GLU D 1 16 ? 50.067 -20.276 126.229 1.00 82.25 ? 382 GLU B CA 1 ATOM 4926 C C . GLU D 1 16 ? 50.402 -18.927 125.601 1.00 76.50 ? 382 GLU B C 1 ATOM 4927 O O . GLU D 1 16 ? 49.513 -18.116 125.342 1.00 76.62 ? 382 GLU B O 1 ATOM 4928 C CB . GLU D 1 16 ? 49.558 -21.241 125.156 1.00 87.75 ? 382 GLU B CB 1 ATOM 4929 C CG . GLU D 1 16 ? 50.580 -21.551 124.071 1.00 88.31 ? 382 GLU B CG 1 ATOM 4930 C CD . GLU D 1 16 ? 50.115 -22.634 123.117 1.00 92.92 ? 382 GLU B CD 1 ATOM 4931 O OE1 . GLU D 1 16 ? 48.987 -23.141 123.294 1.00 99.70 ? 382 GLU B OE1 1 ATOM 4932 O OE2 . GLU D 1 16 ? 50.879 -22.980 122.191 1.00 88.66 ? 382 GLU B OE2 1 ATOM 4933 N N . CYS D 1 17 ? 51.691 -18.696 125.364 1.00 68.58 ? 383 CYS B N 1 ATOM 4934 C CA . CYS D 1 17 ? 52.154 -17.459 124.744 1.00 64.37 ? 383 CYS B CA 1 ATOM 4935 C C . CYS D 1 17 ? 51.622 -17.328 123.326 1.00 65.35 ? 383 CYS B C 1 ATOM 4936 O O . CYS D 1 17 ? 51.644 -18.285 122.555 1.00 67.82 ? 383 CYS B O 1 ATOM 4937 C CB . CYS D 1 17 ? 53.683 -17.398 124.737 1.00 60.79 ? 383 CYS B CB 1 ATOM 4938 S SG . CYS D 1 17 ? 54.429 -17.398 126.378 1.00 66.61 ? 383 CYS B SG 1 ATOM 4939 N N . ASP D 1 18 ? 51.156 -16.132 122.984 1.00 65.67 ? 384 ASP B N 1 ATOM 4940 C CA . ASP D 1 18 ? 50.474 -15.916 121.716 1.00 66.22 ? 384 ASP B CA 1 ATOM 4941 C C . ASP D 1 18 ? 51.366 -15.293 120.644 1.00 61.34 ? 384 ASP B C 1 ATOM 4942 O O . ASP D 1 18 ? 51.774 -14.138 120.757 1.00 53.50 ? 384 ASP B O 1 ATOM 4943 C CB . ASP D 1 18 ? 49.246 -15.033 121.929 1.00 68.35 ? 384 ASP B CB 1 ATOM 4944 C CG . ASP D 1 18 ? 48.374 -14.959 120.703 1.00 73.68 ? 384 ASP B CG 1 ATOM 4945 O OD1 . ASP D 1 18 ? 48.269 -15.985 120.002 1.00 77.52 ? 384 ASP B OD1 1 ATOM 4946 O OD2 . ASP D 1 18 ? 47.799 -13.882 120.438 1.00 75.56 ? 384 ASP B OD2 1 ATOM 4947 N N . PHE D 1 19 ? 51.649 -16.066 119.599 1.00 65.25 ? 385 PHE B N 1 ATOM 4948 C CA . PHE D 1 19 ? 52.416 -15.579 118.456 1.00 64.35 ? 385 PHE B CA 1 ATOM 4949 C C . PHE D 1 19 ? 51.496 -15.209 117.295 1.00 65.65 ? 385 PHE B C 1 ATOM 4950 O O . PHE D 1 19 ? 51.961 -14.968 116.182 1.00 64.72 ? 385 PHE B O 1 ATOM 4951 C CB . PHE D 1 19 ? 53.427 -16.633 117.993 1.00 67.56 ? 385 PHE B CB 1 ATOM 4952 C CG . PHE D 1 19 ? 54.430 -17.018 119.040 1.00 68.60 ? 385 PHE B CG 1 ATOM 4953 C CD1 . PHE D 1 19 ? 54.981 -16.063 119.877 1.00 67.96 ? 385 PHE B CD1 1 ATOM 4954 C CD2 . PHE D 1 19 ? 54.821 -18.339 119.190 1.00 73.60 ? 385 PHE B CD2 1 ATOM 4955 C CE1 . PHE D 1 19 ? 55.907 -16.417 120.843 1.00 67.08 ? 385 PHE B CE1 1 ATOM 4956 C CE2 . PHE D 1 19 ? 55.744 -18.699 120.154 1.00 73.04 ? 385 PHE B CE2 1 ATOM 4957 C CZ . PHE D 1 19 ? 56.287 -17.736 120.982 1.00 68.81 ? 385 PHE B CZ 1 ATOM 4958 N N . SER D 1 20 ? 50.194 -15.170 117.562 1.00 68.28 ? 386 SER B N 1 ATOM 4959 C CA . SER D 1 20 ? 49.188 -14.933 116.525 1.00 70.73 ? 386 SER B CA 1 ATOM 4960 C C . SER D 1 20 ? 49.417 -13.696 115.640 1.00 68.54 ? 386 SER B C 1 ATOM 4961 O O . SER D 1 20 ? 49.308 -13.805 114.419 1.00 73.62 ? 386 SER B O 1 ATOM 4962 C CB . SER D 1 20 ? 47.794 -14.840 117.156 1.00 71.36 ? 386 SER B CB 1 ATOM 4963 O OG . SER D 1 20 ? 47.452 -16.046 117.817 1.00 74.43 ? 386 SER B OG 1 ATOM 4964 N N . PRO D 1 21 ? 49.725 -12.522 116.235 1.00 60.51 ? 387 PRO B N 1 ATOM 4965 C CA . PRO D 1 21 ? 49.853 -11.333 115.377 1.00 60.20 ? 387 PRO B CA 1 ATOM 4966 C C . PRO D 1 21 ? 50.908 -11.474 114.278 1.00 59.77 ? 387 PRO B C 1 ATOM 4967 O O . PRO D 1 21 ? 50.818 -10.817 113.240 1.00 63.58 ? 387 PRO B O 1 ATOM 4968 C CB . PRO D 1 21 ? 50.253 -10.233 116.366 1.00 57.87 ? 387 PRO B CB 1 ATOM 4969 C CG . PRO D 1 21 ? 49.719 -10.691 117.672 1.00 57.03 ? 387 PRO B CG 1 ATOM 4970 C CD . PRO D 1 21 ? 49.891 -12.176 117.660 1.00 55.73 ? 387 PRO B CD 1 ATOM 4971 N N . LEU D 1 22 ? 51.889 -12.337 114.509 1.00 57.11 ? 388 LEU B N 1 ATOM 4972 C CA . LEU D 1 22 ? 52.945 -12.585 113.539 1.00 57.79 ? 388 LEU B CA 1 ATOM 4973 C C . LEU D 1 22 ? 52.392 -13.241 112.273 1.00 65.68 ? 388 LEU B C 1 ATOM 4974 O O . LEU D 1 22 ? 52.844 -12.956 111.163 1.00 66.31 ? 388 LEU B O 1 ATOM 4975 C CB . LEU D 1 22 ? 54.027 -13.466 114.167 1.00 58.68 ? 388 LEU B CB 1 ATOM 4976 C CG . LEU D 1 22 ? 55.473 -13.329 113.694 1.00 64.54 ? 388 LEU B CG 1 ATOM 4977 C CD1 . LEU D 1 22 ? 56.403 -13.924 114.735 1.00 64.54 ? 388 LEU B CD1 1 ATOM 4978 C CD2 . LEU D 1 22 ? 55.685 -14.006 112.348 1.00 68.65 ? 388 LEU B CD2 1 ATOM 4979 N N . LEU D 1 23 ? 51.401 -14.109 112.445 1.00 68.95 ? 389 LEU B N 1 ATOM 4980 C CA . LEU D 1 23 ? 50.899 -14.926 111.346 1.00 71.71 ? 389 LEU B CA 1 ATOM 4981 C C . LEU D 1 23 ? 49.724 -14.292 110.602 1.00 77.77 ? 389 LEU B C 1 ATOM 4982 O O . LEU D 1 23 ? 48.977 -14.982 109.908 1.00 85.93 ? 389 LEU B O 1 ATOM 4983 C CB . LEU D 1 23 ? 50.489 -16.302 111.873 1.00 66.34 ? 389 LEU B CB 1 ATOM 4984 C CG . LEU D 1 23 ? 51.569 -17.072 112.632 1.00 64.65 ? 389 LEU B CG 1 ATOM 4985 C CD1 . LEU D 1 23 ? 51.027 -18.401 113.125 1.00 72.60 ? 389 LEU B CD1 1 ATOM 4986 C CD2 . LEU D 1 23 ? 52.790 -17.280 111.754 1.00 64.30 ? 389 LEU B CD2 1 ATOM 4987 N N . SER D 1 24 ? 49.563 -12.981 110.741 1.00 74.35 ? 390 SER B N 1 ATOM 4988 C CA . SER D 1 24 ? 48.456 -12.292 110.089 1.00 72.85 ? 390 SER B CA 1 ATOM 4989 C C . SER D 1 24 ? 48.840 -10.887 109.643 1.00 66.85 ? 390 SER B C 1 ATOM 4990 O O . SER D 1 24 ? 49.744 -10.268 110.203 1.00 63.36 ? 390 SER B O 1 ATOM 4991 C CB . SER D 1 24 ? 47.245 -12.226 111.023 1.00 76.66 ? 390 SER B CB 1 ATOM 4992 O OG . SER D 1 24 ? 46.791 -13.525 111.362 1.00 84.26 ? 390 SER B OG 1 ATOM 4993 N N . GLY D 1 25 ? 48.140 -10.394 108.627 1.00 69.21 ? 391 GLY B N 1 ATOM 4994 C CA . GLY D 1 25 ? 48.353 -9.049 108.131 1.00 70.46 ? 391 GLY B CA 1 ATOM 4995 C C . GLY D 1 25 ? 49.709 -8.856 107.484 1.00 70.31 ? 391 GLY B C 1 ATOM 4996 O O . GLY D 1 25 ? 50.427 -9.818 107.209 1.00 69.15 ? 391 GLY B O 1 ATOM 4997 N N . THR D 1 26 ? 50.058 -7.599 107.242 1.00 68.48 ? 392 THR B N 1 ATOM 4998 C CA . THR D 1 26 ? 51.316 -7.263 106.593 1.00 64.30 ? 392 THR B CA 1 ATOM 4999 C C . THR D 1 26 ? 52.391 -6.950 107.625 1.00 58.02 ? 392 THR B C 1 ATOM 5000 O O . THR D 1 26 ? 52.278 -5.975 108.368 1.00 56.44 ? 392 THR B O 1 ATOM 5001 C CB . THR D 1 26 ? 51.149 -6.060 105.642 1.00 63.43 ? 392 THR B CB 1 ATOM 5002 O OG1 . THR D 1 26 ? 50.197 -6.388 104.622 1.00 68.87 ? 392 THR B OG1 1 ATOM 5003 C CG2 . THR D 1 26 ? 52.475 -5.697 104.993 1.00 58.05 ? 392 THR B CG2 1 ATOM 5004 N N . PRO D 1 27 ? 53.436 -7.789 107.683 1.00 56.11 ? 393 PRO B N 1 ATOM 5005 C CA . PRO D 1 27 ? 54.564 -7.526 108.580 1.00 55.90 ? 393 PRO B CA 1 ATOM 5006 C C . PRO D 1 27 ? 55.306 -6.260 108.164 1.00 53.52 ? 393 PRO B C 1 ATOM 5007 O O . PRO D 1 27 ? 55.502 -6.033 106.970 1.00 54.29 ? 393 PRO B O 1 ATOM 5008 C CB . PRO D 1 27 ? 55.445 -8.768 108.419 1.00 52.24 ? 393 PRO B CB 1 ATOM 5009 C CG . PRO D 1 27 ? 55.078 -9.325 107.090 1.00 56.15 ? 393 PRO B CG 1 ATOM 5010 C CD . PRO D 1 27 ? 53.620 -9.027 106.909 1.00 57.37 ? 393 PRO B CD 1 ATOM 5011 N N . PRO D 1 28 ? 55.704 -5.437 109.143 1.00 52.52 ? 394 PRO B N 1 ATOM 5012 C CA . PRO D 1 28 ? 56.369 -4.160 108.869 1.00 50.20 ? 394 PRO B CA 1 ATOM 5013 C C . PRO D 1 28 ? 57.806 -4.336 108.397 1.00 50.70 ? 394 PRO B C 1 ATOM 5014 O O . PRO D 1 28 ? 58.332 -5.447 108.416 1.00 47.59 ? 394 PRO B O 1 ATOM 5015 C CB . PRO D 1 28 ? 56.329 -3.455 110.223 1.00 47.72 ? 394 PRO B CB 1 ATOM 5016 C CG . PRO D 1 28 ? 56.361 -4.570 111.207 1.00 42.98 ? 394 PRO B CG 1 ATOM 5017 C CD . PRO D 1 28 ? 55.543 -5.671 110.589 1.00 54.14 ? 394 PRO B CD 1 ATOM 5018 N N . GLN D 1 29 ? 58.431 -3.243 107.977 1.00 52.63 ? 395 GLN B N 1 ATOM 5019 C CA . GLN D 1 29 ? 59.828 -3.282 107.570 1.00 50.50 ? 395 GLN B CA 1 ATOM 5020 C C . GLN D 1 29 ? 60.721 -3.330 108.803 1.00 51.03 ? 395 GLN B C 1 ATOM 5021 O O . GLN D 1 29 ? 60.235 -3.263 109.931 1.00 52.84 ? 395 GLN B O 1 ATOM 5022 C CB . GLN D 1 29 ? 60.175 -2.076 106.696 1.00 52.39 ? 395 GLN B CB 1 ATOM 5023 C CG . GLN D 1 29 ? 59.313 -1.950 105.449 1.00 56.07 ? 395 GLN B CG 1 ATOM 5024 C CD . GLN D 1 29 ? 59.363 -3.188 104.571 1.00 64.32 ? 395 GLN B CD 1 ATOM 5025 O OE1 . GLN D 1 29 ? 60.437 -3.726 104.291 1.00 65.18 ? 395 GLN B OE1 1 ATOM 5026 N NE2 . GLN D 1 29 ? 58.197 -3.647 104.132 1.00 68.87 ? 395 GLN B NE2 1 ATOM 5027 N N . VAL D 1 30 ? 62.025 -3.443 108.583 1.00 51.59 ? 396 VAL B N 1 ATOM 5028 C CA . VAL D 1 30 ? 62.971 -3.659 109.668 1.00 49.98 ? 396 VAL B CA 1 ATOM 5029 C C . VAL D 1 30 ? 63.016 -2.477 110.645 1.00 53.33 ? 396 VAL B C 1 ATOM 5030 O O . VAL D 1 30 ? 63.169 -2.669 111.853 1.00 51.08 ? 396 VAL B O 1 ATOM 5031 C CB . VAL D 1 30 ? 64.390 -3.945 109.107 1.00 52.11 ? 396 VAL B CB 1 ATOM 5032 C CG1 . VAL D 1 30 ? 64.849 -2.827 108.180 1.00 49.66 ? 396 VAL B CG1 1 ATOM 5033 C CG2 . VAL D 1 30 ? 65.387 -4.174 110.233 1.00 51.59 ? 396 VAL B CG2 1 ATOM 5034 N N . TYR D 1 31 ? 62.849 -1.263 110.130 1.00 54.09 ? 397 TYR B N 1 ATOM 5035 C CA . TYR D 1 31 ? 62.936 -0.067 110.963 1.00 49.03 ? 397 TYR B CA 1 ATOM 5036 C C . TYR D 1 31 ? 61.629 0.213 111.701 1.00 49.91 ? 397 TYR B C 1 ATOM 5037 O O . TYR D 1 31 ? 61.582 1.051 112.602 1.00 52.76 ? 397 TYR B O 1 ATOM 5038 C CB . TYR D 1 31 ? 63.342 1.149 110.120 1.00 51.31 ? 397 TYR B CB 1 ATOM 5039 C CG . TYR D 1 31 ? 62.484 1.392 108.896 1.00 54.62 ? 397 TYR B CG 1 ATOM 5040 C CD1 . TYR D 1 31 ? 62.814 0.827 107.669 1.00 56.52 ? 397 TYR B CD1 1 ATOM 5041 C CD2 . TYR D 1 31 ? 61.357 2.200 108.961 1.00 54.72 ? 397 TYR B CD2 1 ATOM 5042 C CE1 . TYR D 1 31 ? 62.039 1.050 106.546 1.00 56.21 ? 397 TYR B CE1 1 ATOM 5043 C CE2 . TYR D 1 31 ? 60.573 2.430 107.840 1.00 55.12 ? 397 TYR B CE2 1 ATOM 5044 C CZ . TYR D 1 31 ? 60.921 1.851 106.636 1.00 54.57 ? 397 TYR B CZ 1 ATOM 5045 O OH . TYR D 1 31 ? 60.150 2.071 105.516 1.00 54.02 ? 397 TYR B OH 1 ATOM 5046 N N . ASN D 1 32 ? 60.570 -0.491 111.318 1.00 51.47 ? 398 ASN B N 1 ATOM 5047 C CA . ASN D 1 32 ? 59.293 -0.384 112.016 1.00 50.49 ? 398 ASN B CA 1 ATOM 5048 C C . ASN D 1 32 ? 58.894 -1.707 112.652 1.00 49.08 ? 398 ASN B C 1 ATOM 5049 O O . ASN D 1 32 ? 57.715 -2.054 112.677 1.00 49.28 ? 398 ASN B O 1 ATOM 5050 C CB . ASN D 1 32 ? 58.191 0.085 111.064 1.00 55.09 ? 398 ASN B CB 1 ATOM 5051 C CG . ASN D 1 32 ? 58.337 1.542 110.674 1.00 61.33 ? 398 ASN B CG 1 ATOM 5052 O OD1 . ASN D 1 32 ? 58.931 2.335 111.403 1.00 66.27 ? 398 ASN B OD1 1 ATOM 5053 N ND2 . ASN D 1 32 ? 57.789 1.902 109.520 1.00 65.09 ? 398 ASN B ND2 1 ATOM 5054 N N . PHE D 1 33 ? 59.880 -2.434 113.171 1.00 46.28 ? 399 PHE B N 1 ATOM 5055 C CA . PHE D 1 33 ? 59.660 -3.776 113.701 1.00 48.39 ? 399 PHE B CA 1 ATOM 5056 C C . PHE D 1 33 ? 58.612 -3.807 114.811 1.00 46.84 ? 399 PHE B C 1 ATOM 5057 O O . PHE D 1 33 ? 58.558 -2.915 115.654 1.00 44.96 ? 399 PHE B O 1 ATOM 5058 C CB . PHE D 1 33 ? 60.980 -4.374 114.209 1.00 54.17 ? 399 PHE B CB 1 ATOM 5059 C CG . PHE D 1 33 ? 61.595 -3.626 115.366 1.00 57.31 ? 399 PHE B CG 1 ATOM 5060 C CD1 . PHE D 1 33 ? 61.371 -4.033 116.674 1.00 54.57 ? 399 PHE B CD1 1 ATOM 5061 C CD2 . PHE D 1 33 ? 62.414 -2.529 115.144 1.00 59.04 ? 399 PHE B CD2 1 ATOM 5062 C CE1 . PHE D 1 33 ? 61.942 -3.354 117.738 1.00 50.01 ? 399 PHE B CE1 1 ATOM 5063 C CE2 . PHE D 1 33 ? 62.988 -1.845 116.204 1.00 56.76 ? 399 PHE B CE2 1 ATOM 5064 C CZ . PHE D 1 33 ? 62.750 -2.259 117.503 1.00 51.91 ? 399 PHE B CZ 1 ATOM 5065 N N . LYS D 1 34 ? 57.773 -4.838 114.788 1.00 48.36 ? 400 LYS B N 1 ATOM 5066 C CA . LYS D 1 34 ? 56.766 -5.037 115.823 1.00 48.26 ? 400 LYS B CA 1 ATOM 5067 C C . LYS D 1 34 ? 57.320 -5.916 116.937 1.00 46.81 ? 400 LYS B C 1 ATOM 5068 O O . LYS D 1 34 ? 57.961 -6.933 116.679 1.00 49.08 ? 400 LYS B O 1 ATOM 5069 C CB . LYS D 1 34 ? 55.495 -5.656 115.234 1.00 52.32 ? 400 LYS B CB 1 ATOM 5070 C CG . LYS D 1 34 ? 54.682 -4.695 114.372 1.00 63.61 ? 400 LYS B CG 1 ATOM 5071 C CD . LYS D 1 34 ? 53.492 -5.388 113.714 1.00 69.05 ? 400 LYS B CD 1 ATOM 5072 C CE . LYS D 1 34 ? 52.768 -4.457 112.750 1.00 67.81 ? 400 LYS B CE 1 ATOM 5073 N NZ . LYS D 1 34 ? 51.693 -5.160 111.992 1.00 70.45 ? 400 LYS B NZ 1 ATOM 5074 N N . ARG D 1 35 ? 57.065 -5.514 118.177 1.00 49.36 ? 401 ARG B N 1 ATOM 5075 C CA . ARG D 1 35 ? 57.603 -6.209 119.338 1.00 48.49 ? 401 ARG B CA 1 ATOM 5076 C C . ARG D 1 35 ? 56.516 -6.891 120.160 1.00 49.01 ? 401 ARG B C 1 ATOM 5077 O O . ARG D 1 35 ? 55.572 -6.248 120.620 1.00 50.56 ? 401 ARG B O 1 ATOM 5078 C CB . ARG D 1 35 ? 58.386 -5.231 120.221 1.00 49.44 ? 401 ARG B CB 1 ATOM 5079 C CG . ARG D 1 35 ? 58.797 -5.793 121.574 1.00 51.34 ? 401 ARG B CG 1 ATOM 5080 C CD . ARG D 1 35 ? 59.912 -4.964 122.200 1.00 53.82 ? 401 ARG B CD 1 ATOM 5081 N NE . ARG D 1 35 ? 61.180 -5.155 121.502 1.00 52.70 ? 401 ARG B NE 1 ATOM 5082 C CZ . ARG D 1 35 ? 62.318 -4.552 121.831 1.00 56.37 ? 401 ARG B CZ 1 ATOM 5083 N NH1 . ARG D 1 35 ? 62.357 -3.706 122.852 1.00 57.68 ? 401 ARG B NH1 1 ATOM 5084 N NH2 . ARG D 1 35 ? 63.421 -4.795 121.137 1.00 59.68 ? 401 ARG B NH2 1 ATOM 5085 N N . LEU D 1 36 ? 56.654 -8.200 120.334 1.00 45.69 ? 402 LEU B N 1 ATOM 5086 C CA . LEU D 1 36 ? 55.791 -8.945 121.239 1.00 44.55 ? 402 LEU B CA 1 ATOM 5087 C C . LEU D 1 36 ? 56.526 -9.202 122.553 1.00 45.68 ? 402 LEU B C 1 ATOM 5088 O O . LEU D 1 36 ? 57.666 -9.671 122.559 1.00 38.74 ? 402 LEU B O 1 ATOM 5089 C CB . LEU D 1 36 ? 55.343 -10.266 120.608 1.00 43.68 ? 402 LEU B CB 1 ATOM 5090 C CG . LEU D 1 36 ? 54.560 -10.185 119.294 1.00 49.52 ? 402 LEU B CG 1 ATOM 5091 C CD1 . LEU D 1 36 ? 54.241 -11.578 118.771 1.00 51.42 ? 402 LEU B CD1 1 ATOM 5092 C CD2 . LEU D 1 36 ? 53.286 -9.369 119.464 1.00 43.71 ? 402 LEU B CD2 1 ATOM 5093 N N . VAL D 1 37 ? 55.869 -8.881 123.662 1.00 43.50 ? 403 VAL B N 1 ATOM 5094 C CA . VAL D 1 37 ? 56.447 -9.086 124.983 1.00 44.08 ? 403 VAL B CA 1 ATOM 5095 C C . VAL D 1 37 ? 55.663 -10.150 125.744 1.00 47.99 ? 403 VAL B C 1 ATOM 5096 O O . VAL D 1 37 ? 54.439 -10.070 125.850 1.00 61.79 ? 403 VAL B O 1 ATOM 5097 C CB . VAL D 1 37 ? 56.464 -7.778 125.792 1.00 47.57 ? 403 VAL B CB 1 ATOM 5098 C CG1 . VAL D 1 37 ? 57.121 -7.997 127.145 1.00 45.21 ? 403 VAL B CG1 1 ATOM 5099 C CG2 . VAL D 1 37 ? 57.178 -6.684 125.012 1.00 46.59 ? 403 VAL B CG2 1 ATOM 5100 N N . PHE D 1 38 ? 56.366 -11.145 126.275 1.00 43.42 ? 404 PHE B N 1 ATOM 5101 C CA . PHE D 1 38 ? 55.709 -12.259 126.949 1.00 46.01 ? 404 PHE B CA 1 ATOM 5102 C C . PHE D 1 38 ? 56.143 -12.407 128.401 1.00 51.30 ? 404 PHE B C 1 ATOM 5103 O O . PHE D 1 38 ? 57.328 -12.542 128.696 1.00 56.32 ? 404 PHE B O 1 ATOM 5104 C CB . PHE D 1 38 ? 55.980 -13.564 126.198 1.00 44.50 ? 404 PHE B CB 1 ATOM 5105 C CG . PHE D 1 38 ? 55.505 -13.549 124.777 1.00 47.94 ? 404 PHE B CG 1 ATOM 5106 C CD1 . PHE D 1 38 ? 54.186 -13.837 124.470 1.00 53.06 ? 404 PHE B CD1 1 ATOM 5107 C CD2 . PHE D 1 38 ? 56.376 -13.242 123.746 1.00 48.91 ? 404 PHE B CD2 1 ATOM 5108 C CE1 . PHE D 1 38 ? 53.747 -13.821 123.162 1.00 56.06 ? 404 PHE B CE1 1 ATOM 5109 C CE2 . PHE D 1 38 ? 55.942 -13.226 122.437 1.00 51.26 ? 404 PHE B CE2 1 ATOM 5110 C CZ . PHE D 1 38 ? 54.626 -13.514 122.145 1.00 52.34 ? 404 PHE B CZ 1 ATOM 5111 N N . THR D 1 39 ? 55.166 -12.375 129.303 1.00 53.91 ? 405 THR B N 1 ATOM 5112 C CA . THR D 1 39 ? 55.390 -12.641 130.719 1.00 54.97 ? 405 THR B CA 1 ATOM 5113 C C . THR D 1 39 ? 54.274 -13.539 131.247 1.00 64.02 ? 405 THR B C 1 ATOM 5114 O O . THR D 1 39 ? 53.118 -13.397 130.843 1.00 74.61 ? 405 THR B O 1 ATOM 5115 C CB . THR D 1 39 ? 55.440 -11.344 131.558 1.00 52.77 ? 405 THR B CB 1 ATOM 5116 O OG1 . THR D 1 39 ? 54.196 -10.644 131.440 1.00 58.07 ? 405 THR B OG1 1 ATOM 5117 C CG2 . THR D 1 39 ? 56.570 -10.436 131.095 1.00 47.15 ? 405 THR B CG2 1 ATOM 5118 N N . ASN D 1 40 ? 54.625 -14.460 132.141 1.00 61.04 ? 406 ASN B N 1 ATOM 5119 C CA . ASN D 1 40 ? 53.661 -15.377 132.750 1.00 68.78 ? 406 ASN B CA 1 ATOM 5120 C C . ASN D 1 40 ? 52.854 -16.176 131.730 1.00 66.44 ? 406 ASN B C 1 ATOM 5121 O O . ASN D 1 40 ? 51.624 -16.126 131.719 1.00 71.15 ? 406 ASN B O 1 ATOM 5122 C CB . ASN D 1 40 ? 52.706 -14.616 133.675 1.00 79.07 ? 406 ASN B CB 1 ATOM 5123 C CG . ASN D 1 40 ? 53.410 -14.023 134.879 1.00 85.19 ? 406 ASN B CG 1 ATOM 5124 O OD1 . ASN D 1 40 ? 53.619 -14.701 135.886 1.00 90.06 ? 406 ASN B OD1 1 ATOM 5125 N ND2 . ASN D 1 40 ? 53.780 -12.751 134.783 1.00 83.60 ? 406 ASN B ND2 1 ATOM 5126 N N . CYS D 1 41 ? 53.557 -16.914 130.879 1.00 62.18 ? 407 CYS B N 1 ATOM 5127 C CA . CYS D 1 41 ? 52.920 -17.755 129.877 1.00 59.01 ? 407 CYS B CA 1 ATOM 5128 C C . CYS D 1 41 ? 53.878 -18.842 129.405 1.00 63.23 ? 407 CYS B C 1 ATOM 5129 O O . CYS D 1 41 ? 55.083 -18.764 129.640 1.00 61.74 ? 407 CYS B O 1 ATOM 5130 C CB . CYS D 1 41 ? 52.449 -16.916 128.688 1.00 59.76 ? 407 CYS B CB 1 ATOM 5131 S SG . CYS D 1 41 ? 53.782 -16.089 127.789 1.00 58.65 ? 407 CYS B SG 1 ATOM 5132 N N . ASN D 1 42 ? 53.339 -19.856 128.738 1.00 66.52 ? 408 ASN B N 1 ATOM 5133 C CA . ASN D 1 42 ? 54.160 -20.940 128.216 1.00 61.51 ? 408 ASN B CA 1 ATOM 5134 C C . ASN D 1 42 ? 54.271 -20.878 126.698 1.00 62.21 ? 408 ASN B C 1 ATOM 5135 O O . ASN D 1 42 ? 53.266 -20.759 125.997 1.00 62.02 ? 408 ASN B O 1 ATOM 5136 C CB . ASN D 1 42 ? 53.599 -22.292 128.655 1.00 63.88 ? 408 ASN B CB 1 ATOM 5137 C CG . ASN D 1 42 ? 53.599 -22.458 130.161 1.00 68.33 ? 408 ASN B CG 1 ATOM 5138 O OD1 . ASN D 1 42 ? 52.563 -22.731 130.767 1.00 77.82 ? 408 ASN B OD1 1 ATOM 5139 N ND2 . ASN D 1 42 ? 54.764 -22.287 130.775 1.00 64.11 ? 408 ASN B ND2 1 ATOM 5140 N N . TYR D 1 43 ? 55.499 -20.960 126.196 1.00 62.07 ? 409 TYR B N 1 ATOM 5141 C CA . TYR D 1 43 ? 55.756 -20.790 124.771 1.00 60.76 ? 409 TYR B CA 1 ATOM 5142 C C . TYR D 1 43 ? 56.087 -22.102 124.069 1.00 66.65 ? 409 TYR B C 1 ATOM 5143 O O . TYR D 1 43 ? 56.487 -23.078 124.699 1.00 69.71 ? 409 TYR B O 1 ATOM 5144 C CB . TYR D 1 43 ? 56.897 -19.794 124.554 1.00 53.05 ? 409 TYR B CB 1 ATOM 5145 C CG . TYR D 1 43 ? 58.246 -20.276 125.041 1.00 55.17 ? 409 TYR B CG 1 ATOM 5146 C CD1 . TYR D 1 43 ? 59.130 -20.918 124.180 1.00 56.22 ? 409 TYR B CD1 1 ATOM 5147 C CD2 . TYR D 1 43 ? 58.642 -20.082 126.357 1.00 57.94 ? 409 TYR B CD2 1 ATOM 5148 C CE1 . TYR D 1 43 ? 60.363 -21.357 124.619 1.00 55.82 ? 409 TYR B CE1 1 ATOM 5149 C CE2 . TYR D 1 43 ? 59.874 -20.518 126.804 1.00 57.69 ? 409 TYR B CE2 1 ATOM 5150 C CZ . TYR D 1 43 ? 60.730 -21.155 125.932 1.00 57.11 ? 409 TYR B CZ 1 ATOM 5151 O OH . TYR D 1 43 ? 61.959 -21.590 126.374 1.00 55.14 ? 409 TYR B OH 1 ATOM 5152 N N . ASN D 1 44 ? 55.919 -22.107 122.752 1.00 65.48 ? 410 ASN B N 1 ATOM 5153 C CA . ASN D 1 44 ? 56.288 -23.248 121.929 1.00 68.84 ? 410 ASN B CA 1 ATOM 5154 C C . ASN D 1 44 ? 57.037 -22.769 120.691 1.00 70.15 ? 410 ASN B C 1 ATOM 5155 O O . ASN D 1 44 ? 56.436 -22.516 119.647 1.00 68.88 ? 410 ASN B O 1 ATOM 5156 C CB . ASN D 1 44 ? 55.046 -24.052 121.539 1.00 75.78 ? 410 ASN B CB 1 ATOM 5157 C CG . ASN D 1 44 ? 55.383 -25.361 120.848 1.00 84.86 ? 410 ASN B CG 1 ATOM 5158 O OD1 . ASN D 1 44 ? 56.511 -25.580 120.407 1.00 82.88 ? 410 ASN B OD1 1 ATOM 5159 N ND2 . ASN D 1 44 ? 54.395 -26.238 120.748 1.00 103.11 ? 410 ASN B ND2 1 ATOM 5160 N N . LEU D 1 45 ? 58.354 -22.643 120.819 1.00 56.98 ? 411 LEU B N 1 ATOM 5161 C CA . LEU D 1 45 ? 59.187 -22.137 119.737 1.00 54.04 ? 411 LEU B CA 1 ATOM 5162 C C . LEU D 1 45 ? 59.224 -23.114 118.566 1.00 55.68 ? 411 LEU B C 1 ATOM 5163 O O . LEU D 1 45 ? 59.327 -22.708 117.406 1.00 53.76 ? 411 LEU B O 1 ATOM 5164 C CB . LEU D 1 45 ? 60.602 -21.856 120.245 1.00 57.58 ? 411 LEU B CB 1 ATOM 5165 C CG . LEU D 1 45 ? 61.536 -21.163 119.254 1.00 64.41 ? 411 LEU B CG 1 ATOM 5166 C CD1 . LEU D 1 45 ? 60.856 -19.946 118.645 1.00 65.59 ? 411 LEU B CD1 1 ATOM 5167 C CD2 . LEU D 1 45 ? 62.844 -20.774 119.925 1.00 65.03 ? 411 LEU B CD2 1 ATOM 5168 N N . THR D 1 46 ? 59.130 -24.402 118.880 1.00 59.15 ? 412 THR B N 1 ATOM 5169 C CA . THR D 1 46 ? 59.112 -25.452 117.869 1.00 56.52 ? 412 THR B CA 1 ATOM 5170 C C . THR D 1 46 ? 57.934 -25.280 116.915 1.00 63.35 ? 412 THR B C 1 ATOM 5171 O O . THR D 1 46 ? 58.055 -25.518 115.711 1.00 66.51 ? 412 THR B O 1 ATOM 5172 C CB . THR D 1 46 ? 59.036 -26.847 118.518 1.00 55.25 ? 412 THR B CB 1 ATOM 5173 O OG1 . THR D 1 46 ? 60.023 -26.949 119.551 1.00 60.79 ? 412 THR B OG1 1 ATOM 5174 C CG2 . THR D 1 46 ? 59.269 -27.937 117.482 1.00 55.52 ? 412 THR B CG2 1 ATOM 5175 N N . LYS D 1 47 ? 56.796 -24.862 117.461 1.00 66.21 ? 413 LYS B N 1 ATOM 5176 C CA . LYS D 1 47 ? 55.597 -24.643 116.660 1.00 69.45 ? 413 LYS B CA 1 ATOM 5177 C C . LYS D 1 47 ? 55.774 -23.449 115.729 1.00 68.04 ? 413 LYS B C 1 ATOM 5178 O O . LYS D 1 47 ? 55.370 -23.490 114.570 1.00 70.11 ? 413 LYS B O 1 ATOM 5179 C CB . LYS D 1 47 ? 54.382 -24.434 117.565 1.00 72.31 ? 413 LYS B CB 1 ATOM 5180 C CG . LYS D 1 47 ? 53.056 -24.375 116.829 1.00 82.40 ? 413 LYS B CG 1 ATOM 5181 C CD . LYS D 1 47 ? 51.900 -24.267 117.808 1.00 86.43 ? 413 LYS B CD 1 ATOM 5182 C CE . LYS D 1 47 ? 50.573 -24.150 117.086 1.00 92.82 ? 413 LYS B CE 1 ATOM 5183 N NZ . LYS D 1 47 ? 49.443 -24.024 118.045 1.00 98.53 ? 413 LYS B NZ 1 ATOM 5184 N N . LEU D 1 48 ? 56.385 -22.388 116.247 1.00 67.44 ? 414 LEU B N 1 ATOM 5185 C CA . LEU D 1 48 ? 56.634 -21.180 115.468 1.00 66.48 ? 414 LEU B CA 1 ATOM 5186 C C . LEU D 1 48 ? 57.560 -21.454 114.289 1.00 65.04 ? 414 LEU B C 1 ATOM 5187 O O . LEU D 1 48 ? 57.297 -21.016 113.168 1.00 66.03 ? 414 LEU B O 1 ATOM 5188 C CB . LEU D 1 48 ? 57.233 -20.087 116.355 1.00 64.56 ? 414 LEU B CB 1 ATOM 5189 C CG . LEU D 1 48 ? 57.545 -18.766 115.649 1.00 63.92 ? 414 LEU B CG 1 ATOM 5190 C CD1 . LEU D 1 48 ? 56.290 -18.194 115.006 1.00 64.24 ? 414 LEU B CD1 1 ATOM 5191 C CD2 . LEU D 1 48 ? 58.159 -17.771 116.621 1.00 60.94 ? 414 LEU B CD2 1 ATOM 5192 N N . LEU D 1 49 ? 58.643 -22.180 114.550 1.00 60.38 ? 415 LEU B N 1 ATOM 5193 C CA . LEU D 1 49 ? 59.612 -22.521 113.515 1.00 59.14 ? 415 LEU B CA 1 ATOM 5194 C C . LEU D 1 49 ? 59.042 -23.512 112.505 1.00 63.17 ? 415 LEU B C 1 ATOM 5195 O O . LEU D 1 49 ? 59.492 -23.566 111.360 1.00 69.60 ? 415 LEU B O 1 ATOM 5196 C CB . LEU D 1 49 ? 60.882 -23.094 114.145 1.00 60.55 ? 415 LEU B CB 1 ATOM 5197 C CG . LEU D 1 49 ? 61.613 -22.170 115.117 1.00 60.28 ? 415 LEU B CG 1 ATOM 5198 C CD1 . LEU D 1 49 ? 62.940 -22.780 115.545 1.00 62.55 ? 415 LEU B CD1 1 ATOM 5199 C CD2 . LEU D 1 49 ? 61.820 -20.797 114.499 1.00 57.78 ? 415 LEU B CD2 1 ATOM 5200 N N . SER D 1 50 ? 58.056 -24.295 112.933 1.00 61.96 ? 416 SER B N 1 ATOM 5201 C CA . SER D 1 50 ? 57.427 -25.277 112.056 1.00 64.54 ? 416 SER B CA 1 ATOM 5202 C C . SER D 1 50 ? 56.622 -24.603 110.955 1.00 66.06 ? 416 SER B C 1 ATOM 5203 O O . SER D 1 50 ? 56.495 -25.135 109.852 1.00 69.12 ? 416 SER B O 1 ATOM 5204 C CB . SER D 1 50 ? 56.521 -26.214 112.856 1.00 71.75 ? 416 SER B CB 1 ATOM 5205 O OG . SER D 1 50 ? 57.249 -26.899 113.858 1.00 80.49 ? 416 SER B OG 1 ATOM 5206 N N . LEU D 1 51 ? 56.077 -23.430 111.260 1.00 66.68 ? 417 LEU B N 1 ATOM 5207 C CA . LEU D 1 51 ? 55.224 -22.720 110.313 1.00 66.72 ? 417 LEU B CA 1 ATOM 5208 C C . LEU D 1 51 ? 56.044 -21.970 109.273 1.00 64.10 ? 417 LEU B C 1 ATOM 5209 O O . LEU D 1 51 ? 55.502 -21.477 108.286 1.00 64.16 ? 417 LEU B O 1 ATOM 5210 C CB . LEU D 1 51 ? 54.295 -21.747 111.045 1.00 63.75 ? 417 LEU B CB 1 ATOM 5211 C CG . LEU D 1 51 ? 52.905 -22.270 111.424 1.00 71.73 ? 417 LEU B CG 1 ATOM 5212 C CD1 . LEU D 1 51 ? 52.130 -22.709 110.187 1.00 74.55 ? 417 LEU B CD1 1 ATOM 5213 C CD2 . LEU D 1 51 ? 52.996 -23.406 112.428 1.00 77.39 ? 417 LEU B CD2 1 ATOM 5214 N N . PHE D 1 52 ? 57.351 -21.893 109.492 1.00 63.50 ? 418 PHE B N 1 ATOM 5215 C CA . PHE D 1 52 ? 58.227 -21.177 108.574 1.00 61.69 ? 418 PHE B CA 1 ATOM 5216 C C . PHE D 1 52 ? 59.335 -22.056 108.005 1.00 62.35 ? 418 PHE B C 1 ATOM 5217 O O . PHE D 1 52 ? 59.627 -23.135 108.525 1.00 62.18 ? 418 PHE B O 1 ATOM 5218 C CB . PHE D 1 52 ? 58.841 -19.961 109.270 1.00 56.59 ? 418 PHE B CB 1 ATOM 5219 C CG . PHE D 1 52 ? 57.848 -18.885 109.592 1.00 59.21 ? 418 PHE B CG 1 ATOM 5220 C CD1 . PHE D 1 52 ? 57.194 -18.868 110.812 1.00 55.47 ? 418 PHE B CD1 1 ATOM 5221 C CD2 . PHE D 1 52 ? 57.561 -17.893 108.668 1.00 61.83 ? 418 PHE B CD2 1 ATOM 5222 C CE1 . PHE D 1 52 ? 56.275 -17.878 111.107 1.00 53.73 ? 418 PHE B CE1 1 ATOM 5223 C CE2 . PHE D 1 52 ? 56.644 -16.902 108.957 1.00 58.35 ? 418 PHE B CE2 1 ATOM 5224 C CZ . PHE D 1 52 ? 55.999 -16.895 110.179 1.00 54.77 ? 418 PHE B CZ 1 ATOM 5225 N N . SER D 1 53 ? 59.940 -21.581 106.922 1.00 60.17 ? 419 SER B N 1 ATOM 5226 C CA . SER D 1 53 ? 61.107 -22.224 106.338 1.00 61.34 ? 419 SER B CA 1 ATOM 5227 C C . SER D 1 53 ? 62.368 -21.497 106.800 1.00 59.43 ? 419 SER B C 1 ATOM 5228 O O . SER D 1 53 ? 62.831 -20.560 106.148 1.00 58.85 ? 419 SER B O 1 ATOM 5229 C CB . SER D 1 53 ? 61.012 -22.232 104.810 1.00 64.41 ? 419 SER B CB 1 ATOM 5230 O OG . SER D 1 53 ? 62.120 -22.899 104.230 1.00 70.12 ? 419 SER B OG 1 ATOM 5231 N N . VAL D 1 54 ? 62.910 -21.931 107.936 1.00 58.90 ? 420 VAL B N 1 ATOM 5232 C CA . VAL D 1 54 ? 64.043 -21.261 108.566 1.00 54.66 ? 420 VAL B CA 1 ATOM 5233 C C . VAL D 1 54 ? 65.334 -21.410 107.765 1.00 60.93 ? 420 VAL B C 1 ATOM 5234 O O . VAL D 1 54 ? 65.833 -22.518 107.566 1.00 62.46 ? 420 VAL B O 1 ATOM 5235 C CB . VAL D 1 54 ? 64.281 -21.794 109.985 1.00 50.63 ? 420 VAL B CB 1 ATOM 5236 C CG1 . VAL D 1 54 ? 65.466 -21.085 110.627 1.00 48.95 ? 420 VAL B CG1 1 ATOM 5237 C CG2 . VAL D 1 54 ? 63.027 -21.623 110.829 1.00 46.71 ? 420 VAL B CG2 1 ATOM 5238 N N . ASN D 1 55 ? 65.874 -20.279 107.320 1.00 60.97 ? 421 ASN B N 1 ATOM 5239 C CA . ASN D 1 55 ? 67.089 -20.269 106.512 1.00 58.44 ? 421 ASN B CA 1 ATOM 5240 C C . ASN D 1 55 ? 68.343 -19.983 107.336 1.00 56.36 ? 421 ASN B C 1 ATOM 5241 O O . ASN D 1 55 ? 69.457 -20.293 106.913 1.00 55.61 ? 421 ASN B O 1 ATOM 5242 C CB . ASN D 1 55 ? 66.959 -19.240 105.387 1.00 57.08 ? 421 ASN B CB 1 ATOM 5243 C CG . ASN D 1 55 ? 65.768 -19.509 104.489 1.00 62.60 ? 421 ASN B CG 1 ATOM 5244 O OD1 . ASN D 1 55 ? 64.912 -18.645 104.297 1.00 63.86 ? 421 ASN B OD1 1 ATOM 5245 N ND2 . ASN D 1 55 ? 65.706 -20.714 103.933 1.00 65.50 ? 421 ASN B ND2 1 ATOM 5246 N N . ASP D 1 56 ? 68.157 -19.391 108.512 1.00 55.42 ? 422 ASP B N 1 ATOM 5247 C CA . ASP D 1 56 ? 69.277 -19.059 109.388 1.00 57.53 ? 422 ASP B CA 1 ATOM 5248 C C . ASP D 1 56 ? 68.822 -18.892 110.836 1.00 54.23 ? 422 ASP B C 1 ATOM 5249 O O . ASP D 1 56 ? 67.861 -18.178 111.117 1.00 48.82 ? 422 ASP B O 1 ATOM 5250 C CB . ASP D 1 56 ? 69.972 -17.785 108.905 1.00 64.98 ? 422 ASP B CB 1 ATOM 5251 C CG . ASP D 1 56 ? 71.326 -17.575 109.555 1.00 72.54 ? 422 ASP B CG 1 ATOM 5252 O OD1 . ASP D 1 56 ? 71.386 -16.931 110.625 1.00 69.59 ? 422 ASP B OD1 1 ATOM 5253 O OD2 . ASP D 1 56 ? 72.333 -18.055 108.991 1.00 79.47 ? 422 ASP B OD2 1 ATOM 5254 N N . PHE D 1 57 ? 69.522 -19.559 111.748 1.00 56.51 ? 423 PHE B N 1 ATOM 5255 C CA . PHE D 1 57 ? 69.208 -19.508 113.171 1.00 53.31 ? 423 PHE B CA 1 ATOM 5256 C C . PHE D 1 57 ? 70.505 -19.322 113.957 1.00 58.31 ? 423 PHE B C 1 ATOM 5257 O O . PHE D 1 57 ? 71.189 -20.293 114.287 1.00 60.85 ? 423 PHE B O 1 ATOM 5258 C CB . PHE D 1 57 ? 68.477 -20.785 113.603 1.00 51.22 ? 423 PHE B CB 1 ATOM 5259 C CG . PHE D 1 57 ? 67.728 -20.666 114.908 1.00 54.30 ? 423 PHE B CG 1 ATOM 5260 C CD1 . PHE D 1 57 ? 67.931 -19.591 115.762 1.00 60.70 ? 423 PHE B CD1 1 ATOM 5261 C CD2 . PHE D 1 57 ? 66.822 -21.646 115.285 1.00 52.25 ? 423 PHE B CD2 1 ATOM 5262 C CE1 . PHE D 1 57 ? 67.242 -19.496 116.964 1.00 54.31 ? 423 PHE B CE1 1 ATOM 5263 C CE2 . PHE D 1 57 ? 66.133 -21.556 116.482 1.00 49.74 ? 423 PHE B CE2 1 ATOM 5264 C CZ . PHE D 1 57 ? 66.342 -20.479 117.321 1.00 47.92 ? 423 PHE B CZ 1 ATOM 5265 N N . THR D 1 58 ? 70.842 -18.068 114.243 1.00 58.37 ? 424 THR B N 1 ATOM 5266 C CA . THR D 1 58 ? 72.057 -17.747 114.984 1.00 57.83 ? 424 THR B CA 1 ATOM 5267 C C . THR D 1 58 ? 71.717 -17.053 116.301 1.00 57.65 ? 424 THR B C 1 ATOM 5268 O O . THR D 1 58 ? 70.753 -16.290 116.382 1.00 58.24 ? 424 THR B O 1 ATOM 5269 C CB . THR D 1 58 ? 73.006 -16.855 114.154 1.00 59.97 ? 424 THR B CB 1 ATOM 5270 O OG1 . THR D 1 58 ? 74.069 -16.379 114.986 1.00 66.07 ? 424 THR B OG1 1 ATOM 5271 C CG2 . THR D 1 58 ? 72.256 -15.666 113.574 1.00 62.22 ? 424 THR B CG2 1 ATOM 5272 N N . CYS D 1 59 ? 72.503 -17.330 117.336 1.00 56.58 ? 425 CYS B N 1 ATOM 5273 C CA . CYS D 1 59 ? 72.240 -16.767 118.656 1.00 50.45 ? 425 CYS B CA 1 ATOM 5274 C C . CYS D 1 59 ? 73.492 -16.160 119.273 1.00 55.46 ? 425 CYS B C 1 ATOM 5275 O O . CYS D 1 59 ? 74.612 -16.440 118.845 1.00 59.27 ? 425 CYS B O 1 ATOM 5276 C CB . CYS D 1 59 ? 71.671 -17.833 119.594 1.00 44.08 ? 425 CYS B CB 1 ATOM 5277 S SG . CYS D 1 59 ? 70.078 -18.519 119.092 1.00 55.34 ? 425 CYS B SG 1 ATOM 5278 N N . SER D 1 60 ? 73.287 -15.326 120.287 1.00 51.52 ? 426 SER B N 1 ATOM 5279 C CA . SER D 1 60 ? 74.385 -14.690 121.000 1.00 45.80 ? 426 SER B CA 1 ATOM 5280 C C . SER D 1 60 ? 74.250 -14.935 122.498 1.00 44.79 ? 426 SER B C 1 ATOM 5281 O O . SER D 1 60 ? 73.230 -14.592 123.095 1.00 47.60 ? 426 SER B O 1 ATOM 5282 C CB . SER D 1 60 ? 74.416 -13.192 120.702 1.00 46.75 ? 426 SER B CB 1 ATOM 5283 O OG . SER D 1 60 ? 75.435 -12.550 121.441 1.00 55.68 ? 426 SER B OG 1 ATOM 5284 N N . GLN D 1 61 ? 75.278 -15.545 123.085 1.00 49.04 ? 427 GLN B N 1 ATOM 5285 C CA . GLN D 1 61 ? 75.321 -15.868 124.514 1.00 51.09 ? 427 GLN B CA 1 ATOM 5286 C C . GLN D 1 61 ? 74.233 -16.864 124.917 1.00 49.56 ? 427 GLN B C 1 ATOM 5287 O O . GLN D 1 61 ? 73.865 -16.961 126.087 1.00 51.52 ? 427 GLN B O 1 ATOM 5288 C CB . GLN D 1 61 ? 75.213 -14.595 125.355 1.00 52.99 ? 427 GLN B CB 1 ATOM 5289 C CG . GLN D 1 61 ? 76.264 -13.559 125.017 1.00 60.28 ? 427 GLN B CG 1 ATOM 5290 C CD . GLN D 1 61 ? 76.122 -12.302 125.843 1.00 71.80 ? 427 GLN B CD 1 ATOM 5291 O OE1 . GLN D 1 61 ? 76.792 -12.140 126.865 1.00 85.17 ? 427 GLN B OE1 1 ATOM 5292 N NE2 . GLN D 1 61 ? 75.247 -11.401 125.408 1.00 65.65 ? 427 GLN B NE2 1 ATOM 5293 N N . ILE D 1 62 ? 73.732 -17.602 123.933 1.00 48.94 ? 428 ILE B N 1 ATOM 5294 C CA . ILE D 1 62 ? 72.752 -18.657 124.154 1.00 45.00 ? 428 ILE B CA 1 ATOM 5295 C C . ILE D 1 62 ? 72.729 -19.542 122.910 1.00 44.52 ? 428 ILE B C 1 ATOM 5296 O O . ILE D 1 62 ? 73.315 -19.192 121.887 1.00 45.66 ? 428 ILE B O 1 ATOM 5297 C CB . ILE D 1 62 ? 71.345 -18.086 124.449 1.00 44.50 ? 428 ILE B CB 1 ATOM 5298 C CG1 . ILE D 1 62 ? 70.498 -19.101 125.224 1.00 41.99 ? 428 ILE B CG1 1 ATOM 5299 C CG2 . ILE D 1 62 ? 70.657 -17.644 123.165 1.00 42.26 ? 428 ILE B CG2 1 ATOM 5300 C CD1 . ILE D 1 62 ? 69.189 -18.546 125.732 1.00 35.80 ? 428 ILE B CD1 1 ATOM 5301 N N . SER D 1 63 ? 72.082 -20.698 122.999 1.00 46.21 ? 429 SER B N 1 ATOM 5302 C CA . SER D 1 63 ? 72.003 -21.605 121.861 1.00 45.52 ? 429 SER B CA 1 ATOM 5303 C C . SER D 1 63 ? 70.553 -21.791 121.434 1.00 47.90 ? 429 SER B C 1 ATOM 5304 O O . SER D 1 63 ? 69.639 -21.572 122.230 1.00 50.02 ? 429 SER B O 1 ATOM 5305 C CB . SER D 1 63 ? 72.641 -22.958 122.200 1.00 46.11 ? 429 SER B CB 1 ATOM 5306 O OG . SER D 1 63 ? 71.852 -23.686 123.121 1.00 47.79 ? 429 SER B OG 1 ATOM 5307 N N . PRO D 1 64 ? 70.337 -22.174 120.165 1.00 48.96 ? 430 PRO B N 1 ATOM 5308 C CA . PRO D 1 64 ? 68.996 -22.489 119.663 1.00 48.48 ? 430 PRO B CA 1 ATOM 5309 C C . PRO D 1 64 ? 68.301 -23.571 120.488 1.00 49.67 ? 430 PRO B C 1 ATOM 5310 O O . PRO D 1 64 ? 67.084 -23.531 120.656 1.00 46.78 ? 430 PRO B O 1 ATOM 5311 C CB . PRO D 1 64 ? 69.266 -22.975 118.239 1.00 50.36 ? 430 PRO B CB 1 ATOM 5312 C CG . PRO D 1 64 ? 70.498 -22.247 117.837 1.00 48.52 ? 430 PRO B CG 1 ATOM 5313 C CD . PRO D 1 64 ? 71.336 -22.162 119.082 1.00 50.73 ? 430 PRO B CD 1 ATOM 5314 N N . ALA D 1 65 ? 69.071 -24.527 120.996 1.00 51.20 ? 431 ALA B N 1 ATOM 5315 C CA . ALA D 1 65 ? 68.513 -25.567 121.850 1.00 50.36 ? 431 ALA B CA 1 ATOM 5316 C C . ALA D 1 65 ? 68.073 -24.974 123.185 1.00 53.09 ? 431 ALA B C 1 ATOM 5317 O O . ALA D 1 65 ? 66.997 -25.291 123.695 1.00 52.67 ? 431 ALA B O 1 ATOM 5318 C CB . ALA D 1 65 ? 69.525 -26.680 122.066 1.00 46.49 ? 431 ALA B CB 1 ATOM 5319 N N . ALA D 1 66 ? 68.908 -24.103 123.741 1.00 50.84 ? 432 ALA B N 1 ATOM 5320 C CA . ALA D 1 66 ? 68.621 -23.490 125.031 1.00 49.32 ? 432 ALA B CA 1 ATOM 5321 C C . ALA D 1 66 ? 67.478 -22.482 124.952 1.00 46.63 ? 432 ALA B C 1 ATOM 5322 O O . ALA D 1 66 ? 66.658 -22.397 125.866 1.00 48.54 ? 432 ALA B O 1 ATOM 5323 C CB . ALA D 1 66 ? 69.872 -22.820 125.584 1.00 48.06 ? 432 ALA B CB 1 ATOM 5324 N N . ILE D 1 67 ? 67.426 -21.721 123.862 1.00 44.60 ? 433 ILE B N 1 ATOM 5325 C CA . ILE D 1 67 ? 66.443 -20.648 123.731 1.00 42.54 ? 433 ILE B CA 1 ATOM 5326 C C . ILE D 1 67 ? 65.016 -21.200 123.700 1.00 43.23 ? 433 ILE B C 1 ATOM 5327 O O . ILE D 1 67 ? 64.067 -20.507 124.064 1.00 48.52 ? 433 ILE B O 1 ATOM 5328 C CB . ILE D 1 67 ? 66.700 -19.785 122.461 1.00 45.91 ? 433 ILE B CB 1 ATOM 5329 C CG1 . ILE D 1 67 ? 65.908 -18.477 122.517 1.00 41.69 ? 433 ILE B CG1 1 ATOM 5330 C CG2 . ILE D 1 67 ? 66.350 -20.545 121.195 1.00 44.49 ? 433 ILE B CG2 1 ATOM 5331 C CD1 . ILE D 1 67 ? 66.276 -17.594 123.671 1.00 46.62 ? 433 ILE B CD1 1 ATOM 5332 N N . ALA D 1 68 ? 64.872 -22.459 123.294 1.00 40.80 ? 434 ALA B N 1 ATOM 5333 C CA . ALA D 1 68 ? 63.556 -23.074 123.180 1.00 44.35 ? 434 ALA B CA 1 ATOM 5334 C C . ALA D 1 68 ? 63.253 -24.047 124.317 1.00 46.87 ? 434 ALA B C 1 ATOM 5335 O O . ALA D 1 68 ? 62.330 -24.853 124.209 1.00 49.79 ? 434 ALA B O 1 ATOM 5336 C CB . ALA D 1 68 ? 63.430 -23.786 121.845 1.00 44.10 ? 434 ALA B CB 1 ATOM 5337 N N . SER D 1 69 ? 64.016 -23.978 125.403 1.00 41.60 ? 435 SER B N 1 ATOM 5338 C CA . SER D 1 69 ? 63.800 -24.907 126.509 1.00 42.36 ? 435 SER B CA 1 ATOM 5339 C C . SER D 1 69 ? 64.080 -24.312 127.887 1.00 42.25 ? 435 SER B C 1 ATOM 5340 O O . SER D 1 69 ? 64.184 -25.046 128.867 1.00 49.00 ? 435 SER B O 1 ATOM 5341 C CB . SER D 1 69 ? 64.657 -26.160 126.314 1.00 47.76 ? 435 SER B CB 1 ATOM 5342 O OG . SER D 1 69 ? 66.030 -25.830 126.195 1.00 52.59 ? 435 SER B OG 1 ATOM 5343 N N . ASN D 1 70 ? 64.188 -22.991 127.970 1.00 38.63 ? 436 ASN B N 1 ATOM 5344 C CA . ASN D 1 70 ? 64.500 -22.343 129.242 1.00 39.45 ? 436 ASN B CA 1 ATOM 5345 C C . ASN D 1 70 ? 63.400 -21.409 129.746 1.00 40.10 ? 436 ASN B C 1 ATOM 5346 O O . ASN D 1 70 ? 62.529 -20.985 128.987 1.00 38.02 ? 436 ASN B O 1 ATOM 5347 C CB . ASN D 1 70 ? 65.818 -21.574 129.128 1.00 40.70 ? 436 ASN B CB 1 ATOM 5348 C CG . ASN D 1 70 ? 67.032 -22.479 129.239 1.00 47.21 ? 436 ASN B CG 1 ATOM 5349 O OD1 . ASN D 1 70 ? 67.612 -22.625 130.312 1.00 53.11 ? 436 ASN B OD1 1 ATOM 5350 N ND2 . ASN D 1 70 ? 67.415 -23.100 128.130 1.00 49.68 ? 436 ASN B ND2 1 ATOM 5351 N N . CYS D 1 71 ? 63.443 -21.106 131.040 1.00 43.21 ? 437 CYS B N 1 ATOM 5352 C CA . CYS D 1 71 ? 62.494 -20.185 131.656 1.00 43.00 ? 437 CYS B CA 1 ATOM 5353 C C . CYS D 1 71 ? 63.107 -18.797 131.829 1.00 43.43 ? 437 CYS B C 1 ATOM 5354 O O . CYS D 1 71 ? 64.248 -18.664 132.273 1.00 40.63 ? 437 CYS B O 1 ATOM 5355 C CB . CYS D 1 71 ? 62.025 -20.717 133.011 1.00 41.37 ? 437 CYS B CB 1 ATOM 5356 S SG . CYS D 1 71 ? 61.112 -22.268 132.938 1.00 51.89 ? 437 CYS B SG 1 ATOM 5357 N N . TYR D 1 72 ? 62.336 -17.771 131.483 1.00 44.17 ? 438 TYR B N 1 ATOM 5358 C CA . TYR D 1 72 ? 62.805 -16.393 131.545 1.00 46.42 ? 438 TYR B CA 1 ATOM 5359 C C . TYR D 1 72 ? 61.829 -15.516 132.317 1.00 47.27 ? 438 TYR B C 1 ATOM 5360 O O . TYR D 1 72 ? 60.678 -15.893 132.524 1.00 49.34 ? 438 TYR B O 1 ATOM 5361 C CB . TYR D 1 72 ? 62.999 -15.832 130.134 1.00 44.68 ? 438 TYR B CB 1 ATOM 5362 C CG . TYR D 1 72 ? 63.479 -16.859 129.136 1.00 45.81 ? 438 TYR B CG 1 ATOM 5363 C CD1 . TYR D 1 72 ? 64.811 -17.252 129.102 1.00 48.91 ? 438 TYR B CD1 1 ATOM 5364 C CD2 . TYR D 1 72 ? 62.600 -17.440 128.231 1.00 41.72 ? 438 TYR B CD2 1 ATOM 5365 C CE1 . TYR D 1 72 ? 65.255 -18.193 128.195 1.00 45.96 ? 438 TYR B CE1 1 ATOM 5366 C CE2 . TYR D 1 72 ? 63.034 -18.382 127.318 1.00 42.44 ? 438 TYR B CE2 1 ATOM 5367 C CZ . TYR D 1 72 ? 64.363 -18.756 127.305 1.00 45.57 ? 438 TYR B CZ 1 ATOM 5368 O OH . TYR D 1 72 ? 64.801 -19.693 126.400 1.00 47.79 ? 438 TYR B OH 1 ATOM 5369 N N . SER D 1 73 ? 62.293 -14.346 132.742 1.00 48.28 ? 439 SER B N 1 ATOM 5370 C CA . SER D 1 73 ? 61.411 -13.366 133.360 1.00 51.70 ? 439 SER B CA 1 ATOM 5371 C C . SER D 1 73 ? 60.517 -12.745 132.291 1.00 50.45 ? 439 SER B C 1 ATOM 5372 O O . SER D 1 73 ? 59.334 -12.504 132.520 1.00 52.49 ? 439 SER B O 1 ATOM 5373 C CB . SER D 1 73 ? 62.216 -12.286 134.087 1.00 56.37 ? 439 SER B CB 1 ATOM 5374 O OG . SER D 1 73 ? 61.362 -11.286 134.616 1.00 63.08 ? 439 SER B OG 1 ATOM 5375 N N . SER D 1 74 ? 61.095 -12.491 131.121 1.00 43.30 ? 440 SER B N 1 ATOM 5376 C CA . SER D 1 74 ? 60.331 -12.024 129.972 1.00 44.66 ? 440 SER B CA 1 ATOM 5377 C C . SER D 1 74 ? 61.010 -12.433 128.668 1.00 41.24 ? 440 SER B C 1 ATOM 5378 O O . SER D 1 74 ? 62.228 -12.616 128.620 1.00 38.55 ? 440 SER B O 1 ATOM 5379 C CB . SER D 1 74 ? 60.147 -10.506 130.019 1.00 52.12 ? 440 SER B CB 1 ATOM 5380 O OG . SER D 1 74 ? 61.388 -9.834 129.939 1.00 58.73 ? 440 SER B OG 1 ATOM 5381 N N . LEU D 1 75 ? 60.212 -12.588 127.616 1.00 41.40 ? 441 LEU B N 1 ATOM 5382 C CA . LEU D 1 75 ? 60.736 -12.928 126.298 1.00 43.88 ? 441 LEU B CA 1 ATOM 5383 C C . LEU D 1 75 ? 60.223 -11.944 125.257 1.00 45.47 ? 441 LEU B C 1 ATOM 5384 O O . LEU D 1 75 ? 59.021 -11.799 125.063 1.00 53.30 ? 441 LEU B O 1 ATOM 5385 C CB . LEU D 1 75 ? 60.355 -14.361 125.911 1.00 45.12 ? 441 LEU B CB 1 ATOM 5386 C CG . LEU D 1 75 ? 60.973 -14.916 124.623 1.00 42.26 ? 441 LEU B CG 1 ATOM 5387 C CD1 . LEU D 1 75 ? 61.340 -16.380 124.801 1.00 41.45 ? 441 LEU B CD1 1 ATOM 5388 C CD2 . LEU D 1 75 ? 60.034 -14.749 123.434 1.00 39.26 ? 441 LEU B CD2 1 ATOM 5389 N N . ILE D 1 76 ? 61.151 -11.272 124.588 1.00 46.70 ? 442 ILE B N 1 ATOM 5390 C CA . ILE D 1 76 ? 60.812 -10.280 123.581 1.00 43.79 ? 442 ILE B CA 1 ATOM 5391 C C . ILE D 1 76 ? 61.013 -10.871 122.189 1.00 43.10 ? 442 ILE B C 1 ATOM 5392 O O . ILE D 1 76 ? 62.046 -11.477 121.905 1.00 43.22 ? 442 ILE B O 1 ATOM 5393 C CB . ILE D 1 76 ? 61.659 -8.990 123.748 1.00 48.33 ? 442 ILE B CB 1 ATOM 5394 C CG1 . ILE D 1 76 ? 61.010 -8.040 124.760 1.00 51.81 ? 442 ILE B CG1 1 ATOM 5395 C CG2 . ILE D 1 76 ? 61.829 -8.270 122.420 1.00 45.59 ? 442 ILE B CG2 1 ATOM 5396 C CD1 . ILE D 1 76 ? 60.977 -8.555 126.186 1.00 55.92 ? 442 ILE B CD1 1 ATOM 5397 N N . LEU D 1 77 ? 60.011 -10.707 121.332 1.00 43.78 ? 443 LEU B N 1 ATOM 5398 C CA . LEU D 1 77 ? 60.080 -11.205 119.965 1.00 43.19 ? 443 LEU B CA 1 ATOM 5399 C C . LEU D 1 77 ? 59.806 -10.098 118.957 1.00 41.76 ? 443 LEU B C 1 ATOM 5400 O O . LEU D 1 77 ? 58.682 -9.618 118.834 1.00 42.41 ? 443 LEU B O 1 ATOM 5401 C CB . LEU D 1 77 ? 59.092 -12.355 119.759 1.00 44.09 ? 443 LEU B CB 1 ATOM 5402 C CG . LEU D 1 77 ? 58.917 -12.838 118.315 1.00 49.57 ? 443 LEU B CG 1 ATOM 5403 C CD1 . LEU D 1 77 ? 60.224 -13.371 117.752 1.00 43.82 ? 443 LEU B CD1 1 ATOM 5404 C CD2 . LEU D 1 77 ? 57.823 -13.891 118.222 1.00 56.48 ? 443 LEU B CD2 1 ATOM 5405 N N . ASP D 1 78 ? 60.847 -9.692 118.241 1.00 40.96 ? 444 ASP B N 1 ATOM 5406 C CA . ASP D 1 78 ? 60.700 -8.718 117.171 1.00 43.31 ? 444 ASP B CA 1 ATOM 5407 C C . ASP D 1 78 ? 60.586 -9.440 115.837 1.00 47.20 ? 444 ASP B C 1 ATOM 5408 O O . ASP D 1 78 ? 61.353 -10.364 115.561 1.00 46.95 ? 444 ASP B O 1 ATOM 5409 C CB . ASP D 1 78 ? 61.882 -7.744 117.155 1.00 40.13 ? 444 ASP B CB 1 ATOM 5410 C CG . ASP D 1 78 ? 62.009 -6.959 118.447 1.00 44.17 ? 444 ASP B CG 1 ATOM 5411 O OD1 . ASP D 1 78 ? 60.979 -6.748 119.122 1.00 43.54 ? 444 ASP B OD1 1 ATOM 5412 O OD2 . ASP D 1 78 ? 63.138 -6.547 118.787 1.00 46.79 ? 444 ASP B OD2 1 ATOM 5413 N N . TYR D 1 79 ? 59.622 -9.032 115.018 1.00 46.86 ? 445 TYR B N 1 ATOM 5414 C CA . TYR D 1 79 ? 59.489 -9.602 113.682 1.00 49.36 ? 445 TYR B CA 1 ATOM 5415 C C . TYR D 1 79 ? 59.238 -8.514 112.644 1.00 47.18 ? 445 TYR B C 1 ATOM 5416 O O . TYR D 1 79 ? 58.672 -7.462 112.951 1.00 42.62 ? 445 TYR B O 1 ATOM 5417 C CB . TYR D 1 79 ? 58.370 -10.650 113.639 1.00 49.80 ? 445 TYR B CB 1 ATOM 5418 C CG . TYR D 1 79 ? 56.969 -10.100 113.791 1.00 47.09 ? 445 TYR B CG 1 ATOM 5419 C CD1 . TYR D 1 79 ? 56.414 -9.900 115.047 1.00 44.49 ? 445 TYR B CD1 1 ATOM 5420 C CD2 . TYR D 1 79 ? 56.193 -9.803 112.676 1.00 44.85 ? 445 TYR B CD2 1 ATOM 5421 C CE1 . TYR D 1 79 ? 55.134 -9.409 115.191 1.00 45.52 ? 445 TYR B CE1 1 ATOM 5422 C CE2 . TYR D 1 79 ? 54.914 -9.311 112.810 1.00 43.32 ? 445 TYR B CE2 1 ATOM 5423 C CZ . TYR D 1 79 ? 54.388 -9.116 114.069 1.00 47.29 ? 445 TYR B CZ 1 ATOM 5424 O OH . TYR D 1 79 ? 53.109 -8.627 114.207 1.00 50.48 ? 445 TYR B OH 1 ATOM 5425 N N . PHE D 1 80 ? 59.667 -8.783 111.415 1.00 48.92 ? 446 PHE B N 1 ATOM 5426 C CA . PHE D 1 80 ? 59.603 -7.807 110.336 1.00 49.13 ? 446 PHE B CA 1 ATOM 5427 C C . PHE D 1 80 ? 59.927 -8.459 108.997 1.00 52.24 ? 446 PHE B C 1 ATOM 5428 O O . PHE D 1 80 ? 60.538 -9.530 108.949 1.00 47.84 ? 446 PHE B O 1 ATOM 5429 C CB . PHE D 1 80 ? 60.574 -6.652 110.602 1.00 41.20 ? 446 PHE B CB 1 ATOM 5430 C CG . PHE D 1 80 ? 61.963 -7.102 110.960 1.00 41.84 ? 446 PHE B CG 1 ATOM 5431 C CD1 . PHE D 1 80 ? 62.323 -7.296 112.285 1.00 44.19 ? 446 PHE B CD1 1 ATOM 5432 C CD2 . PHE D 1 80 ? 62.907 -7.335 109.973 1.00 45.97 ? 446 PHE B CD2 1 ATOM 5433 C CE1 . PHE D 1 80 ? 63.598 -7.713 112.619 1.00 48.13 ? 446 PHE B CE1 1 ATOM 5434 C CE2 . PHE D 1 80 ? 64.186 -7.753 110.301 1.00 48.12 ? 446 PHE B CE2 1 ATOM 5435 C CZ . PHE D 1 80 ? 64.532 -7.942 111.623 1.00 50.38 ? 446 PHE B CZ 1 ATOM 5436 N N . SER D 1 81 ? 59.517 -7.809 107.912 1.00 53.86 ? 447 SER B N 1 ATOM 5437 C CA . SER D 1 81 ? 59.914 -8.236 106.577 1.00 51.65 ? 447 SER B CA 1 ATOM 5438 C C . SER D 1 81 ? 61.394 -7.944 106.374 1.00 51.30 ? 447 SER B C 1 ATOM 5439 O O . SER D 1 81 ? 61.872 -6.860 106.710 1.00 55.26 ? 447 SER B O 1 ATOM 5440 C CB . SER D 1 81 ? 59.079 -7.534 105.504 1.00 52.55 ? 447 SER B CB 1 ATOM 5441 O OG . SER D 1 81 ? 57.693 -7.740 105.715 1.00 52.60 ? 447 SER B OG 1 ATOM 5442 N N . TYR D 1 82 ? 62.118 -8.917 105.831 1.00 48.27 ? 448 TYR B N 1 ATOM 5443 C CA . TYR D 1 82 ? 63.547 -8.760 105.595 1.00 45.55 ? 448 TYR B CA 1 ATOM 5444 C C . TYR D 1 82 ? 64.018 -9.708 104.500 1.00 50.52 ? 448 TYR B C 1 ATOM 5445 O O . TYR D 1 82 ? 63.810 -10.917 104.588 1.00 52.25 ? 448 TYR B O 1 ATOM 5446 C CB . TYR D 1 82 ? 64.336 -9.007 106.885 1.00 45.57 ? 448 TYR B CB 1 ATOM 5447 C CG . TYR D 1 82 ? 65.757 -8.483 106.851 1.00 46.03 ? 448 TYR B CG 1 ATOM 5448 C CD1 . TYR D 1 82 ? 66.039 -7.163 107.180 1.00 43.23 ? 448 TYR B CD1 1 ATOM 5449 C CD2 . TYR D 1 82 ? 66.815 -9.310 106.497 1.00 50.29 ? 448 TYR B CD2 1 ATOM 5450 C CE1 . TYR D 1 82 ? 67.334 -6.677 107.155 1.00 45.07 ? 448 TYR B CE1 1 ATOM 5451 C CE2 . TYR D 1 82 ? 68.117 -8.833 106.469 1.00 50.99 ? 448 TYR B CE2 1 ATOM 5452 C CZ . TYR D 1 82 ? 68.369 -7.516 106.799 1.00 48.77 ? 448 TYR B CZ 1 ATOM 5453 O OH . TYR D 1 82 ? 69.658 -7.037 106.771 1.00 46.17 ? 448 TYR B OH 1 ATOM 5454 N N . PRO D 1 83 ? 64.655 -9.155 103.457 1.00 50.86 ? 449 PRO B N 1 ATOM 5455 C CA . PRO D 1 83 ? 65.167 -9.970 102.353 1.00 51.47 ? 449 PRO B CA 1 ATOM 5456 C C . PRO D 1 83 ? 66.389 -10.784 102.765 1.00 52.56 ? 449 PRO B C 1 ATOM 5457 O O . PRO D 1 83 ? 67.291 -10.255 103.413 1.00 54.16 ? 449 PRO B O 1 ATOM 5458 C CB . PRO D 1 83 ? 65.527 -8.930 101.290 1.00 52.79 ? 449 PRO B CB 1 ATOM 5459 C CG . PRO D 1 83 ? 65.842 -7.705 102.066 1.00 52.08 ? 449 PRO B CG 1 ATOM 5460 C CD . PRO D 1 83 ? 64.951 -7.724 103.275 1.00 46.42 ? 449 PRO B CD 1 ATOM 5461 N N . LEU D 1 84 ? 66.408 -12.058 102.387 1.00 53.54 ? 450 LEU B N 1 ATOM 5462 C CA . LEU D 1 84 ? 67.502 -12.955 102.739 1.00 55.38 ? 450 LEU B CA 1 ATOM 5463 C C . LEU D 1 84 ? 68.817 -12.519 102.093 1.00 62.44 ? 450 LEU B C 1 ATOM 5464 O O . LEU D 1 84 ? 69.899 -12.863 102.574 1.00 66.58 ? 450 LEU B O 1 ATOM 5465 C CB . LEU D 1 84 ? 67.161 -14.389 102.328 1.00 56.96 ? 450 LEU B CB 1 ATOM 5466 C CG . LEU D 1 84 ? 68.110 -15.493 102.796 1.00 60.77 ? 450 LEU B CG 1 ATOM 5467 C CD1 . LEU D 1 84 ? 68.167 -15.534 104.316 1.00 56.05 ? 450 LEU B CD1 1 ATOM 5468 C CD2 . LEU D 1 84 ? 67.689 -16.841 102.232 1.00 62.23 ? 450 LEU B CD2 1 ATOM 5469 N N . SER D 1 85 ? 68.718 -11.756 101.007 1.00 60.13 ? 451 SER B N 1 ATOM 5470 C CA . SER D 1 85 ? 69.902 -11.271 100.304 1.00 61.11 ? 451 SER B CA 1 ATOM 5471 C C . SER D 1 85 ? 70.705 -10.291 101.156 1.00 60.13 ? 451 SER B C 1 ATOM 5472 O O . SER D 1 85 ? 71.888 -10.063 100.901 1.00 60.94 ? 451 SER B O 1 ATOM 5473 C CB . SER D 1 85 ? 69.507 -10.612 98.981 1.00 63.66 ? 451 SER B CB 1 ATOM 5474 O OG . SER D 1 85 ? 68.587 -9.554 99.184 1.00 64.30 ? 451 SER B OG 1 ATOM 5475 N N . MET D 1 86 ? 70.063 -9.715 102.169 1.00 55.85 ? 452 MET B N 1 ATOM 5476 C CA . MET D 1 86 ? 70.751 -8.805 103.079 1.00 56.06 ? 452 MET B CA 1 ATOM 5477 C C . MET D 1 86 ? 71.103 -9.489 104.397 1.00 54.60 ? 452 MET B C 1 ATOM 5478 O O . MET D 1 86 ? 71.168 -8.845 105.440 1.00 56.01 ? 452 MET B O 1 ATOM 5479 C CB . MET D 1 86 ? 69.904 -7.559 103.345 1.00 57.98 ? 452 MET B CB 1 ATOM 5480 C CG . MET D 1 86 ? 69.572 -6.759 102.094 1.00 63.58 ? 452 MET B CG 1 ATOM 5481 S SD . MET D 1 86 ? 69.121 -5.044 102.430 1.00 61.77 ? 452 MET B SD 1 ATOM 5482 C CE . MET D 1 86 ? 67.921 -5.246 103.744 1.00 81.09 ? 452 MET B CE 1 ATOM 5483 N N . LYS D 1 87 ? 71.334 -10.797 104.331 1.00 60.96 ? 453 LYS B N 1 ATOM 5484 C CA . LYS D 1 87 ? 71.701 -11.602 105.497 1.00 61.30 ? 453 LYS B CA 1 ATOM 5485 C C . LYS D 1 87 ? 72.895 -11.032 106.263 1.00 61.63 ? 453 LYS B C 1 ATOM 5486 O O . LYS D 1 87 ? 72.831 -10.849 107.477 1.00 63.23 ? 453 LYS B O 1 ATOM 5487 C CB . LYS D 1 87 ? 72.012 -13.040 105.064 1.00 65.35 ? 453 LYS B CB 1 ATOM 5488 C CG . LYS D 1 87 ? 72.508 -13.941 106.184 1.00 69.86 ? 453 LYS B CG 1 ATOM 5489 C CD . LYS D 1 87 ? 73.161 -15.199 105.625 1.00 78.62 ? 453 LYS B CD 1 ATOM 5490 C CE . LYS D 1 87 ? 74.374 -14.852 104.769 1.00 85.84 ? 453 LYS B CE 1 ATOM 5491 N NZ . LYS D 1 87 ? 75.078 -16.060 104.254 1.00 88.19 ? 453 LYS B NZ 1 ATOM 5492 N N . SER D 1 88 ? 73.977 -10.752 105.545 1.00 61.30 ? 454 SER B N 1 ATOM 5493 C CA . SER D 1 88 ? 75.216 -10.290 106.161 1.00 65.81 ? 454 SER B CA 1 ATOM 5494 C C . SER D 1 88 ? 75.060 -8.943 106.855 1.00 74.70 ? 454 SER B C 1 ATOM 5495 O O . SER D 1 88 ? 75.712 -8.675 107.863 1.00 73.60 ? 454 SER B O 1 ATOM 5496 C CB . SER D 1 88 ? 76.323 -10.195 105.112 1.00 64.38 ? 454 SER B CB 1 ATOM 5497 O OG . SER D 1 88 ? 76.016 -9.210 104.143 1.00 64.89 ? 454 SER B OG 1 ATOM 5498 N N . ASP D 1 89 ? 74.193 -8.098 106.310 1.00 84.04 ? 455 ASP B N 1 ATOM 5499 C CA . ASP D 1 89 ? 74.038 -6.739 106.812 1.00 87.25 ? 455 ASP B CA 1 ATOM 5500 C C . ASP D 1 89 ? 73.308 -6.712 108.151 1.00 82.36 ? 455 ASP B C 1 ATOM 5501 O O . ASP D 1 89 ? 73.406 -5.742 108.905 1.00 80.60 ? 455 ASP B O 1 ATOM 5502 C CB . ASP D 1 89 ? 73.296 -5.877 105.794 1.00 90.59 ? 455 ASP B CB 1 ATOM 5503 C CG . ASP D 1 89 ? 73.741 -4.434 105.827 1.00 98.08 ? 455 ASP B CG 1 ATOM 5504 O OD1 . ASP D 1 89 ? 74.547 -4.041 104.957 1.00 101.11 ? 455 ASP B OD1 1 ATOM 5505 O OD2 . ASP D 1 89 ? 73.294 -3.698 106.732 1.00 100.67 ? 455 ASP B OD2 1 ATOM 5506 N N . LEU D 1 90 ? 72.576 -7.781 108.439 1.00 85.67 ? 456 LEU B N 1 ATOM 5507 C CA . LEU D 1 90 ? 71.889 -7.918 109.715 1.00 76.87 ? 456 LEU B CA 1 ATOM 5508 C C . LEU D 1 90 ? 72.798 -8.659 110.693 1.00 83.53 ? 456 LEU B C 1 ATOM 5509 O O . LEU D 1 90 ? 72.452 -9.726 111.202 1.00 83.61 ? 456 LEU B O 1 ATOM 5510 C CB . LEU D 1 90 ? 70.556 -8.649 109.530 1.00 69.34 ? 456 LEU B CB 1 ATOM 5511 C CG . LEU D 1 90 ? 69.553 -8.684 110.685 1.00 66.00 ? 456 LEU B CG 1 ATOM 5512 C CD1 . LEU D 1 90 ? 69.235 -7.287 111.187 1.00 55.43 ? 456 LEU B CD1 1 ATOM 5513 C CD2 . LEU D 1 90 ? 68.285 -9.398 110.251 1.00 66.38 ? 456 LEU B CD2 1 ATOM 5514 N N . SER D 1 91 ? 73.973 -8.088 110.938 1.00 88.87 ? 457 SER B N 1 ATOM 5515 C CA . SER D 1 91 ? 74.957 -8.700 111.823 1.00 95.80 ? 457 SER B CA 1 ATOM 5516 C C . SER D 1 91 ? 75.642 -7.661 112.703 1.00 100.43 ? 457 SER B C 1 ATOM 5517 O O . SER D 1 91 ? 75.656 -6.471 112.385 1.00 98.67 ? 457 SER B O 1 ATOM 5518 C CB . SER D 1 91 ? 76.005 -9.465 111.013 1.00 96.63 ? 457 SER B CB 1 ATOM 5519 O OG . SER D 1 91 ? 77.003 -10.008 111.860 1.00 101.70 ? 457 SER B OG 1 ATOM 5520 N N . VAL D 1 92 ? 76.213 -8.125 113.810 1.00 105.67 ? 458 VAL B N 1 ATOM 5521 C CA . VAL D 1 92 ? 76.877 -7.246 114.763 1.00 107.28 ? 458 VAL B CA 1 ATOM 5522 C C . VAL D 1 92 ? 78.157 -6.662 114.173 1.00 107.29 ? 458 VAL B C 1 ATOM 5523 O O . VAL D 1 92 ? 78.490 -5.501 114.412 1.00 106.14 ? 458 VAL B O 1 ATOM 5524 C CB . VAL D 1 92 ? 77.216 -7.992 116.071 1.00 114.77 ? 458 VAL B CB 1 ATOM 5525 C CG1 . VAL D 1 92 ? 77.690 -7.014 117.136 1.00 117.48 ? 458 VAL B CG1 1 ATOM 5526 C CG2 . VAL D 1 92 ? 76.008 -8.774 116.564 1.00 114.91 ? 458 VAL B CG2 1 ATOM 5527 N N . SER D 1 93 ? 78.866 -7.474 113.395 1.00 108.12 ? 459 SER B N 1 ATOM 5528 C CA . SER D 1 93 ? 80.146 -7.065 112.827 1.00 109.51 ? 459 SER B CA 1 ATOM 5529 C C . SER D 1 93 ? 79.995 -6.459 111.436 1.00 103.30 ? 459 SER B C 1 ATOM 5530 O O . SER D 1 93 ? 80.954 -6.411 110.667 1.00 103.93 ? 459 SER B O 1 ATOM 5531 C CB . SER D 1 93 ? 81.105 -8.256 112.770 1.00 113.70 ? 459 SER B CB 1 ATOM 5532 O OG . SER D 1 93 ? 80.582 -9.290 111.955 1.00 108.83 ? 459 SER B OG 1 ATOM 5533 N N . SER D 1 94 ? 78.791 -5.997 111.114 1.00 98.32 ? 460 SER B N 1 ATOM 5534 C CA . SER D 1 94 ? 78.548 -5.365 109.822 1.00 97.15 ? 460 SER B CA 1 ATOM 5535 C C . SER D 1 94 ? 78.242 -3.882 109.984 1.00 95.06 ? 460 SER B C 1 ATOM 5536 O O . SER D 1 94 ? 77.375 -3.500 110.770 1.00 95.62 ? 460 SER B O 1 ATOM 5537 C CB . SER D 1 94 ? 77.401 -6.059 109.087 1.00 96.12 ? 460 SER B CB 1 ATOM 5538 O OG . SER D 1 94 ? 77.163 -5.448 107.830 1.00 93.48 ? 460 SER B OG 1 ATOM 5539 N N . ALA D 1 95 ? 78.956 -3.051 109.233 1.00 92.86 ? 461 ALA B N 1 ATOM 5540 C CA . ALA D 1 95 ? 78.765 -1.607 109.293 1.00 89.10 ? 461 ALA B CA 1 ATOM 5541 C C . ALA D 1 95 ? 77.698 -1.149 108.304 1.00 79.60 ? 461 ALA B C 1 ATOM 5542 O O . ALA D 1 95 ? 77.622 0.030 107.961 1.00 79.71 ? 461 ALA B O 1 ATOM 5543 C CB . ALA D 1 95 ? 80.079 -0.887 109.027 1.00 94.78 ? 461 ALA B CB 1 ATOM 5544 N N . GLY D 1 96 ? 76.877 -2.090 107.848 1.00 74.32 ? 462 GLY B N 1 ATOM 5545 C CA . GLY D 1 96 ? 75.794 -1.778 106.934 1.00 66.83 ? 462 GLY B CA 1 ATOM 5546 C C . GLY D 1 96 ? 74.720 -0.940 107.602 1.00 60.18 ? 462 GLY B C 1 ATOM 5547 O O . GLY D 1 96 ? 74.648 -0.889 108.828 1.00 63.50 ? 462 GLY B O 1 ATOM 5548 N N . PRO D 1 97 ? 73.870 -0.286 106.795 1.00 53.72 ? 463 PRO B N 1 ATOM 5549 C CA . PRO D 1 97 ? 72.851 0.646 107.296 1.00 50.27 ? 463 PRO B CA 1 ATOM 5550 C C . PRO D 1 97 ? 71.843 -0.002 108.245 1.00 53.46 ? 463 PRO B C 1 ATOM 5551 O O . PRO D 1 97 ? 71.316 0.680 109.126 1.00 58.61 ? 463 PRO B O 1 ATOM 5552 C CB . PRO D 1 97 ? 72.157 1.130 106.016 1.00 48.72 ? 463 PRO B CB 1 ATOM 5553 C CG . PRO D 1 97 ? 72.445 0.076 104.998 1.00 50.28 ? 463 PRO B CG 1 ATOM 5554 C CD . PRO D 1 97 ? 73.808 -0.439 105.332 1.00 51.63 ? 463 PRO B CD 1 ATOM 5555 N N . ILE D 1 98 ? 71.587 -1.294 108.068 1.00 51.93 ? 464 ILE B N 1 ATOM 5556 C CA . ILE D 1 98 ? 70.627 -2.013 108.902 1.00 51.34 ? 464 ILE B CA 1 ATOM 5557 C C . ILE D 1 98 ? 70.998 -1.963 110.383 1.00 53.33 ? 464 ILE B C 1 ATOM 5558 O O . ILE D 1 98 ? 70.213 -1.501 111.210 1.00 51.29 ? 464 ILE B O 1 ATOM 5559 C CB . ILE D 1 98 ? 70.503 -3.488 108.471 1.00 56.25 ? 464 ILE B CB 1 ATOM 5560 C CG1 . ILE D 1 98 ? 70.057 -3.584 107.010 1.00 56.37 ? 464 ILE B CG1 1 ATOM 5561 C CG2 . ILE D 1 98 ? 69.523 -4.222 109.364 1.00 52.35 ? 464 ILE B CG2 1 ATOM 5562 C CD1 . ILE D 1 98 ? 68.659 -3.068 106.765 1.00 55.78 ? 464 ILE B CD1 1 ATOM 5563 N N . SER D 1 99 ? 72.194 -2.435 110.716 1.00 58.61 ? 465 SER B N 1 ATOM 5564 C CA . SER D 1 99 ? 72.630 -2.463 112.108 1.00 64.71 ? 465 SER B CA 1 ATOM 5565 C C . SER D 1 99 ? 72.930 -1.059 112.635 1.00 66.44 ? 465 SER B C 1 ATOM 5566 O O . SER D 1 99 ? 72.892 -0.820 113.842 1.00 70.03 ? 465 SER B O 1 ATOM 5567 C CB . SER D 1 99 ? 73.860 -3.363 112.269 1.00 67.95 ? 465 SER B CB 1 ATOM 5568 O OG . SER D 1 99 ? 74.930 -2.929 111.449 1.00 71.82 ? 465 SER B OG 1 ATOM 5569 N N . GLN D 1 100 ? 73.212 -0.129 111.729 1.00 66.90 ? 466 GLN B N 1 ATOM 5570 C CA . GLN D 1 100 ? 73.547 1.234 112.124 1.00 69.14 ? 466 GLN B CA 1 ATOM 5571 C C . GLN D 1 100 ? 72.310 2.086 112.401 1.00 66.50 ? 466 GLN B C 1 ATOM 5572 O O . GLN D 1 100 ? 72.264 2.811 113.393 1.00 73.10 ? 466 GLN B O 1 ATOM 5573 C CB . GLN D 1 100 ? 74.405 1.909 111.050 1.00 69.96 ? 466 GLN B CB 1 ATOM 5574 C CG . GLN D 1 100 ? 75.751 1.247 110.820 1.00 75.10 ? 466 GLN B CG 1 ATOM 5575 C CD . GLN D 1 100 ? 76.588 1.172 112.079 1.00 88.26 ? 466 GLN B CD 1 ATOM 5576 O OE1 . GLN D 1 100 ? 76.759 0.101 112.662 1.00 92.20 ? 466 GLN B OE1 1 ATOM 5577 N NE2 . GLN D 1 100 ? 77.120 2.312 112.504 1.00 95.59 ? 466 GLN B NE2 1 ATOM 5578 N N . PHE D 1 101 ? 71.308 2.002 111.534 1.00 55.82 ? 467 PHE B N 1 ATOM 5579 C CA . PHE D 1 101 ? 70.173 2.914 111.634 1.00 56.49 ? 467 PHE B CA 1 ATOM 5580 C C . PHE D 1 101 ? 68.825 2.227 111.836 1.00 56.23 ? 467 PHE B C 1 ATOM 5581 O O . PHE D 1 101 ? 67.880 2.848 112.313 1.00 56.71 ? 467 PHE B O 1 ATOM 5582 C CB . PHE D 1 101 ? 70.098 3.796 110.386 1.00 55.60 ? 467 PHE B CB 1 ATOM 5583 C CG . PHE D 1 101 ? 71.375 4.525 110.079 1.00 56.00 ? 467 PHE B CG 1 ATOM 5584 C CD1 . PHE D 1 101 ? 71.717 5.675 110.771 1.00 54.55 ? 467 PHE B CD1 1 ATOM 5585 C CD2 . PHE D 1 101 ? 72.229 4.065 109.091 1.00 57.76 ? 467 PHE B CD2 1 ATOM 5586 C CE1 . PHE D 1 101 ? 72.889 6.347 110.487 1.00 61.67 ? 467 PHE B CE1 1 ATOM 5587 C CE2 . PHE D 1 101 ? 73.404 4.733 108.802 1.00 59.79 ? 467 PHE B CE2 1 ATOM 5588 C CZ . PHE D 1 101 ? 73.734 5.876 109.500 1.00 62.79 ? 467 PHE B CZ 1 ATOM 5589 N N . ASN D 1 102 ? 68.730 0.952 111.478 1.00 53.22 ? 468 ASN B N 1 ATOM 5590 C CA . ASN D 1 102 ? 67.433 0.282 111.470 1.00 50.31 ? 468 ASN B CA 1 ATOM 5591 C C . ASN D 1 102 ? 67.144 -0.561 112.711 1.00 51.14 ? 468 ASN B C 1 ATOM 5592 O O . ASN D 1 102 ? 66.201 -0.279 113.450 1.00 51.10 ? 468 ASN B O 1 ATOM 5593 C CB . ASN D 1 102 ? 67.309 -0.589 110.219 1.00 47.03 ? 468 ASN B CB 1 ATOM 5594 C CG . ASN D 1 102 ? 67.289 0.229 108.945 1.00 46.65 ? 468 ASN B CG 1 ATOM 5595 O OD1 . ASN D 1 102 ? 66.225 0.612 108.456 1.00 53.45 ? 468 ASN B OD1 1 ATOM 5596 N ND2 . ASN D 1 102 ? 68.469 0.514 108.406 1.00 44.14 ? 468 ASN B ND2 1 ATOM 5597 N N . TYR D 1 103 ? 67.951 -1.591 112.940 1.00 53.84 ? 469 TYR B N 1 ATOM 5598 C CA . TYR D 1 103 ? 67.667 -2.550 114.004 1.00 51.84 ? 469 TYR B CA 1 ATOM 5599 C C . TYR D 1 103 ? 68.937 -3.077 114.663 1.00 52.26 ? 469 TYR B C 1 ATOM 5600 O O . TYR D 1 103 ? 69.824 -3.605 113.994 1.00 48.66 ? 469 TYR B O 1 ATOM 5601 C CB . TYR D 1 103 ? 66.843 -3.712 113.444 1.00 49.40 ? 469 TYR B CB 1 ATOM 5602 C CG . TYR D 1 103 ? 66.424 -4.749 114.461 1.00 47.89 ? 469 TYR B CG 1 ATOM 5603 C CD1 . TYR D 1 103 ? 65.393 -4.495 115.355 1.00 47.33 ? 469 TYR B CD1 1 ATOM 5604 C CD2 . TYR D 1 103 ? 67.042 -5.994 114.511 1.00 41.13 ? 469 TYR B CD2 1 ATOM 5605 C CE1 . TYR D 1 103 ? 64.998 -5.444 116.280 1.00 43.72 ? 469 TYR B CE1 1 ATOM 5606 C CE2 . TYR D 1 103 ? 66.654 -6.947 115.431 1.00 38.39 ? 469 TYR B CE2 1 ATOM 5607 C CZ . TYR D 1 103 ? 65.631 -6.668 116.314 1.00 40.29 ? 469 TYR B CZ 1 ATOM 5608 O OH . TYR D 1 103 ? 65.238 -7.613 117.235 1.00 41.43 ? 469 TYR B OH 1 ATOM 5609 N N . LYS D 1 104 ? 69.009 -2.931 115.982 1.00 55.82 ? 470 LYS B N 1 ATOM 5610 C CA . LYS D 1 104 ? 70.145 -3.410 116.761 1.00 55.70 ? 470 LYS B CA 1 ATOM 5611 C C . LYS D 1 104 ? 69.660 -4.086 118.040 1.00 52.59 ? 470 LYS B C 1 ATOM 5612 O O . LYS D 1 104 ? 68.939 -3.482 118.830 1.00 54.76 ? 470 LYS B O 1 ATOM 5613 C CB . LYS D 1 104 ? 71.095 -2.256 117.094 1.00 58.24 ? 470 LYS B CB 1 ATOM 5614 C CG . LYS D 1 104 ? 72.305 -2.657 117.923 1.00 62.60 ? 470 LYS B CG 1 ATOM 5615 C CD . LYS D 1 104 ? 73.213 -1.462 118.191 1.00 71.54 ? 470 LYS B CD 1 ATOM 5616 C CE . LYS D 1 104 ? 73.757 -0.878 116.897 1.00 75.92 ? 470 LYS B CE 1 ATOM 5617 N NZ . LYS D 1 104 ? 74.623 0.313 117.129 1.00 84.59 ? 470 LYS B NZ 1 ATOM 5618 N N . GLN D 1 105 ? 70.052 -5.340 118.237 1.00 50.05 ? 471 GLN B N 1 ATOM 5619 C CA . GLN D 1 105 ? 69.628 -6.099 119.412 1.00 50.90 ? 471 GLN B CA 1 ATOM 5620 C C . GLN D 1 105 ? 70.483 -5.804 120.641 1.00 52.79 ? 471 GLN B C 1 ATOM 5621 O O . GLN D 1 105 ? 71.544 -5.192 120.544 1.00 59.31 ? 471 GLN B O 1 ATOM 5622 C CB . GLN D 1 105 ? 69.653 -7.601 119.117 1.00 48.70 ? 471 GLN B CB 1 ATOM 5623 C CG . GLN D 1 105 ? 68.470 -8.095 118.310 1.00 47.92 ? 471 GLN B CG 1 ATOM 5624 C CD . GLN D 1 105 ? 68.563 -9.572 117.997 1.00 46.49 ? 471 GLN B CD 1 ATOM 5625 O OE1 . GLN D 1 105 ? 69.577 -10.043 117.480 1.00 51.07 ? 471 GLN B OE1 1 ATOM 5626 N NE2 . GLN D 1 105 ? 67.508 -10.314 118.315 1.00 41.71 ? 471 GLN B NE2 1 ATOM 5627 N N . SER D 1 106 ? 70.006 -6.254 121.795 1.00 53.04 ? 472 SER B N 1 ATOM 5628 C CA . SER D 1 106 ? 70.690 -6.036 123.062 1.00 56.06 ? 472 SER B CA 1 ATOM 5629 C C . SER D 1 106 ? 72.081 -6.665 123.088 1.00 58.41 ? 472 SER B C 1 ATOM 5630 O O . SER D 1 106 ? 72.293 -7.748 122.541 1.00 57.66 ? 472 SER B O 1 ATOM 5631 C CB . SER D 1 106 ? 69.851 -6.590 124.214 1.00 56.75 ? 472 SER B CB 1 ATOM 5632 O OG . SER D 1 106 ? 70.529 -6.455 125.451 1.00 60.14 ? 472 SER B OG 1 ATOM 5633 N N . PHE D 1 107 ? 73.023 -5.970 123.719 1.00 63.83 ? 473 PHE B N 1 ATOM 5634 C CA . PHE D 1 107 ? 74.369 -6.494 123.923 1.00 66.81 ? 473 PHE B CA 1 ATOM 5635 C C . PHE D 1 107 ? 74.482 -7.137 125.301 1.00 67.00 ? 473 PHE B C 1 ATOM 5636 O O . PHE D 1 107 ? 75.309 -8.023 125.518 1.00 67.24 ? 473 PHE B O 1 ATOM 5637 C CB . PHE D 1 107 ? 75.420 -5.386 123.784 1.00 79.19 ? 473 PHE B CB 1 ATOM 5638 C CG . PHE D 1 107 ? 75.545 -4.827 122.393 1.00 90.16 ? 473 PHE B CG 1 ATOM 5639 C CD1 . PHE D 1 107 ? 76.439 -5.377 121.486 1.00 92.85 ? 473 PHE B CD1 1 ATOM 5640 C CD2 . PHE D 1 107 ? 74.781 -3.740 121.996 1.00 93.64 ? 473 PHE B CD2 1 ATOM 5641 C CE1 . PHE D 1 107 ? 76.561 -4.859 120.206 1.00 91.08 ? 473 PHE B CE1 1 ATOM 5642 C CE2 . PHE D 1 107 ? 74.898 -3.219 120.719 1.00 91.66 ? 473 PHE B CE2 1 ATOM 5643 C CZ . PHE D 1 107 ? 75.789 -3.779 119.824 1.00 89.44 ? 473 PHE B CZ 1 ATOM 5644 N N . SER D 1 108 ? 73.643 -6.681 126.227 1.00 65.21 ? 474 SER B N 1 ATOM 5645 C CA . SER D 1 108 ? 73.715 -7.117 127.620 1.00 65.45 ? 474 SER B CA 1 ATOM 5646 C C . SER D 1 108 ? 72.705 -8.210 127.958 1.00 54.02 ? 474 SER B C 1 ATOM 5647 O O . SER D 1 108 ? 72.563 -8.596 129.114 1.00 60.20 ? 474 SER B O 1 ATOM 5648 C CB . SER D 1 108 ? 73.517 -5.919 128.552 1.00 72.65 ? 474 SER B CB 1 ATOM 5649 O OG . SER D 1 108 ? 72.350 -5.193 128.209 1.00 75.33 ? 474 SER B OG 1 ATOM 5650 N N . ASN D 1 109 ? 72.001 -8.701 126.945 1.00 49.54 ? 475 ASN B N 1 ATOM 5651 C CA . ASN D 1 109 ? 71.061 -9.804 127.118 1.00 48.94 ? 475 ASN B CA 1 ATOM 5652 C C . ASN D 1 109 ? 71.257 -10.853 126.033 1.00 43.24 ? 475 ASN B C 1 ATOM 5653 O O . ASN D 1 109 ? 71.649 -10.518 124.916 1.00 44.48 ? 475 ASN B O 1 ATOM 5654 C CB . ASN D 1 109 ? 69.611 -9.303 127.099 1.00 51.40 ? 475 ASN B CB 1 ATOM 5655 C CG . ASN D 1 109 ? 69.252 -8.489 128.328 1.00 52.25 ? 475 ASN B CG 1 ATOM 5656 O OD1 . ASN D 1 109 ? 69.104 -9.030 129.423 1.00 55.44 ? 475 ASN B OD1 1 ATOM 5657 N ND2 . ASN D 1 109 ? 69.088 -7.184 128.147 1.00 62.34 ? 475 ASN B ND2 1 ATOM 5658 N N . PRO D 1 110 ? 70.988 -12.127 126.361 1.00 48.48 ? 476 PRO B N 1 ATOM 5659 C CA . PRO D 1 110 ? 71.042 -13.194 125.356 1.00 39.92 ? 476 PRO B CA 1 ATOM 5660 C C . PRO D 1 110 ? 70.073 -12.911 124.216 1.00 40.30 ? 476 PRO B C 1 ATOM 5661 O O . PRO D 1 110 ? 68.924 -12.548 124.470 1.00 44.41 ? 476 PRO B O 1 ATOM 5662 C CB . PRO D 1 110 ? 70.620 -14.442 126.138 1.00 40.03 ? 476 PRO B CB 1 ATOM 5663 C CG . PRO D 1 110 ? 70.895 -14.112 127.567 1.00 46.91 ? 476 PRO B CG 1 ATOM 5664 C CD . PRO D 1 110 ? 70.641 -12.643 127.697 1.00 52.75 ? 476 PRO B CD 1 ATOM 5665 N N . THR D 1 111 ? 70.533 -13.052 122.979 1.00 36.28 ? 477 THR B N 1 ATOM 5666 C CA . THR D 1 111 ? 69.683 -12.777 121.828 1.00 40.29 ? 477 THR B CA 1 ATOM 5667 C C . THR D 1 111 ? 69.784 -13.868 120.772 1.00 44.03 ? 477 THR B C 1 ATOM 5668 O O . THR D 1 111 ? 70.786 -14.574 120.685 1.00 46.40 ? 477 THR B O 1 ATOM 5669 C CB . THR D 1 111 ? 70.030 -11.420 121.165 1.00 39.35 ? 477 THR B CB 1 ATOM 5670 O OG1 . THR D 1 111 ? 71.426 -11.382 120.850 1.00 46.33 ? 477 THR B OG1 1 ATOM 5671 C CG2 . THR D 1 111 ? 69.690 -10.259 122.090 1.00 41.38 ? 477 THR B CG2 1 ATOM 5672 N N . CYS D 1 112 ? 68.730 -13.997 119.974 1.00 49.71 ? 478 CYS B N 1 ATOM 5673 C CA . CYS D 1 112 ? 68.745 -14.868 118.808 1.00 48.25 ? 478 CYS B CA 1 ATOM 5674 C C . CYS D 1 112 ? 68.248 -14.109 117.588 1.00 54.70 ? 478 CYS B C 1 ATOM 5675 O O . CYS D 1 112 ? 67.492 -13.141 117.707 1.00 55.24 ? 478 CYS B O 1 ATOM 5676 C CB . CYS D 1 112 ? 67.890 -16.115 119.036 1.00 43.26 ? 478 CYS B CB 1 ATOM 5677 S SG . CYS D 1 112 ? 68.673 -17.394 120.040 1.00 55.92 ? 478 CYS B SG 1 ATOM 5678 N N . LEU D 1 113 ? 68.683 -14.553 116.416 1.00 54.14 ? 479 LEU B N 1 ATOM 5679 C CA . LEU D 1 113 ? 68.268 -13.939 115.165 1.00 45.94 ? 479 LEU B CA 1 ATOM 5680 C C . LEU D 1 113 ? 67.922 -15.019 114.152 1.00 47.81 ? 479 LEU B C 1 ATOM 5681 O O . LEU D 1 113 ? 68.736 -15.901 113.863 1.00 52.71 ? 479 LEU B O 1 ATOM 5682 C CB . LEU D 1 113 ? 69.364 -13.023 114.628 1.00 43.73 ? 479 LEU B CB 1 ATOM 5683 C CG . LEU D 1 113 ? 69.062 -12.307 113.313 1.00 50.12 ? 479 LEU B CG 1 ATOM 5684 C CD1 . LEU D 1 113 ? 67.821 -11.442 113.443 1.00 45.94 ? 479 LEU B CD1 1 ATOM 5685 C CD2 . LEU D 1 113 ? 70.258 -11.474 112.898 1.00 51.20 ? 479 LEU B CD2 1 ATOM 5686 N N . ILE D 1 114 ? 66.705 -14.947 113.624 1.00 44.96 ? 480 ILE B N 1 ATOM 5687 C CA . ILE D 1 114 ? 66.203 -15.966 112.716 1.00 44.91 ? 480 ILE B CA 1 ATOM 5688 C C . ILE D 1 114 ? 65.741 -15.361 111.395 1.00 52.60 ? 480 ILE B C 1 ATOM 5689 O O . ILE D 1 114 ? 64.879 -14.480 111.372 1.00 55.54 ? 480 ILE B O 1 ATOM 5690 C CB . ILE D 1 114 ? 65.033 -16.744 113.341 1.00 44.21 ? 480 ILE B CB 1 ATOM 5691 C CG1 . ILE D 1 114 ? 65.445 -17.334 114.691 1.00 44.81 ? 480 ILE B CG1 1 ATOM 5692 C CG2 . ILE D 1 114 ? 64.553 -17.835 112.396 1.00 44.48 ? 480 ILE B CG2 1 ATOM 5693 C CD1 . ILE D 1 114 ? 64.345 -18.110 115.381 1.00 51.62 ? 480 ILE B CD1 1 ATOM 5694 N N . LEU D 1 115 ? 66.323 -15.836 110.298 1.00 49.80 ? 481 LEU B N 1 ATOM 5695 C CA . LEU D 1 115 ? 65.897 -15.428 108.966 1.00 45.26 ? 481 LEU B CA 1 ATOM 5696 C C . LEU D 1 115 ? 65.078 -16.544 108.332 1.00 50.65 ? 481 LEU B C 1 ATOM 5697 O O . LEU D 1 115 ? 65.596 -17.630 108.069 1.00 50.13 ? 481 LEU B O 1 ATOM 5698 C CB . LEU D 1 115 ? 67.102 -15.080 108.092 1.00 46.61 ? 481 LEU B CB 1 ATOM 5699 C CG . LEU D 1 115 ? 68.053 -14.025 108.661 1.00 49.15 ? 481 LEU B CG 1 ATOM 5700 C CD1 . LEU D 1 115 ? 69.166 -13.717 107.674 1.00 53.72 ? 481 LEU B CD1 1 ATOM 5701 C CD2 . LEU D 1 115 ? 67.294 -12.762 109.034 1.00 47.33 ? 481 LEU B CD2 1 ATOM 5702 N N . ALA D 1 116 ? 63.797 -16.276 108.095 1.00 52.87 ? 482 ALA B N 1 ATOM 5703 C CA . ALA D 1 116 ? 62.890 -17.307 107.609 1.00 54.59 ? 482 ALA B CA 1 ATOM 5704 C C . ALA D 1 116 ? 62.139 -16.880 106.358 1.00 59.68 ? 482 ALA B C 1 ATOM 5705 O O . ALA D 1 116 ? 61.966 -15.692 106.094 1.00 61.54 ? 482 ALA B O 1 ATOM 5706 C CB . ALA D 1 116 ? 61.904 -17.692 108.700 1.00 54.92 ? 482 ALA B CB 1 ATOM 5707 N N . THR D 1 117 ? 61.693 -17.868 105.592 1.00 63.91 ? 483 THR B N 1 ATOM 5708 C CA . THR D 1 117 ? 60.896 -17.627 104.399 1.00 62.44 ? 483 THR B CA 1 ATOM 5709 C C . THR D 1 117 ? 59.487 -18.172 104.605 1.00 59.63 ? 483 THR B C 1 ATOM 5710 O O . THR D 1 117 ? 59.313 -19.263 105.148 1.00 62.44 ? 483 THR B O 1 ATOM 5711 C CB . THR D 1 117 ? 61.532 -18.281 103.151 1.00 67.46 ? 483 THR B CB 1 ATOM 5712 O OG1 . THR D 1 117 ? 62.884 -17.828 103.004 1.00 68.71 ? 483 THR B OG1 1 ATOM 5713 C CG2 . THR D 1 117 ? 60.751 -17.926 101.900 1.00 67.88 ? 483 THR B CG2 1 ATOM 5714 N N . VAL D 1 118 ? 58.486 -17.404 104.187 1.00 56.39 ? 484 VAL B N 1 ATOM 5715 C CA . VAL D 1 118 ? 57.096 -17.838 104.274 1.00 62.15 ? 484 VAL B CA 1 ATOM 5716 C C . VAL D 1 118 ? 56.779 -18.888 103.207 1.00 69.09 ? 484 VAL B C 1 ATOM 5717 O O . VAL D 1 118 ? 56.820 -18.596 102.013 1.00 76.18 ? 484 VAL B O 1 ATOM 5718 C CB . VAL D 1 118 ? 56.129 -16.648 104.118 1.00 62.94 ? 484 VAL B CB 1 ATOM 5719 C CG1 . VAL D 1 118 ? 54.689 -17.132 104.084 1.00 65.52 ? 484 VAL B CG1 1 ATOM 5720 C CG2 . VAL D 1 118 ? 56.340 -15.636 105.236 1.00 52.34 ? 484 VAL B CG2 1 ATOM 5721 N N . PRO D 1 119 ? 56.465 -20.119 103.638 1.00 65.28 ? 485 PRO B N 1 ATOM 5722 C CA . PRO D 1 119 ? 56.182 -21.219 102.710 1.00 68.25 ? 485 PRO B CA 1 ATOM 5723 C C . PRO D 1 119 ? 54.760 -21.182 102.153 1.00 72.78 ? 485 PRO B C 1 ATOM 5724 O O . PRO D 1 119 ? 53.953 -20.360 102.589 1.00 75.39 ? 485 PRO B O 1 ATOM 5725 C CB . PRO D 1 119 ? 56.391 -22.460 103.578 1.00 67.95 ? 485 PRO B CB 1 ATOM 5726 C CG . PRO D 1 119 ? 56.013 -22.009 104.943 1.00 66.68 ? 485 PRO B CG 1 ATOM 5727 C CD . PRO D 1 119 ? 56.415 -20.559 105.044 1.00 65.59 ? 485 PRO B CD 1 ATOM 5728 N N . HIS D 1 120 ? 54.462 -22.066 101.203 1.00 76.60 ? 486 HIS B N 1 ATOM 5729 C CA . HIS D 1 120 ? 53.119 -22.169 100.634 1.00 77.10 ? 486 HIS B CA 1 ATOM 5730 C C . HIS D 1 120 ? 52.127 -22.588 101.713 1.00 81.00 ? 486 HIS B C 1 ATOM 5731 O O . HIS D 1 120 ? 50.940 -22.270 101.646 1.00 79.60 ? 486 HIS B O 1 ATOM 5732 C CB . HIS D 1 120 ? 53.101 -23.162 99.473 1.00 82.22 ? 486 HIS B CB 1 ATOM 5733 C CG . HIS D 1 120 ? 54.266 -23.022 98.544 1.00 89.13 ? 486 HIS B CG 1 ATOM 5734 N ND1 . HIS D 1 120 ? 55.426 -23.751 98.694 1.00 95.08 ? 486 HIS B ND1 1 ATOM 5735 C CD2 . HIS D 1 120 ? 54.456 -22.231 97.462 1.00 91.45 ? 486 HIS B CD2 1 ATOM 5736 C CE1 . HIS D 1 120 ? 56.278 -23.421 97.739 1.00 97.11 ? 486 HIS B CE1 1 ATOM 5737 N NE2 . HIS D 1 120 ? 55.714 -22.499 96.979 1.00 95.54 ? 486 HIS B NE2 1 ATOM 5738 N N . ASN D 1 121 ? 52.643 -23.328 102.690 1.00 92.22 ? 487 ASN B N 1 ATOM 5739 C CA . ASN D 1 121 ? 51.968 -23.602 103.954 1.00 97.62 ? 487 ASN B CA 1 ATOM 5740 C C . ASN D 1 121 ? 51.194 -22.403 104.484 1.00 88.10 ? 487 ASN B C 1 ATOM 5741 O O . ASN D 1 121 ? 49.997 -22.482 104.755 1.00 85.86 ? 487 ASN B O 1 ATOM 5742 C CB . ASN D 1 121 ? 53.002 -24.016 104.995 1.00 107.00 ? 487 ASN B CB 1 ATOM 5743 C CG . ASN D 1 121 ? 52.729 -25.365 105.600 1.00 120.00 ? 487 ASN B CG 1 ATOM 5744 O OD1 . ASN D 1 121 ? 51.609 -25.680 106.005 1.00 121.91 ? 487 ASN B OD1 1 ATOM 5745 N ND2 . ASN D 1 121 ? 53.772 -26.177 105.666 1.00 134.49 ? 487 ASN B ND2 1 ATOM 5746 N N . LEU D 1 122 ? 51.911 -21.293 104.633 1.00 80.68 ? 488 LEU B N 1 ATOM 5747 C CA . LEU D 1 122 ? 51.354 -20.066 105.186 1.00 75.48 ? 488 LEU B CA 1 ATOM 5748 C C . LEU D 1 122 ? 50.727 -19.197 104.113 1.00 71.01 ? 488 LEU B C 1 ATOM 5749 O O . LEU D 1 122 ? 51.391 -18.782 103.164 1.00 71.38 ? 488 LEU B O 1 ATOM 5750 C CB . LEU D 1 122 ? 52.435 -19.274 105.919 1.00 77.23 ? 488 LEU B CB 1 ATOM 5751 C CG . LEU D 1 122 ? 52.620 -19.552 107.409 1.00 75.49 ? 488 LEU B CG 1 ATOM 5752 C CD1 . LEU D 1 122 ? 53.784 -18.738 107.937 1.00 72.70 ? 488 LEU B CD1 1 ATOM 5753 C CD2 . LEU D 1 122 ? 51.345 -19.223 108.166 1.00 76.31 ? 488 LEU B CD2 1 ATOM 5754 N N . THR D 1 123 ? 49.440 -18.919 104.275 1.00 69.96 ? 489 THR B N 1 ATOM 5755 C CA . THR D 1 123 ? 48.704 -18.135 103.299 1.00 68.91 ? 489 THR B CA 1 ATOM 5756 C C . THR D 1 123 ? 47.856 -17.078 103.995 1.00 71.08 ? 489 THR B C 1 ATOM 5757 O O . THR D 1 123 ? 46.922 -16.533 103.410 1.00 75.60 ? 489 THR B O 1 ATOM 5758 C CB . THR D 1 123 ? 47.809 -19.032 102.427 1.00 69.73 ? 489 THR B CB 1 ATOM 5759 O OG1 . THR D 1 123 ? 46.971 -19.831 103.270 1.00 73.60 ? 489 THR B OG1 1 ATOM 5760 C CG2 . THR D 1 123 ? 48.661 -19.952 101.565 1.00 63.30 ? 489 THR B CG2 1 ATOM 5761 N N . THR D 1 124 ? 48.192 -16.790 105.249 1.00 70.30 ? 490 THR B N 1 ATOM 5762 C CA . THR D 1 124 ? 47.459 -15.801 106.031 1.00 72.85 ? 490 THR B CA 1 ATOM 5763 C C . THR D 1 124 ? 48.258 -14.509 106.172 1.00 68.16 ? 490 THR B C 1 ATOM 5764 O O . THR D 1 124 ? 47.714 -13.466 106.530 1.00 70.17 ? 490 THR B O 1 ATOM 5765 C CB . THR D 1 124 ? 47.111 -16.338 107.433 1.00 83.06 ? 490 THR B CB 1 ATOM 5766 O OG1 . THR D 1 124 ? 46.776 -17.729 107.344 1.00 89.99 ? 490 THR B OG1 1 ATOM 5767 C CG2 . THR D 1 124 ? 45.932 -15.574 108.025 1.00 88.07 ? 490 THR B CG2 1 ATOM 5768 N N . ILE D 1 125 ? 49.552 -14.581 105.886 1.00 61.48 ? 491 ILE B N 1 ATOM 5769 C CA . ILE D 1 125 ? 50.405 -13.403 105.951 1.00 63.88 ? 491 ILE B CA 1 ATOM 5770 C C . ILE D 1 125 ? 50.336 -12.615 104.650 1.00 65.39 ? 491 ILE B C 1 ATOM 5771 O O . ILE D 1 125 ? 50.685 -13.128 103.588 1.00 64.95 ? 491 ILE B O 1 ATOM 5772 C CB . ILE D 1 125 ? 51.872 -13.774 106.239 1.00 62.04 ? 491 ILE B CB 1 ATOM 5773 C CG1 . ILE D 1 125 ? 51.984 -14.515 107.571 1.00 59.21 ? 491 ILE B CG1 1 ATOM 5774 C CG2 . ILE D 1 125 ? 52.738 -12.529 106.255 1.00 56.85 ? 491 ILE B CG2 1 ATOM 5775 C CD1 . ILE D 1 125 ? 53.393 -14.944 107.905 1.00 59.36 ? 491 ILE B CD1 1 ATOM 5776 N N . THR D 1 126 ? 49.879 -11.370 104.739 1.00 69.08 ? 492 THR B N 1 ATOM 5777 C CA . THR D 1 126 ? 49.779 -10.510 103.565 1.00 70.26 ? 492 THR B CA 1 ATOM 5778 C C . THR D 1 126 ? 51.158 -9.970 103.192 1.00 69.20 ? 492 THR B C 1 ATOM 5779 O O . THR D 1 126 ? 51.969 -9.639 104.058 1.00 70.98 ? 492 THR B O 1 ATOM 5780 C CB . THR D 1 126 ? 48.800 -9.340 103.798 1.00 72.30 ? 492 THR B CB 1 ATOM 5781 O OG1 . THR D 1 126 ? 47.534 -9.854 104.231 1.00 76.12 ? 492 THR B OG1 1 ATOM 5782 C CG2 . THR D 1 126 ? 48.600 -8.536 102.521 1.00 68.88 ? 492 THR B CG2 1 ATOM 5783 N N . LYS D 1 127 ? 51.412 -9.886 101.893 1.00 67.40 ? 493 LYS B N 1 ATOM 5784 C CA . LYS D 1 127 ? 52.714 -9.506 101.365 1.00 62.88 ? 493 LYS B CA 1 ATOM 5785 C C . LYS D 1 127 ? 52.829 -8.000 101.125 1.00 67.10 ? 493 LYS B C 1 ATOM 5786 O O . LYS D 1 127 ? 51.933 -7.393 100.538 1.00 71.14 ? 493 LYS B O 1 ATOM 5787 C CB . LYS D 1 127 ? 52.963 -10.257 100.062 1.00 59.70 ? 493 LYS B CB 1 ATOM 5788 C CG . LYS D 1 127 ? 54.405 -10.557 99.749 1.00 57.06 ? 493 LYS B CG 1 ATOM 5789 C CD . LYS D 1 127 ? 54.476 -11.324 98.446 1.00 59.80 ? 493 LYS B CD 1 ATOM 5790 C CE . LYS D 1 127 ? 55.823 -11.973 98.251 1.00 65.40 ? 493 LYS B CE 1 ATOM 5791 N NZ . LYS D 1 127 ? 55.910 -12.618 96.911 1.00 70.80 ? 493 LYS B NZ 1 ATOM 5792 N N . PRO D 1 128 ? 53.937 -7.392 101.577 1.00 67.47 ? 494 PRO B N 1 ATOM 5793 C CA . PRO D 1 128 ? 54.207 -5.973 101.315 1.00 65.63 ? 494 PRO B CA 1 ATOM 5794 C C . PRO D 1 128 ? 54.527 -5.725 99.844 1.00 63.90 ? 494 PRO B C 1 ATOM 5795 O O . PRO D 1 128 ? 54.817 -6.673 99.117 1.00 66.09 ? 494 PRO B O 1 ATOM 5796 C CB . PRO D 1 128 ? 55.428 -5.671 102.196 1.00 67.15 ? 494 PRO B CB 1 ATOM 5797 C CG . PRO D 1 128 ? 55.498 -6.799 103.181 1.00 69.92 ? 494 PRO B CG 1 ATOM 5798 C CD . PRO D 1 128 ? 54.955 -7.989 102.456 1.00 70.37 ? 494 PRO B CD 1 ATOM 5799 N N . LEU D 1 129 ? 54.477 -4.468 99.413 1.00 62.44 ? 495 LEU B N 1 ATOM 5800 C CA . LEU D 1 129 ? 54.789 -4.129 98.029 1.00 66.61 ? 495 LEU B CA 1 ATOM 5801 C C . LEU D 1 129 ? 56.275 -4.311 97.732 1.00 70.71 ? 495 LEU B C 1 ATOM 5802 O O . LEU D 1 129 ? 56.654 -4.648 96.609 1.00 76.69 ? 495 LEU B O 1 ATOM 5803 C CB . LEU D 1 129 ? 54.365 -2.692 97.716 1.00 70.50 ? 495 LEU B CB 1 ATOM 5804 C CG . LEU D 1 129 ? 52.861 -2.430 97.607 1.00 73.94 ? 495 LEU B CG 1 ATOM 5805 C CD1 . LEU D 1 129 ? 52.592 -0.966 97.286 1.00 78.15 ? 495 LEU B CD1 1 ATOM 5806 C CD2 . LEU D 1 129 ? 52.238 -3.337 96.558 1.00 73.54 ? 495 LEU B CD2 1 ATOM 5807 N N . LYS D 1 130 ? 57.109 -4.093 98.746 1.00 66.42 ? 496 LYS B N 1 ATOM 5808 C CA . LYS D 1 130 ? 58.556 -4.197 98.593 1.00 60.97 ? 496 LYS B CA 1 ATOM 5809 C C . LYS D 1 130 ? 59.246 -4.224 99.951 1.00 63.24 ? 496 LYS B C 1 ATOM 5810 O O . LYS D 1 130 ? 58.614 -3.992 100.981 1.00 67.99 ? 496 LYS B O 1 ATOM 5811 C CB . LYS D 1 130 ? 59.093 -3.028 97.762 1.00 61.28 ? 496 LYS B CB 1 ATOM 5812 C CG . LYS D 1 130 ? 58.985 -1.677 98.455 1.00 59.81 ? 496 LYS B CG 1 ATOM 5813 C CD . LYS D 1 130 ? 59.280 -0.533 97.499 1.00 62.16 ? 496 LYS B CD 1 ATOM 5814 C CE . LYS D 1 130 ? 58.186 -0.387 96.452 1.00 67.83 ? 496 LYS B CE 1 ATOM 5815 N NZ . LYS D 1 130 ? 58.431 0.765 95.538 1.00 67.13 ? 496 LYS B NZ 1 ATOM 5816 N N . TYR D 1 131 ? 60.544 -4.510 99.950 1.00 53.99 ? 497 TYR B N 1 ATOM 5817 C CA . TYR D 1 131 ? 61.350 -4.381 101.159 1.00 52.93 ? 497 TYR B CA 1 ATOM 5818 C C . TYR D 1 131 ? 61.902 -2.964 101.248 1.00 52.73 ? 497 TYR B C 1 ATOM 5819 O O . TYR D 1 131 ? 62.341 -2.399 100.248 1.00 50.26 ? 497 TYR B O 1 ATOM 5820 C CB . TYR D 1 131 ? 62.497 -5.396 101.175 1.00 54.65 ? 497 TYR B CB 1 ATOM 5821 C CG . TYR D 1 131 ? 62.050 -6.840 101.188 1.00 61.65 ? 497 TYR B CG 1 ATOM 5822 C CD1 . TYR D 1 131 ? 61.584 -7.434 102.355 1.00 59.01 ? 497 TYR B CD1 1 ATOM 5823 C CD2 . TYR D 1 131 ? 62.105 -7.613 100.035 1.00 67.06 ? 497 TYR B CD2 1 ATOM 5824 C CE1 . TYR D 1 131 ? 61.179 -8.757 102.371 1.00 59.93 ? 497 TYR B CE1 1 ATOM 5825 C CE2 . TYR D 1 131 ? 61.703 -8.936 100.041 1.00 67.42 ? 497 TYR B CE2 1 ATOM 5826 C CZ . TYR D 1 131 ? 61.241 -9.503 101.210 1.00 65.15 ? 497 TYR B CZ 1 ATOM 5827 O OH . TYR D 1 131 ? 60.840 -10.820 101.216 1.00 68.95 ? 497 TYR B OH 1 ATOM 5828 N N . SER D 1 132 ? 61.880 -2.390 102.445 1.00 55.05 ? 498 SER B N 1 ATOM 5829 C CA . SER D 1 132 ? 62.378 -1.033 102.633 1.00 54.69 ? 498 SER B CA 1 ATOM 5830 C C . SER D 1 132 ? 63.258 -0.929 103.870 1.00 54.56 ? 498 SER B C 1 ATOM 5831 O O . SER D 1 132 ? 62.996 -1.574 104.885 1.00 54.09 ? 498 SER B O 1 ATOM 5832 C CB . SER D 1 132 ? 61.216 -0.044 102.735 1.00 51.12 ? 498 SER B CB 1 ATOM 5833 O OG . SER D 1 132 ? 60.422 -0.069 101.563 1.00 56.41 ? 498 SER B OG 1 ATOM 5834 N N . TYR D 1 133 ? 64.307 -0.117 103.779 1.00 55.62 ? 499 TYR B N 1 ATOM 5835 C CA . TYR D 1 133 ? 65.167 0.139 104.929 1.00 51.03 ? 499 TYR B CA 1 ATOM 5836 C C . TYR D 1 133 ? 65.769 1.536 104.876 1.00 49.59 ? 499 TYR B C 1 ATOM 5837 O O . TYR D 1 133 ? 65.916 2.119 103.802 1.00 49.95 ? 499 TYR B O 1 ATOM 5838 C CB . TYR D 1 133 ? 66.278 -0.910 105.019 1.00 48.64 ? 499 TYR B CB 1 ATOM 5839 C CG . TYR D 1 133 ? 67.272 -0.891 103.876 1.00 52.94 ? 499 TYR B CG 1 ATOM 5840 C CD1 . TYR D 1 133 ? 68.470 -0.192 103.981 1.00 52.75 ? 499 TYR B CD1 1 ATOM 5841 C CD2 . TYR D 1 133 ? 67.022 -1.591 102.701 1.00 55.88 ? 499 TYR B CD2 1 ATOM 5842 C CE1 . TYR D 1 133 ? 69.387 -0.181 102.941 1.00 55.52 ? 499 TYR B CE1 1 ATOM 5843 C CE2 . TYR D 1 133 ? 67.933 -1.586 101.655 1.00 56.66 ? 499 TYR B CE2 1 ATOM 5844 C CZ . TYR D 1 133 ? 69.114 -0.881 101.782 1.00 55.80 ? 499 TYR B CZ 1 ATOM 5845 O OH . TYR D 1 133 ? 70.019 -0.872 100.745 1.00 54.97 ? 499 TYR B OH 1 ATOM 5846 N N . ILE D 1 134 ? 66.109 2.066 106.047 1.00 48.60 ? 500 ILE B N 1 ATOM 5847 C CA . ILE D 1 134 ? 66.737 3.375 106.152 1.00 51.62 ? 500 ILE B CA 1 ATOM 5848 C C . ILE D 1 134 ? 68.231 3.280 105.852 1.00 58.16 ? 500 ILE B C 1 ATOM 5849 O O . ILE D 1 134 ? 68.966 2.583 106.549 1.00 59.60 ? 500 ILE B O 1 ATOM 5850 C CB . ILE D 1 134 ? 66.530 3.981 107.553 1.00 53.00 ? 500 ILE B CB 1 ATOM 5851 C CG1 . ILE D 1 134 ? 65.046 3.962 107.932 1.00 48.59 ? 500 ILE B CG1 1 ATOM 5852 C CG2 . ILE D 1 134 ? 67.089 5.395 107.614 1.00 57.84 ? 500 ILE B CG2 1 ATOM 5853 C CD1 . ILE D 1 134 ? 64.747 4.584 109.280 1.00 47.65 ? 500 ILE B CD1 1 ATOM 5854 N N . ASN D 1 135 ? 68.674 3.978 104.810 1.00 65.43 ? 501 ASN B N 1 ATOM 5855 C CA . ASN D 1 135 ? 70.073 3.931 104.396 1.00 69.20 ? 501 ASN B CA 1 ATOM 5856 C C . ASN D 1 135 ? 70.943 4.878 105.216 1.00 69.82 ? 501 ASN B C 1 ATOM 5857 O O . ASN D 1 135 ? 72.063 4.535 105.597 1.00 71.33 ? 501 ASN B O 1 ATOM 5858 C CB . ASN D 1 135 ? 70.203 4.264 102.909 1.00 77.13 ? 501 ASN B CB 1 ATOM 5859 C CG . ASN D 1 135 ? 71.540 3.839 102.331 1.00 88.76 ? 501 ASN B CG 1 ATOM 5860 O OD1 . ASN D 1 135 ? 72.530 4.565 102.425 1.00 96.88 ? 501 ASN B OD1 1 ATOM 5861 N ND2 . ASN D 1 135 ? 71.574 2.657 101.726 1.00 90.37 ? 501 ASN B ND2 1 ATOM 5862 N N . LYS D 1 136 ? 70.423 6.073 105.475 1.00 68.26 ? 502 LYS B N 1 ATOM 5863 C CA . LYS D 1 136 ? 71.103 7.047 106.322 1.00 68.44 ? 502 LYS B CA 1 ATOM 5864 C C . LYS D 1 136 ? 70.105 7.768 107.223 1.00 63.95 ? 502 LYS B C 1 ATOM 5865 O O . LYS D 1 136 ? 68.970 8.019 106.827 1.00 62.64 ? 502 LYS B O 1 ATOM 5866 C CB . LYS D 1 136 ? 71.876 8.067 105.479 1.00 75.85 ? 502 LYS B CB 1 ATOM 5867 C CG . LYS D 1 136 ? 73.079 7.499 104.743 1.00 83.65 ? 502 LYS B CG 1 ATOM 5868 C CD . LYS D 1 136 ? 74.021 8.607 104.296 1.00 92.39 ? 502 LYS B CD 1 ATOM 5869 C CE . LYS D 1 136 ? 74.554 9.387 105.492 1.00 94.77 ? 502 LYS B CE 1 ATOM 5870 N NZ . LYS D 1 136 ? 75.493 10.472 105.087 1.00 99.76 ? 502 LYS B NZ 1 ATOM 5871 N N . CYS D 1 137 ? 70.539 8.092 108.436 1.00 60.54 ? 503 CYS B N 1 ATOM 5872 C CA . CYS D 1 137 ? 69.714 8.826 109.387 1.00 58.63 ? 503 CYS B CA 1 ATOM 5873 C C . CYS D 1 137 ? 70.590 9.749 110.222 1.00 57.19 ? 503 CYS B C 1 ATOM 5874 O O . CYS D 1 137 ? 71.347 9.292 111.080 1.00 59.79 ? 503 CYS B O 1 ATOM 5875 C CB . CYS D 1 137 ? 68.937 7.865 110.289 1.00 62.26 ? 503 CYS B CB 1 ATOM 5876 S SG . CYS D 1 137 ? 68.007 8.667 111.621 1.00 70.54 ? 503 CYS B SG 1 ATOM 5877 N N . SER D 1 138 ? 70.489 11.048 109.971 1.00 55.90 ? 504 SER B N 1 ATOM 5878 C CA . SER D 1 138 ? 71.377 12.003 110.621 1.00 60.14 ? 504 SER B CA 1 ATOM 5879 C C . SER D 1 138 ? 70.642 13.221 111.159 1.00 62.44 ? 504 SER B C 1 ATOM 5880 O O . SER D 1 138 ? 69.513 13.511 110.765 1.00 64.06 ? 504 SER B O 1 ATOM 5881 C CB . SER D 1 138 ? 72.466 12.461 109.649 1.00 65.42 ? 504 SER B CB 1 ATOM 5882 O OG . SER D 1 138 ? 73.196 11.361 109.142 1.00 69.21 ? 504 SER B OG 1 ATOM 5883 N N . ARG D 1 139 ? 71.300 13.925 112.073 1.00 63.19 ? 505 ARG B N 1 ATOM 5884 C CA . ARG D 1 139 ? 70.823 15.213 112.555 1.00 67.55 ? 505 ARG B CA 1 ATOM 5885 C C . ARG D 1 139 ? 71.604 16.336 111.885 1.00 69.01 ? 505 ARG B C 1 ATOM 5886 O O . ARG D 1 139 ? 72.813 16.455 112.069 1.00 67.28 ? 505 ARG B O 1 ATOM 5887 C CB . ARG D 1 139 ? 70.958 15.315 114.077 1.00 70.56 ? 505 ARG B CB 1 ATOM 5888 C CG . ARG D 1 139 ? 69.830 14.657 114.853 1.00 68.11 ? 505 ARG B CG 1 ATOM 5889 C CD . ARG D 1 139 ? 68.903 15.696 115.459 1.00 69.33 ? 505 ARG B CD 1 ATOM 5890 N NE . ARG D 1 139 ? 69.510 16.371 116.604 1.00 74.11 ? 505 ARG B NE 1 ATOM 5891 C CZ . ARG D 1 139 ? 69.367 17.664 116.874 1.00 77.64 ? 505 ARG B CZ 1 ATOM 5892 N NH1 . ARG D 1 139 ? 68.638 18.432 116.077 1.00 81.30 ? 505 ARG B NH1 1 ATOM 5893 N NH2 . ARG D 1 139 ? 69.957 18.190 117.939 1.00 79.43 ? 505 ARG B NH2 1 ATOM 5894 N N . PHE D 1 140 ? 70.917 17.152 111.096 1.00 71.20 ? 506 PHE B N 1 ATOM 5895 C CA . PHE D 1 140 ? 71.553 18.319 110.505 1.00 73.17 ? 506 PHE B CA 1 ATOM 5896 C C . PHE D 1 140 ? 71.461 19.467 111.496 1.00 83.86 ? 506 PHE B C 1 ATOM 5897 O O . PHE D 1 140 ? 70.375 19.972 111.776 1.00 87.64 ? 506 PHE B O 1 ATOM 5898 C CB . PHE D 1 140 ? 70.903 18.699 109.177 1.00 77.14 ? 506 PHE B CB 1 ATOM 5899 C CG . PHE D 1 140 ? 71.736 19.630 108.347 1.00 79.79 ? 506 PHE B CG 1 ATOM 5900 C CD1 . PHE D 1 140 ? 73.060 19.331 108.075 1.00 79.77 ? 506 PHE B CD1 1 ATOM 5901 C CD2 . PHE D 1 140 ? 71.198 20.797 107.834 1.00 85.12 ? 506 PHE B CD2 1 ATOM 5902 C CE1 . PHE D 1 140 ? 73.835 20.180 107.313 1.00 86.00 ? 506 PHE B CE1 1 ATOM 5903 C CE2 . PHE D 1 140 ? 71.968 21.652 107.068 1.00 89.99 ? 506 PHE B CE2 1 ATOM 5904 C CZ . PHE D 1 140 ? 73.289 21.338 106.805 1.00 90.21 ? 506 PHE B CZ 1 ATOM 5905 N N . LEU D 1 141 ? 72.608 19.865 112.034 1.00 83.88 ? 507 LEU B N 1 ATOM 5906 C CA . LEU D 1 141 ? 72.656 20.818 113.136 1.00 86.34 ? 507 LEU B CA 1 ATOM 5907 C C . LEU D 1 141 ? 72.209 22.219 112.736 1.00 90.67 ? 507 LEU B C 1 ATOM 5908 O O . LEU D 1 141 ? 72.027 22.528 111.558 1.00 92.09 ? 507 LEU B O 1 ATOM 5909 C CB . LEU D 1 141 ? 74.071 20.869 113.724 1.00 89.02 ? 507 LEU B CB 1 ATOM 5910 C CG . LEU D 1 141 ? 74.294 20.078 115.017 1.00 86.30 ? 507 LEU B CG 1 ATOM 5911 C CD1 . LEU D 1 141 ? 73.450 18.810 115.062 1.00 75.75 ? 507 LEU B CD1 1 ATOM 5912 C CD2 . LEU D 1 141 ? 75.766 19.750 115.198 1.00 89.07 ? 507 LEU B CD2 1 ATOM 5913 N N . SER D 1 142 ? 72.043 23.064 113.745 1.00 93.94 ? 508 SER B N 1 ATOM 5914 C CA . SER D 1 142 ? 71.543 24.417 113.565 1.00 101.48 ? 508 SER B CA 1 ATOM 5915 C C . SER D 1 142 ? 72.525 25.280 112.781 1.00 105.75 ? 508 SER B C 1 ATOM 5916 O O . SER D 1 142 ? 72.136 26.270 112.156 1.00 111.34 ? 508 SER B O 1 ATOM 5917 C CB . SER D 1 142 ? 71.254 25.045 114.927 1.00 102.85 ? 508 SER B CB 1 ATOM 5918 O OG . SER D 1 142 ? 72.334 24.831 115.821 1.00 101.92 ? 508 SER B OG 1 ATOM 5919 N N . ASP D 1 143 ? 73.795 24.890 112.810 1.00 103.41 ? 509 ASP B N 1 ATOM 5920 C CA . ASP D 1 143 ? 74.846 25.629 112.122 1.00 108.10 ? 509 ASP B CA 1 ATOM 5921 C C . ASP D 1 143 ? 74.741 25.510 110.603 1.00 113.32 ? 509 ASP B C 1 ATOM 5922 O O . ASP D 1 143 ? 75.317 26.322 109.875 1.00 120.10 ? 509 ASP B O 1 ATOM 5923 C CB . ASP D 1 143 ? 76.226 25.148 112.587 1.00 105.48 ? 509 ASP B CB 1 ATOM 5924 C CG . ASP D 1 143 ? 76.406 23.638 112.459 1.00 103.10 ? 509 ASP B CG 1 ATOM 5925 O OD1 . ASP D 1 143 ? 77.116 23.054 113.305 1.00 102.49 ? 509 ASP B OD1 1 ATOM 5926 O OD2 . ASP D 1 143 ? 75.850 23.028 111.520 1.00 103.15 ? 509 ASP B OD2 1 ATOM 5927 N N . ASP D 1 144 ? 74.015 24.491 110.141 1.00 113.79 ? 510 ASP B N 1 ATOM 5928 C CA . ASP D 1 144 ? 73.945 24.137 108.723 1.00 119.17 ? 510 ASP B CA 1 ATOM 5929 C C . ASP D 1 144 ? 75.319 23.752 108.195 1.00 126.08 ? 510 ASP B C 1 ATOM 5930 O O . ASP D 1 144 ? 75.553 23.741 106.987 1.00 127.57 ? 510 ASP B O 1 ATOM 5931 C CB . ASP D 1 144 ? 73.368 25.285 107.895 1.00 123.71 ? 510 ASP B CB 1 ATOM 5932 C CG . ASP D 1 144 ? 71.881 25.460 108.095 1.00 123.56 ? 510 ASP B CG 1 ATOM 5933 O OD1 . ASP D 1 144 ? 71.335 24.876 109.055 1.00 120.31 ? 510 ASP B OD1 1 ATOM 5934 O OD2 . ASP D 1 144 ? 71.261 26.182 107.287 1.00 127.97 ? 510 ASP B OD2 1 ATOM 5935 N N . ARG D 1 145 ? 76.228 23.436 109.111 1.00 131.45 ? 511 ARG B N 1 ATOM 5936 C CA . ARG D 1 145 ? 77.602 23.120 108.751 1.00 133.68 ? 511 ARG B CA 1 ATOM 5937 C C . ARG D 1 145 ? 77.967 21.693 109.125 1.00 127.26 ? 511 ARG B C 1 ATOM 5938 O O . ARG D 1 145 ? 78.849 21.094 108.516 1.00 128.78 ? 511 ARG B O 1 ATOM 5939 C CB . ARG D 1 145 ? 78.564 24.103 109.424 1.00 141.09 ? 511 ARG B CB 1 ATOM 5940 C CG . ARG D 1 145 ? 78.991 25.277 108.556 1.00 151.81 ? 511 ARG B CG 1 ATOM 5941 C CD . ARG D 1 145 ? 77.840 25.882 107.757 1.00 156.59 ? 511 ARG B CD 1 ATOM 5942 N NE . ARG D 1 145 ? 77.701 25.248 106.451 1.00 156.03 ? 511 ARG B NE 1 ATOM 5943 C CZ . ARG D 1 145 ? 78.475 25.526 105.409 1.00 159.32 ? 511 ARG B CZ 1 ATOM 5944 N NH1 . ARG D 1 145 ? 79.437 26.432 105.523 1.00 163.93 ? 511 ARG B NH1 1 ATOM 5945 N NH2 . ARG D 1 145 ? 78.290 24.904 104.252 1.00 157.97 ? 511 ARG B NH2 1 ATOM 5946 N N . THR D 1 146 ? 77.266 21.143 110.109 1.00 117.48 ? 512 THR B N 1 ATOM 5947 C CA . THR D 1 146 ? 77.655 19.866 110.689 1.00 103.03 ? 512 THR B CA 1 ATOM 5948 C C . THR D 1 146 ? 76.579 18.790 110.558 1.00 93.13 ? 512 THR B C 1 ATOM 5949 O O . THR D 1 146 ? 75.400 19.045 110.800 1.00 90.37 ? 512 THR B O 1 ATOM 5950 C CB . THR D 1 146 ? 78.005 20.038 112.177 1.00 99.00 ? 512 THR B CB 1 ATOM 5951 O OG1 . THR D 1 146 ? 78.562 21.342 112.392 1.00 101.98 ? 512 THR B OG1 1 ATOM 5952 C CG2 . THR D 1 146 ? 79.005 18.985 112.609 1.00 95.45 ? 512 THR B CG2 1 ATOM 5953 N N . GLU D 1 147 ? 76.993 17.585 110.176 1.00 86.77 ? 513 GLU B N 1 ATOM 5954 C CA . GLU D 1 147 ? 76.078 16.449 110.095 1.00 81.15 ? 513 GLU B CA 1 ATOM 5955 C C . GLU D 1 147 ? 76.435 15.388 111.131 1.00 78.30 ? 513 GLU B C 1 ATOM 5956 O O . GLU D 1 147 ? 77.582 14.949 111.211 1.00 77.15 ? 513 GLU B O 1 ATOM 5957 C CB . GLU D 1 147 ? 76.093 15.831 108.694 1.00 80.06 ? 513 GLU B CB 1 ATOM 5958 C CG . GLU D 1 147 ? 75.123 14.670 108.519 1.00 75.85 ? 513 GLU B CG 1 ATOM 5959 C CD . GLU D 1 147 ? 75.571 13.687 107.452 1.00 76.77 ? 513 GLU B CD 1 ATOM 5960 O OE1 . GLU D 1 147 ? 76.708 13.826 106.956 1.00 81.69 ? 513 GLU B OE1 1 ATOM 5961 O OE2 . GLU D 1 147 ? 74.787 12.776 107.113 1.00 72.58 ? 513 GLU B OE2 1 ATOM 5962 N N . VAL D 1 148 ? 75.448 14.979 111.921 1.00 75.62 ? 514 VAL B N 1 ATOM 5963 C CA . VAL D 1 148 ? 75.664 13.971 112.952 1.00 73.13 ? 514 VAL B CA 1 ATOM 5964 C C . VAL D 1 148 ? 74.753 12.773 112.748 1.00 70.42 ? 514 VAL B C 1 ATOM 5965 O O . VAL D 1 148 ? 73.553 12.854 113.014 1.00 72.23 ? 514 VAL B O 1 ATOM 5966 C CB . VAL D 1 148 ? 75.422 14.538 114.359 1.00 73.90 ? 514 VAL B CB 1 ATOM 5967 C CG1 . VAL D 1 148 ? 75.727 13.481 115.412 1.00 69.60 ? 514 VAL B CG1 1 ATOM 5968 C CG2 . VAL D 1 148 ? 76.268 15.776 114.576 1.00 80.29 ? 514 VAL B CG2 1 ATOM 5969 N N . PRO D 1 149 ? 75.320 11.652 112.278 1.00 67.94 ? 515 PRO B N 1 ATOM 5970 C CA . PRO D 1 149 ? 74.539 10.433 112.041 1.00 62.53 ? 515 PRO B CA 1 ATOM 5971 C C . PRO D 1 149 ? 73.910 9.898 113.326 1.00 63.08 ? 515 PRO B C 1 ATOM 5972 O O . PRO D 1 149 ? 74.524 9.960 114.392 1.00 64.08 ? 515 PRO B O 1 ATOM 5973 C CB . PRO D 1 149 ? 75.575 9.452 111.482 1.00 61.98 ? 515 PRO B CB 1 ATOM 5974 C CG . PRO D 1 149 ? 76.886 9.964 111.980 1.00 66.58 ? 515 PRO B CG 1 ATOM 5975 C CD . PRO D 1 149 ? 76.755 11.451 112.018 1.00 68.56 ? 515 PRO B CD 1 ATOM 5976 N N . GLN D 1 150 ? 72.687 9.390 113.218 1.00 63.59 ? 516 GLN B N 1 ATOM 5977 C CA . GLN D 1 150 ? 71.961 8.884 114.377 1.00 63.48 ? 516 GLN B CA 1 ATOM 5978 C C . GLN D 1 150 ? 71.955 7.359 114.402 1.00 57.86 ? 516 GLN B C 1 ATOM 5979 O O . GLN D 1 150 ? 71.122 6.722 113.759 1.00 56.06 ? 516 GLN B O 1 ATOM 5980 C CB . GLN D 1 150 ? 70.525 9.415 114.382 1.00 65.15 ? 516 GLN B CB 1 ATOM 5981 C CG . GLN D 1 150 ? 70.418 10.930 114.480 1.00 66.47 ? 516 GLN B CG 1 ATOM 5982 C CD . GLN D 1 150 ? 70.937 11.467 115.801 1.00 66.90 ? 516 GLN B CD 1 ATOM 5983 O OE1 . GLN D 1 150 ? 71.959 12.152 115.847 1.00 73.72 ? 516 GLN B OE1 1 ATOM 5984 N NE2 . GLN D 1 150 ? 70.230 11.161 116.884 1.00 62.27 ? 516 GLN B NE2 1 ATOM 5985 N N . LEU D 1 151 ? 72.891 6.781 115.146 1.00 56.78 ? 517 LEU B N 1 ATOM 5986 C CA . LEU D 1 151 ? 72.973 5.333 115.277 1.00 56.05 ? 517 LEU B CA 1 ATOM 5987 C C . LEU D 1 151 ? 71.877 4.810 116.199 1.00 56.71 ? 517 LEU B C 1 ATOM 5988 O O . LEU D 1 151 ? 71.696 5.312 117.307 1.00 55.10 ? 517 LEU B O 1 ATOM 5989 C CB . LEU D 1 151 ? 74.348 4.917 115.798 1.00 58.00 ? 517 LEU B CB 1 ATOM 5990 C CG . LEU D 1 151 ? 75.539 5.337 114.935 1.00 61.91 ? 517 LEU B CG 1 ATOM 5991 C CD1 . LEU D 1 151 ? 76.824 4.712 115.453 1.00 68.54 ? 517 LEU B CD1 1 ATOM 5992 C CD2 . LEU D 1 151 ? 75.305 4.967 113.479 1.00 60.14 ? 517 LEU B CD2 1 ATOM 5993 N N . VAL D 1 152 ? 71.145 3.801 115.736 1.00 60.34 ? 518 VAL B N 1 ATOM 5994 C CA . VAL D 1 152 ? 70.036 3.251 116.507 1.00 59.37 ? 518 VAL B CA 1 ATOM 5995 C C . VAL D 1 152 ? 70.554 2.500 117.732 1.00 60.10 ? 518 VAL B C 1 ATOM 5996 O O . VAL D 1 152 ? 71.546 1.774 117.658 1.00 63.55 ? 518 VAL B O 1 ATOM 5997 C CB . VAL D 1 152 ? 69.149 2.315 115.643 1.00 58.31 ? 518 VAL B CB 1 ATOM 5998 C CG1 . VAL D 1 152 ? 69.950 1.134 115.109 1.00 54.62 ? 518 VAL B CG1 1 ATOM 5999 C CG2 . VAL D 1 152 ? 67.937 1.839 116.434 1.00 60.93 ? 518 VAL B CG2 1 ATOM 6000 N N . ASN D 1 153 ? 69.893 2.703 118.866 1.00 57.88 ? 519 ASN B N 1 ATOM 6001 C CA . ASN D 1 153 ? 70.275 2.028 120.098 1.00 61.36 ? 519 ASN B CA 1 ATOM 6002 C C . ASN D 1 153 ? 69.567 0.688 120.244 1.00 62.50 ? 519 ASN B C 1 ATOM 6003 O O . ASN D 1 153 ? 68.606 0.402 119.532 1.00 59.46 ? 519 ASN B O 1 ATOM 6004 C CB . ASN D 1 153 ? 69.977 2.915 121.308 1.00 67.00 ? 519 ASN B CB 1 ATOM 6005 C CG . ASN D 1 153 ? 70.800 4.190 121.314 1.00 69.02 ? 519 ASN B CG 1 ATOM 6006 O OD1 . ASN D 1 153 ? 71.951 4.204 120.874 1.00 68.22 ? 519 ASN B OD1 1 ATOM 6007 N ND2 . ASN D 1 153 ? 70.212 5.272 121.813 1.00 68.74 ? 519 ASN B ND2 1 ATOM 6008 N N . ALA D 1 154 ? 70.054 -0.131 121.170 1.00 70.66 ? 520 ALA B N 1 ATOM 6009 C CA . ALA D 1 154 ? 69.464 -1.437 121.431 1.00 73.49 ? 520 ALA B CA 1 ATOM 6010 C C . ALA D 1 154 ? 68.034 -1.303 121.952 1.00 74.91 ? 520 ALA B C 1 ATOM 6011 O O . ALA D 1 154 ? 67.738 -0.403 122.740 1.00 78.55 ? 520 ALA B O 1 ATOM 6012 C CB . ALA D 1 154 ? 70.320 -2.214 122.421 1.00 76.94 ? 520 ALA B CB 1 ATOM 6013 N N . ASN D 1 155 ? 67.160 -2.199 121.496 1.00 66.18 ? 521 ASN B N 1 ATOM 6014 C CA . ASN D 1 155 ? 65.760 -2.241 121.924 1.00 66.34 ? 521 ASN B CA 1 ATOM 6015 C C . ASN D 1 155 ? 65.000 -0.955 121.633 1.00 64.49 ? 521 ASN B C 1 ATOM 6016 O O . ASN D 1 155 ? 64.005 -0.654 122.292 1.00 74.38 ? 521 ASN B O 1 ATOM 6017 C CB . ASN D 1 155 ? 65.662 -2.555 123.420 1.00 66.64 ? 521 ASN B CB 1 ATOM 6018 C CG . ASN D 1 155 ? 66.384 -3.826 123.794 1.00 71.77 ? 521 ASN B CG 1 ATOM 6019 O OD1 . ASN D 1 155 ? 66.347 -4.814 123.061 1.00 71.30 ? 521 ASN B OD1 1 ATOM 6020 N ND2 . ASN D 1 155 ? 67.053 -3.810 124.941 1.00 81.93 ? 521 ASN B ND2 1 ATOM 6021 N N . GLN D 1 156 ? 65.467 -0.197 120.648 1.00 57.22 ? 522 GLN B N 1 ATOM 6022 C CA . GLN D 1 156 ? 64.837 1.074 120.310 1.00 56.56 ? 522 GLN B CA 1 ATOM 6023 C C . GLN D 1 156 ? 64.672 1.242 118.805 1.00 54.22 ? 522 GLN B C 1 ATOM 6024 O O . GLN D 1 156 ? 65.322 0.554 118.016 1.00 55.81 ? 522 GLN B O 1 ATOM 6025 C CB . GLN D 1 156 ? 65.649 2.243 120.881 1.00 58.59 ? 522 GLN B CB 1 ATOM 6026 C CG . GLN D 1 156 ? 65.634 2.325 122.400 1.00 67.43 ? 522 GLN B CG 1 ATOM 6027 C CD . GLN D 1 156 ? 66.398 3.524 122.927 1.00 76.00 ? 522 GLN B CD 1 ATOM 6028 O OE1 . GLN D 1 156 ? 66.871 4.360 122.158 1.00 78.70 ? 522 GLN B OE1 1 ATOM 6029 N NE2 . GLN D 1 156 ? 66.523 3.612 124.247 1.00 78.46 ? 522 GLN B NE2 1 ATOM 6030 N N . TYR D 1 157 ? 63.790 2.155 118.415 1.00 52.87 ? 523 TYR B N 1 ATOM 6031 C CA . TYR D 1 157 ? 63.603 2.490 117.011 1.00 51.34 ? 523 TYR B CA 1 ATOM 6032 C C . TYR D 1 157 ? 64.549 3.612 116.607 1.00 55.08 ? 523 TYR B C 1 ATOM 6033 O O . TYR D 1 157 ? 65.181 4.241 117.452 1.00 57.55 ? 523 TYR B O 1 ATOM 6034 C CB . TYR D 1 157 ? 62.155 2.904 116.733 1.00 52.16 ? 523 TYR B CB 1 ATOM 6035 C CG . TYR D 1 157 ? 61.140 1.795 116.890 1.00 53.22 ? 523 TYR B CG 1 ATOM 6036 C CD1 . TYR D 1 157 ? 60.833 0.951 115.830 1.00 48.74 ? 523 TYR B CD1 1 ATOM 6037 C CD2 . TYR D 1 157 ? 60.477 1.600 118.095 1.00 54.71 ? 523 TYR B CD2 1 ATOM 6038 C CE1 . TYR D 1 157 ? 59.901 -0.060 115.968 1.00 49.85 ? 523 TYR B CE1 1 ATOM 6039 C CE2 . TYR D 1 157 ? 59.543 0.591 118.242 1.00 55.35 ? 523 TYR B CE2 1 ATOM 6040 C CZ . TYR D 1 157 ? 59.259 -0.235 117.176 1.00 54.36 ? 523 TYR B CZ 1 ATOM 6041 O OH . TYR D 1 157 ? 58.330 -1.240 117.318 1.00 60.03 ? 523 TYR B OH 1 ATOM 6042 N N . SER D 1 158 ? 64.641 3.859 115.307 1.00 61.26 ? 524 SER B N 1 ATOM 6043 C CA . SER D 1 158 ? 65.419 4.978 114.797 1.00 61.48 ? 524 SER B CA 1 ATOM 6044 C C . SER D 1 158 ? 64.694 6.285 115.079 1.00 63.42 ? 524 SER B C 1 ATOM 6045 O O . SER D 1 158 ? 63.467 6.321 115.090 1.00 64.68 ? 524 SER B O 1 ATOM 6046 C CB . SER D 1 158 ? 65.665 4.824 113.295 1.00 63.39 ? 524 SER B CB 1 ATOM 6047 O OG . SER D 1 158 ? 66.377 5.935 112.774 1.00 67.28 ? 524 SER B OG 1 ATOM 6048 N N . PRO D 1 159 ? 65.451 7.366 115.317 1.00 66.59 ? 525 PRO B N 1 ATOM 6049 C CA . PRO D 1 159 ? 64.841 8.692 115.462 1.00 67.09 ? 525 PRO B CA 1 ATOM 6050 C C . PRO D 1 159 ? 64.136 9.135 114.180 1.00 67.22 ? 525 PRO B C 1 ATOM 6051 O O . PRO D 1 159 ? 63.293 10.031 114.219 1.00 65.36 ? 525 PRO B O 1 ATOM 6052 C CB . PRO D 1 159 ? 66.036 9.600 115.770 1.00 64.65 ? 525 PRO B CB 1 ATOM 6053 C CG . PRO D 1 159 ? 67.074 8.685 116.333 1.00 64.78 ? 525 PRO B CG 1 ATOM 6054 C CD . PRO D 1 159 ? 66.896 7.387 115.605 1.00 65.38 ? 525 PRO B CD 1 ATOM 6055 N N . CYS D 1 160 ? 64.475 8.498 113.062 1.00 68.93 ? 526 CYS B N 1 ATOM 6056 C CA . CYS D 1 160 ? 63.933 8.876 111.762 1.00 70.81 ? 526 CYS B CA 1 ATOM 6057 C C . CYS D 1 160 ? 62.706 8.057 111.354 1.00 71.52 ? 526 CYS B C 1 ATOM 6058 O O . CYS D 1 160 ? 62.257 8.139 110.211 1.00 73.29 ? 526 CYS B O 1 ATOM 6059 C CB . CYS D 1 160 ? 65.015 8.749 110.686 1.00 71.62 ? 526 CYS B CB 1 ATOM 6060 S SG . CYS D 1 160 ? 66.464 9.803 110.949 1.00 94.74 ? 526 CYS B SG 1 ATOM 6061 N N . VAL D 1 161 ? 62.155 7.275 112.281 1.00 68.92 ? 527 VAL B N 1 ATOM 6062 C CA . VAL D 1 161 ? 60.939 6.518 111.988 1.00 62.79 ? 527 VAL B CA 1 ATOM 6063 C C . VAL D 1 161 ? 59.739 7.456 111.910 1.00 59.70 ? 527 VAL B C 1 ATOM 6064 O O . VAL D 1 161 ? 58.667 7.072 111.450 1.00 60.07 ? 527 VAL B O 1 ATOM 6065 C CB . VAL D 1 161 ? 60.656 5.423 113.043 1.00 59.52 ? 527 VAL B CB 1 ATOM 6066 C CG1 . VAL D 1 161 ? 61.805 4.426 113.107 1.00 57.47 ? 527 VAL B CG1 1 ATOM 6067 C CG2 . VAL D 1 161 ? 60.386 6.041 114.406 1.00 54.32 ? 527 VAL B CG2 1 ATOM 6068 N N . SER D 1 162 ? 59.933 8.690 112.365 1.00 60.22 ? 528 SER B N 1 ATOM 6069 C CA . SER D 1 162 ? 58.882 9.697 112.331 1.00 64.75 ? 528 SER B CA 1 ATOM 6070 C C . SER D 1 162 ? 58.841 10.414 110.988 1.00 69.04 ? 528 SER B C 1 ATOM 6071 O O . SER D 1 162 ? 57.895 11.145 110.696 1.00 75.71 ? 528 SER B O 1 ATOM 6072 C CB . SER D 1 162 ? 59.081 10.713 113.457 1.00 67.87 ? 528 SER B CB 1 ATOM 6073 O OG . SER D 1 162 ? 60.327 11.375 113.329 1.00 67.04 ? 528 SER B OG 1 ATOM 6074 N N . ILE D 1 163 ? 59.871 10.207 110.172 1.00 68.29 ? 529 ILE B N 1 ATOM 6075 C CA . ILE D 1 163 ? 59.961 10.881 108.880 1.00 69.42 ? 529 ILE B CA 1 ATOM 6076 C C . ILE D 1 163 ? 60.069 9.895 107.719 1.00 65.85 ? 529 ILE B C 1 ATOM 6077 O O . ILE D 1 163 ? 59.922 10.275 106.557 1.00 66.04 ? 529 ILE B O 1 ATOM 6078 C CB . ILE D 1 163 ? 61.165 11.844 108.832 1.00 67.22 ? 529 ILE B CB 1 ATOM 6079 C CG1 . ILE D 1 163 ? 62.479 11.068 108.745 1.00 60.80 ? 529 ILE B CG1 1 ATOM 6080 C CG2 . ILE D 1 163 ? 61.163 12.760 110.046 1.00 70.08 ? 529 ILE B CG2 1 ATOM 6081 C CD1 . ILE D 1 163 ? 63.702 11.955 108.718 1.00 59.11 ? 529 ILE B CD1 1 ATOM 6082 N N . VAL D 1 164 ? 60.325 8.630 108.035 1.00 63.11 ? 530 VAL B N 1 ATOM 6083 C CA . VAL D 1 164 ? 60.414 7.592 107.012 1.00 62.09 ? 530 VAL B CA 1 ATOM 6084 C C . VAL D 1 164 ? 59.131 6.768 106.963 1.00 64.19 ? 530 VAL B C 1 ATOM 6085 O O . VAL D 1 164 ? 58.748 6.147 107.956 1.00 65.93 ? 530 VAL B O 1 ATOM 6086 C CB . VAL D 1 164 ? 61.612 6.654 107.256 1.00 55.26 ? 530 VAL B CB 1 ATOM 6087 C CG1 . VAL D 1 164 ? 61.595 5.506 106.261 1.00 51.52 ? 530 VAL B CG1 1 ATOM 6088 C CG2 . VAL D 1 164 ? 62.919 7.426 107.161 1.00 55.07 ? 530 VAL B CG2 1 ATOM 6089 N N . PRO D 1 165 ? 58.461 6.761 105.801 1.00 63.82 ? 531 PRO B N 1 ATOM 6090 C CA . PRO D 1 165 ? 57.206 6.030 105.593 1.00 63.71 ? 531 PRO B CA 1 ATOM 6091 C C . PRO D 1 165 ? 57.355 4.533 105.839 1.00 61.67 ? 531 PRO B C 1 ATOM 6092 O O . PRO D 1 165 ? 58.473 4.018 105.836 1.00 59.09 ? 531 PRO B O 1 ATOM 6093 C CB . PRO D 1 165 ? 56.877 6.304 104.121 1.00 63.10 ? 531 PRO B CB 1 ATOM 6094 C CG . PRO D 1 165 ? 57.624 7.544 103.785 1.00 62.97 ? 531 PRO B CG 1 ATOM 6095 C CD . PRO D 1 165 ? 58.882 7.482 104.588 1.00 60.88 ? 531 PRO B CD 1 ATOM 6096 N N . SER D 1 166 ? 56.235 3.846 106.041 1.00 64.07 ? 532 SER B N 1 ATOM 6097 C CA . SER D 1 166 ? 56.249 2.408 106.284 1.00 62.66 ? 532 SER B CA 1 ATOM 6098 C C . SER D 1 166 ? 56.726 1.646 105.050 1.00 63.35 ? 532 SER B C 1 ATOM 6099 O O . SER D 1 166 ? 57.162 0.500 105.143 1.00 62.30 ? 532 SER B O 1 ATOM 6100 C CB . SER D 1 166 ? 54.861 1.925 106.701 1.00 64.89 ? 532 SER B CB 1 ATOM 6101 O OG . SER D 1 166 ? 53.901 2.210 105.701 1.00 70.69 ? 532 SER B OG 1 ATOM 6102 N N . THR D 1 167 ? 56.635 2.293 103.895 1.00 65.55 ? 533 THR B N 1 ATOM 6103 C CA . THR D 1 167 ? 57.122 1.723 102.648 1.00 64.37 ? 533 THR B CA 1 ATOM 6104 C C . THR D 1 167 ? 57.755 2.816 101.796 1.00 63.29 ? 533 THR B C 1 ATOM 6105 O O . THR D 1 167 ? 57.090 3.776 101.410 1.00 64.31 ? 533 THR B O 1 ATOM 6106 C CB . THR D 1 167 ? 55.995 1.034 101.857 1.00 67.09 ? 533 THR B CB 1 ATOM 6107 O OG1 . THR D 1 167 ? 55.499 -0.082 102.607 1.00 69.33 ? 533 THR B OG1 1 ATOM 6108 C CG2 . THR D 1 167 ? 56.508 0.545 100.514 1.00 67.81 ? 533 THR B CG2 1 ATOM 6109 N N . VAL D 1 168 ? 59.047 2.673 101.520 1.00 59.88 ? 534 VAL B N 1 ATOM 6110 C CA . VAL D 1 168 ? 59.765 3.647 100.709 1.00 57.71 ? 534 VAL B CA 1 ATOM 6111 C C . VAL D 1 168 ? 59.301 3.559 99.258 1.00 68.25 ? 534 VAL B C 1 ATOM 6112 O O . VAL D 1 168 ? 59.316 2.488 98.654 1.00 72.11 ? 534 VAL B O 1 ATOM 6113 C CB . VAL D 1 168 ? 61.290 3.440 100.789 1.00 54.89 ? 534 VAL B CB 1 ATOM 6114 C CG1 . VAL D 1 168 ? 62.012 4.437 99.902 1.00 57.45 ? 534 VAL B CG1 1 ATOM 6115 C CG2 . VAL D 1 168 ? 61.764 3.570 102.230 1.00 51.01 ? 534 VAL B CG2 1 ATOM 6116 N N . TRP D 1 169 ? 58.882 4.695 98.711 1.00 69.39 ? 535 TRP B N 1 ATOM 6117 C CA . TRP D 1 169 ? 58.315 4.754 97.367 1.00 76.87 ? 535 TRP B CA 1 ATOM 6118 C C . TRP D 1 169 ? 59.376 4.525 96.293 1.00 78.72 ? 535 TRP B C 1 ATOM 6119 O O . TRP D 1 169 ? 59.231 3.651 95.438 1.00 76.46 ? 535 TRP B O 1 ATOM 6120 C CB . TRP D 1 169 ? 57.632 6.104 97.153 1.00 83.17 ? 535 TRP B CB 1 ATOM 6121 C CG . TRP D 1 169 ? 56.670 6.154 96.005 1.00 94.34 ? 535 TRP B CG 1 ATOM 6122 C CD1 . TRP D 1 169 ? 56.970 6.365 94.689 1.00 101.40 ? 535 TRP B CD1 1 ATOM 6123 C CD2 . TRP D 1 169 ? 55.245 6.016 96.074 1.00 97.54 ? 535 TRP B CD2 1 ATOM 6124 N NE1 . TRP D 1 169 ? 55.821 6.356 93.934 1.00 103.84 ? 535 TRP B NE1 1 ATOM 6125 C CE2 . TRP D 1 169 ? 54.749 6.144 94.760 1.00 104.48 ? 535 TRP B CE2 1 ATOM 6126 C CE3 . TRP D 1 169 ? 54.341 5.790 97.118 1.00 93.11 ? 535 TRP B CE3 1 ATOM 6127 C CZ2 . TRP D 1 169 ? 53.390 6.054 94.464 1.00 109.67 ? 535 TRP B CZ2 1 ATOM 6128 C CZ3 . TRP D 1 169 ? 52.993 5.702 96.821 1.00 98.05 ? 535 TRP B CZ3 1 ATOM 6129 C CH2 . TRP D 1 169 ? 52.530 5.834 95.505 1.00 106.81 ? 535 TRP B CH2 1 ATOM 6130 N N . GLU D 1 170 ? 60.442 5.315 96.346 1.00 87.49 ? 536 GLU B N 1 ATOM 6131 C CA . GLU D 1 170 ? 61.524 5.217 95.373 1.00 90.89 ? 536 GLU B CA 1 ATOM 6132 C C . GLU D 1 170 ? 62.862 5.018 96.077 1.00 85.10 ? 536 GLU B C 1 ATOM 6133 O O . GLU D 1 170 ? 63.130 5.644 97.099 1.00 82.71 ? 536 GLU B O 1 ATOM 6134 C CB . GLU D 1 170 ? 61.569 6.471 94.496 1.00 100.50 ? 536 GLU B CB 1 ATOM 6135 C CG . GLU D 1 170 ? 62.579 6.413 93.361 1.00 107.86 ? 536 GLU B CG 1 ATOM 6136 C CD . GLU D 1 170 ? 62.080 5.611 92.175 1.00 116.24 ? 536 GLU B CD 1 ATOM 6137 O OE1 . GLU D 1 170 ? 62.891 5.314 91.273 1.00 120.10 ? 536 GLU B OE1 1 ATOM 6138 O OE2 . GLU D 1 170 ? 60.875 5.284 92.143 1.00 119.05 ? 536 GLU B OE2 1 ATOM 6139 N N . ASP D 1 171 ? 63.699 4.144 95.528 1.00 85.55 ? 537 ASP B N 1 ATOM 6140 C CA . ASP D 1 171 ? 65.000 3.866 96.124 1.00 80.76 ? 537 ASP B CA 1 ATOM 6141 C C . ASP D 1 171 ? 65.890 5.102 96.092 1.00 81.68 ? 537 ASP B C 1 ATOM 6142 O O . ASP D 1 171 ? 66.245 5.596 95.022 1.00 87.41 ? 537 ASP B O 1 ATOM 6143 C CB . ASP D 1 171 ? 65.688 2.706 95.404 1.00 84.63 ? 537 ASP B CB 1 ATOM 6144 C CG . ASP D 1 171 ? 66.974 2.282 96.085 1.00 85.21 ? 537 ASP B CG 1 ATOM 6145 O OD1 . ASP D 1 171 ? 66.912 1.437 97.003 1.00 83.33 ? 537 ASP B OD1 1 ATOM 6146 O OD2 . ASP D 1 171 ? 68.048 2.792 95.703 1.00 86.59 ? 537 ASP B OD2 1 ATOM 6147 N N . GLY D 1 172 ? 66.243 5.600 97.272 1.00 75.31 ? 538 GLY B N 1 ATOM 6148 C CA . GLY D 1 172 ? 67.076 6.783 97.381 1.00 73.86 ? 538 GLY B CA 1 ATOM 6149 C C . GLY D 1 172 ? 66.278 8.030 97.705 1.00 74.54 ? 538 GLY B C 1 ATOM 6150 O O . GLY D 1 172 ? 66.764 9.147 97.537 1.00 78.35 ? 538 GLY B O 1 ATOM 6151 N N . ASP D 1 173 ? 65.047 7.839 98.172 1.00 74.36 ? 539 ASP B N 1 ATOM 6152 C CA . ASP D 1 173 ? 64.181 8.962 98.512 1.00 77.64 ? 539 ASP B CA 1 ATOM 6153 C C . ASP D 1 173 ? 64.715 9.737 99.708 1.00 78.27 ? 539 ASP B C 1 ATOM 6154 O O . ASP D 1 173 ? 65.479 9.209 100.518 1.00 75.49 ? 539 ASP B O 1 ATOM 6155 C CB . ASP D 1 173 ? 62.753 8.484 98.788 1.00 77.31 ? 539 ASP B CB 1 ATOM 6156 C CG . ASP D 1 173 ? 61.921 8.376 97.523 1.00 79.76 ? 539 ASP B CG 1 ATOM 6157 O OD1 . ASP D 1 173 ? 62.287 9.016 96.515 1.00 80.55 ? 539 ASP B OD1 1 ATOM 6158 O OD2 . ASP D 1 173 ? 60.900 7.656 97.537 1.00 81.56 ? 539 ASP B OD2 1 ATOM 6159 N N . TYR D 1 174 ? 64.296 10.995 99.809 1.00 80.07 ? 540 TYR B N 1 ATOM 6160 C CA . TYR D 1 174 ? 64.818 11.913 100.811 1.00 73.77 ? 540 TYR B CA 1 ATOM 6161 C C . TYR D 1 174 ? 63.734 12.352 101.787 1.00 69.76 ? 540 TYR B C 1 ATOM 6162 O O . TYR D 1 174 ? 62.589 12.573 101.398 1.00 72.25 ? 540 TYR B O 1 ATOM 6163 C CB . TYR D 1 174 ? 65.434 13.133 100.125 1.00 77.49 ? 540 TYR B CB 1 ATOM 6164 C CG . TYR D 1 174 ? 66.081 14.121 101.066 1.00 78.12 ? 540 TYR B CG 1 ATOM 6165 C CD1 . TYR D 1 174 ? 67.087 13.724 101.937 1.00 73.49 ? 540 TYR B CD1 1 ATOM 6166 C CD2 . TYR D 1 174 ? 65.701 15.458 101.068 1.00 80.95 ? 540 TYR B CD2 1 ATOM 6167 C CE1 . TYR D 1 174 ? 67.686 14.626 102.794 1.00 75.68 ? 540 TYR B CE1 1 ATOM 6168 C CE2 . TYR D 1 174 ? 66.295 16.367 101.920 1.00 81.62 ? 540 TYR B CE2 1 ATOM 6169 C CZ . TYR D 1 174 ? 67.287 15.947 102.781 1.00 82.17 ? 540 TYR B CZ 1 ATOM 6170 O OH . TYR D 1 174 ? 67.883 16.849 103.632 1.00 87.91 ? 540 TYR B OH 1 ATOM 6171 N N . TYR D 1 175 ? 64.102 12.475 103.058 1.00 64.95 ? 541 TYR B N 1 ATOM 6172 C CA . TYR D 1 175 ? 63.160 12.899 104.084 1.00 64.66 ? 541 TYR B CA 1 ATOM 6173 C C . TYR D 1 175 ? 63.815 13.907 105.021 1.00 64.39 ? 541 TYR B C 1 ATOM 6174 O O . TYR D 1 175 ? 65.013 13.832 105.286 1.00 61.48 ? 541 TYR B O 1 ATOM 6175 C CB . TYR D 1 175 ? 62.643 11.694 104.873 1.00 63.81 ? 541 TYR B CB 1 ATOM 6176 C CG . TYR D 1 175 ? 62.237 10.526 104.002 1.00 68.26 ? 541 TYR B CG 1 ATOM 6177 C CD1 . TYR D 1 175 ? 61.076 10.575 103.241 1.00 75.09 ? 541 TYR B CD1 1 ATOM 6178 C CD2 . TYR D 1 175 ? 63.016 9.376 103.938 1.00 61.03 ? 541 TYR B CD2 1 ATOM 6179 C CE1 . TYR D 1 175 ? 60.703 9.513 102.438 1.00 74.90 ? 541 TYR B CE1 1 ATOM 6180 C CE2 . TYR D 1 175 ? 62.648 8.308 103.141 1.00 59.15 ? 541 TYR B CE2 1 ATOM 6181 C CZ . TYR D 1 175 ? 61.490 8.382 102.393 1.00 69.85 ? 541 TYR B CZ 1 ATOM 6182 O OH . TYR D 1 175 ? 61.117 7.324 101.596 1.00 74.25 ? 541 TYR B OH 1 ATOM 6183 N N . ARG D 1 176 ? 63.024 14.853 105.513 1.00 68.64 ? 542 ARG B N 1 ATOM 6184 C CA . ARG D 1 176 ? 63.527 15.867 106.431 1.00 72.70 ? 542 ARG B CA 1 ATOM 6185 C C . ARG D 1 176 ? 62.415 16.406 107.318 1.00 78.30 ? 542 ARG B C 1 ATOM 6186 O O . ARG D 1 176 ? 61.249 16.435 106.923 1.00 82.40 ? 542 ARG B O 1 ATOM 6187 C CB . ARG D 1 176 ? 64.185 17.015 105.661 1.00 74.21 ? 542 ARG B CB 1 ATOM 6188 C CG . ARG D 1 176 ? 63.264 17.716 104.677 1.00 76.67 ? 542 ARG B CG 1 ATOM 6189 C CD . ARG D 1 176 ? 64.000 18.812 103.925 1.00 80.64 ? 542 ARG B CD 1 ATOM 6190 N NE . ARG D 1 176 ? 63.170 19.417 102.889 1.00 81.30 ? 542 ARG B NE 1 ATOM 6191 C CZ . ARG D 1 176 ? 62.341 20.434 103.098 1.00 88.73 ? 542 ARG B CZ 1 ATOM 6192 N NH1 . ARG D 1 176 ? 62.228 20.961 104.308 1.00 92.86 ? 542 ARG B NH1 1 ATOM 6193 N NH2 . ARG D 1 176 ? 61.624 20.922 102.096 1.00 90.26 ? 542 ARG B NH2 1 ATOM 6194 N N . LYS D 1 177 ? 62.785 16.831 108.520 1.00 80.85 ? 543 LYS B N 1 ATOM 6195 C CA . LYS D 1 177 ? 61.820 17.372 109.466 1.00 85.20 ? 543 LYS B CA 1 ATOM 6196 C C . LYS D 1 177 ? 62.393 18.563 110.219 1.00 88.19 ? 543 LYS B C 1 ATOM 6197 O O . LYS D 1 177 ? 63.512 18.508 110.730 1.00 85.34 ? 543 LYS B O 1 ATOM 6198 C CB . LYS D 1 177 ? 61.381 16.292 110.455 1.00 85.50 ? 543 LYS B CB 1 ATOM 6199 C CG . LYS D 1 177 ? 60.378 16.762 111.494 1.00 89.24 ? 543 LYS B CG 1 ATOM 6200 C CD . LYS D 1 177 ? 60.000 15.631 112.436 1.00 86.75 ? 543 LYS B CD 1 ATOM 6201 C CE . LYS D 1 177 ? 58.979 16.082 113.467 1.00 90.23 ? 543 LYS B CE 1 ATOM 6202 N NZ . LYS D 1 177 ? 58.576 14.966 114.365 1.00 89.20 ? 543 LYS B NZ 1 ATOM 6203 N N . GLN D 1 178 ? 61.621 19.643 110.279 1.00 96.44 ? 544 GLN B N 1 ATOM 6204 C CA . GLN D 1 178 ? 62.007 20.806 111.064 1.00 98.98 ? 544 GLN B CA 1 ATOM 6205 C C . GLN D 1 178 ? 61.872 20.491 112.549 1.00 100.10 ? 544 GLN B C 1 ATOM 6206 O O . GLN D 1 178 ? 60.775 20.215 113.036 1.00 100.89 ? 544 GLN B O 1 ATOM 6207 C CB . GLN D 1 178 ? 61.150 22.018 110.696 1.00 107.09 ? 544 GLN B CB 1 ATOM 6208 C CG . GLN D 1 178 ? 61.454 23.267 111.512 1.00 114.64 ? 544 GLN B CG 1 ATOM 6209 C CD . GLN D 1 178 ? 62.827 23.836 111.215 1.00 114.32 ? 544 GLN B CD 1 ATOM 6210 O OE1 . GLN D 1 178 ? 63.352 23.675 110.115 1.00 111.07 ? 544 GLN B OE1 1 ATOM 6211 N NE2 . GLN D 1 178 ? 63.417 24.504 112.199 1.00 117.60 ? 544 GLN B NE2 1 ATOM 6212 N N . LEU D 1 179 ? 62.990 20.523 113.266 1.00 100.31 ? 545 LEU B N 1 ATOM 6213 C CA . LEU D 1 179 ? 62.975 20.250 114.698 1.00 95.28 ? 545 LEU B CA 1 ATOM 6214 C C . LEU D 1 179 ? 62.823 21.534 115.505 1.00 92.15 ? 545 LEU B C 1 ATOM 6215 O O . LEU D 1 179 ? 63.484 22.535 115.229 1.00 86.04 ? 545 LEU B O 1 ATOM 6216 C CB . LEU D 1 179 ? 64.248 19.514 115.120 1.00 75.93 ? 545 LEU B CB 1 ATOM 6217 C CG . LEU D 1 179 ? 64.481 18.139 114.493 1.00 71.15 ? 545 LEU B CG 1 ATOM 6218 C CD1 . LEU D 1 179 ? 65.655 17.441 115.160 1.00 69.70 ? 545 LEU B CD1 1 ATOM 6219 C CD2 . LEU D 1 179 ? 63.225 17.286 114.576 1.00 69.18 ? 545 LEU B CD2 1 ATOM 6220 N N . SER D 1 180 ? 61.944 21.496 116.499 1.00 91.41 ? 546 SER B N 1 ATOM 6221 C CA . SER D 1 180 ? 61.737 22.635 117.385 1.00 98.56 ? 546 SER B CA 1 ATOM 6222 C C . SER D 1 180 ? 63.005 22.912 118.186 1.00 103.00 ? 546 SER B C 1 ATOM 6223 O O . SER D 1 180 ? 63.798 22.000 118.422 1.00 100.96 ? 546 SER B O 1 ATOM 6224 C CB . SER D 1 180 ? 60.555 22.378 118.324 1.00 98.41 ? 546 SER B CB 1 ATOM 6225 O OG . SER D 1 180 ? 60.794 21.255 119.153 1.00 94.77 ? 546 SER B OG 1 ATOM 6226 N N . PRO D 1 181 ? 63.209 24.176 118.593 1.00 108.50 ? 547 PRO B N 1 ATOM 6227 C CA . PRO D 1 181 ? 64.364 24.552 119.417 1.00 112.00 ? 547 PRO B CA 1 ATOM 6228 C C . PRO D 1 181 ? 64.474 23.723 120.697 1.00 111.89 ? 547 PRO B C 1 ATOM 6229 O O . PRO D 1 181 ? 65.577 23.517 121.204 1.00 113.48 ? 547 PRO B O 1 ATOM 6230 C CB . PRO D 1 181 ? 64.094 26.023 119.742 1.00 119.19 ? 547 PRO B CB 1 ATOM 6231 C CG . PRO D 1 181 ? 63.288 26.509 118.589 1.00 118.28 ? 547 PRO B CG 1 ATOM 6232 C CD . PRO D 1 181 ? 62.412 25.351 118.197 1.00 112.23 ? 547 PRO B CD 1 ATOM 6233 N N . LEU D 1 182 ? 63.339 23.254 121.205 1.00 111.98 ? 548 LEU B N 1 ATOM 6234 C CA . LEU D 1 182 ? 63.319 22.405 122.390 1.00 112.86 ? 548 LEU B CA 1 ATOM 6235 C C . LEU D 1 182 ? 63.963 21.051 122.101 1.00 108.33 ? 548 LEU B C 1 ATOM 6236 O O . LEU D 1 182 ? 64.573 20.441 122.978 1.00 109.22 ? 548 LEU B O 1 ATOM 6237 C CB . LEU D 1 182 ? 61.884 22.215 122.885 1.00 112.52 ? 548 LEU B CB 1 ATOM 6238 C CG . LEU D 1 182 ? 61.701 21.391 124.160 1.00 113.55 ? 548 LEU B CG 1 ATOM 6239 C CD1 . LEU D 1 182 ? 62.418 22.048 125.330 1.00 120.85 ? 548 LEU B CD1 1 ATOM 6240 C CD2 . LEU D 1 182 ? 60.224 21.201 124.469 1.00 114.49 ? 548 LEU B CD2 1 ATOM 6241 N N . GLU D 1 183 ? 63.827 20.592 120.861 1.00 106.25 ? 549 GLU B N 1 ATOM 6242 C CA . GLU D 1 183 ? 64.403 19.320 120.441 1.00 106.28 ? 549 GLU B CA 1 ATOM 6243 C C . GLU D 1 183 ? 65.874 19.463 120.062 1.00 107.70 ? 549 GLU B C 1 ATOM 6244 O O . GLU D 1 183 ? 66.490 18.519 119.565 1.00 103.75 ? 549 GLU B O 1 ATOM 6245 C CB . GLU D 1 183 ? 63.620 18.742 119.258 1.00 104.81 ? 549 GLU B CB 1 ATOM 6246 C CG . GLU D 1 183 ? 62.192 18.333 119.583 1.00 106.17 ? 549 GLU B CG 1 ATOM 6247 C CD . GLU D 1 183 ? 61.422 17.894 118.351 1.00 103.79 ? 549 GLU B CD 1 ATOM 6248 O OE1 . GLU D 1 183 ? 61.683 18.443 117.260 1.00 103.72 ? 549 GLU B OE1 1 ATOM 6249 O OE2 . GLU D 1 183 ? 60.562 16.996 118.471 1.00 101.25 ? 549 GLU B OE2 1 ATOM 6250 N N . GLY D 1 184 ? 66.432 20.647 120.293 1.00 111.88 ? 550 GLY B N 1 ATOM 6251 C CA . GLY D 1 184 ? 67.821 20.907 119.963 1.00 111.81 ? 550 GLY B CA 1 ATOM 6252 C C . GLY D 1 184 ? 67.968 21.642 118.645 1.00 109.93 ? 550 GLY B C 1 ATOM 6253 O O . GLY D 1 184 ? 69.081 21.903 118.189 1.00 110.17 ? 550 GLY B O 1 ATOM 6254 N N . GLY D 1 185 ? 66.837 21.974 118.031 1.00 116.59 ? 551 GLY B N 1 ATOM 6255 C CA . GLY D 1 185 ? 66.834 22.694 116.772 1.00 88.60 ? 551 GLY B CA 1 ATOM 6256 C C . GLY D 1 185 ? 67.425 21.880 115.639 1.00 87.79 ? 551 GLY B C 1 ATOM 6257 O O . GLY D 1 185 ? 67.543 20.659 115.733 1.00 80.51 ? 551 GLY B O 1 ATOM 6258 N N . GLY D 1 186 ? 67.799 22.562 114.562 1.00 88.04 ? 552 GLY B N 1 ATOM 6259 C CA . GLY D 1 186 ? 68.372 21.901 113.406 1.00 86.89 ? 552 GLY B CA 1 ATOM 6260 C C . GLY D 1 186 ? 67.368 21.042 112.663 1.00 84.99 ? 552 GLY B C 1 ATOM 6261 O O . GLY D 1 186 ? 66.158 21.193 112.831 1.00 84.05 ? 552 GLY B O 1 ATOM 6262 N N . TRP D 1 187 ? 67.873 20.131 111.839 1.00 83.99 ? 553 TRP B N 1 ATOM 6263 C CA . TRP D 1 187 ? 67.017 19.276 111.028 1.00 79.83 ? 553 TRP B CA 1 ATOM 6264 C C . TRP D 1 187 ? 67.202 17.804 111.366 1.00 76.97 ? 553 TRP B C 1 ATOM 6265 O O . TRP D 1 187 ? 68.218 17.408 111.937 1.00 76.87 ? 553 TRP B O 1 ATOM 6266 C CB . TRP D 1 187 ? 67.295 19.496 109.539 1.00 78.05 ? 553 TRP B CB 1 ATOM 6267 C CG . TRP D 1 187 ? 66.923 20.856 109.040 1.00 82.06 ? 553 TRP B CG 1 ATOM 6268 C CD1 . TRP D 1 187 ? 67.662 21.999 109.143 1.00 84.72 ? 553 TRP B CD1 1 ATOM 6269 C CD2 . TRP D 1 187 ? 65.721 21.216 108.349 1.00 81.26 ? 553 TRP B CD2 1 ATOM 6270 N NE1 . TRP D 1 187 ? 66.993 23.048 108.563 1.00 87.44 ? 553 TRP B NE1 1 ATOM 6271 C CE2 . TRP D 1 187 ? 65.799 22.594 108.067 1.00 85.55 ? 553 TRP B CE2 1 ATOM 6272 C CE3 . TRP D 1 187 ? 64.587 20.507 107.942 1.00 77.32 ? 553 TRP B CE3 1 ATOM 6273 C CZ2 . TRP D 1 187 ? 64.786 23.277 107.397 1.00 88.95 ? 553 TRP B CZ2 1 ATOM 6274 C CZ3 . TRP D 1 187 ? 63.583 21.186 107.279 1.00 81.28 ? 553 TRP B CZ3 1 ATOM 6275 C CH2 . TRP D 1 187 ? 63.688 22.558 107.013 1.00 86.99 ? 553 TRP B CH2 1 ATOM 6276 N N . LEU D 1 188 ? 66.206 17.001 111.011 1.00 73.65 ? 554 LEU B N 1 ATOM 6277 C CA . LEU D 1 188 ? 66.311 15.553 111.104 1.00 69.30 ? 554 LEU B CA 1 ATOM 6278 C C . LEU D 1 188 ? 66.106 14.966 109.716 1.00 73.79 ? 554 LEU B C 1 ATOM 6279 O O . LEU D 1 188 ? 64.985 14.934 109.208 1.00 76.75 ? 554 LEU B O 1 ATOM 6280 C CB . LEU D 1 188 ? 65.287 14.987 112.087 1.00 68.53 ? 554 LEU B CB 1 ATOM 6281 C CG . LEU D 1 188 ? 65.286 13.467 112.273 1.00 64.61 ? 554 LEU B CG 1 ATOM 6282 C CD1 . LEU D 1 188 ? 66.626 12.991 112.812 1.00 63.94 ? 554 LEU B CD1 1 ATOM 6283 C CD2 . LEU D 1 188 ? 64.153 13.037 113.190 1.00 60.65 ? 554 LEU B CD2 1 ATOM 6284 N N . VAL D 1 189 ? 67.192 14.515 109.099 1.00 75.91 ? 555 VAL B N 1 ATOM 6285 C CA . VAL D 1 189 ? 67.134 14.025 107.728 1.00 72.96 ? 555 VAL B CA 1 ATOM 6286 C C . VAL D 1 189 ? 67.379 12.521 107.651 1.00 67.50 ? 555 VAL B C 1 ATOM 6287 O O . VAL D 1 189 ? 67.984 11.932 108.548 1.00 64.61 ? 555 VAL B O 1 ATOM 6288 C CB . VAL D 1 189 ? 68.158 14.749 106.834 1.00 72.28 ? 555 VAL B CB 1 ATOM 6289 C CG1 . VAL D 1 189 ? 67.874 16.241 106.810 1.00 75.52 ? 555 VAL B CG1 1 ATOM 6290 C CG2 . VAL D 1 189 ? 69.573 14.481 107.323 1.00 70.79 ? 555 VAL B CG2 1 ATOM 6291 N N . ALA D 1 190 ? 66.900 11.908 106.572 1.00 65.71 ? 556 ALA B N 1 ATOM 6292 C CA . ALA D 1 190 ? 67.089 10.479 106.351 1.00 61.78 ? 556 ALA B CA 1 ATOM 6293 C C . ALA D 1 190 ? 66.940 10.111 104.878 1.00 63.30 ? 556 ALA B C 1 ATOM 6294 O O . ALA D 1 190 ? 66.387 10.874 104.087 1.00 65.03 ? 556 ALA B O 1 ATOM 6295 C CB . ALA D 1 190 ? 66.108 9.678 107.192 1.00 56.66 ? 556 ALA B CB 1 ATOM 6296 N N . SER D 1 191 ? 67.441 8.933 104.520 1.00 59.83 ? 557 SER B N 1 ATOM 6297 C CA . SER D 1 191 ? 67.318 8.424 103.159 1.00 59.47 ? 557 SER B CA 1 ATOM 6298 C C . SER D 1 191 ? 66.788 6.995 103.163 1.00 56.84 ? 557 SER B C 1 ATOM 6299 O O . SER D 1 191 ? 67.207 6.173 103.974 1.00 54.89 ? 557 SER B O 1 ATOM 6300 C CB . SER D 1 191 ? 68.662 8.481 102.435 1.00 60.35 ? 557 SER B CB 1 ATOM 6301 O OG . SER D 1 191 ? 68.568 7.889 101.151 1.00 62.24 ? 557 SER B OG 1 ATOM 6302 N N . GLY D 1 192 ? 65.869 6.703 102.250 1.00 60.20 ? 558 GLY B N 1 ATOM 6303 C CA . GLY D 1 192 ? 65.265 5.386 102.177 1.00 58.34 ? 558 GLY B CA 1 ATOM 6304 C C . GLY D 1 192 ? 65.764 4.566 101.004 1.00 57.41 ? 558 GLY B C 1 ATOM 6305 O O . GLY D 1 192 ? 66.047 5.101 99.935 1.00 60.38 ? 558 GLY B O 1 ATOM 6306 N N . SER D 1 193 ? 65.872 3.258 101.209 1.00 53.38 ? 559 SER B N 1 ATOM 6307 C CA . SER D 1 193 ? 66.289 2.349 100.149 1.00 56.82 ? 559 SER B CA 1 ATOM 6308 C C . SER D 1 193 ? 65.303 1.200 100.007 1.00 57.10 ? 559 SER B C 1 ATOM 6309 O O . SER D 1 193 ? 64.706 0.756 100.986 1.00 57.43 ? 559 SER B O 1 ATOM 6310 C CB . SER D 1 193 ? 67.694 1.808 100.420 1.00 58.60 ? 559 SER B CB 1 ATOM 6311 O OG . SER D 1 193 ? 68.647 2.855 100.483 1.00 62.43 ? 559 SER B OG 1 ATOM 6312 N N . THR D 1 194 ? 65.137 0.722 98.779 1.00 61.39 ? 560 THR B N 1 ATOM 6313 C CA . THR D 1 194 ? 64.198 -0.355 98.502 1.00 61.22 ? 560 THR B CA 1 ATOM 6314 C C . THR D 1 194 ? 64.898 -1.585 97.941 1.00 62.01 ? 560 THR B C 1 ATOM 6315 O O . THR D 1 194 ? 65.921 -1.481 97.265 1.00 66.68 ? 560 THR B O 1 ATOM 6316 C CB . THR D 1 194 ? 63.107 0.086 97.507 1.00 67.56 ? 560 THR B CB 1 ATOM 6317 O OG1 . THR D 1 194 ? 63.692 0.314 96.219 1.00 72.20 ? 560 THR B OG1 1 ATOM 6318 C CG2 . THR D 1 194 ? 62.432 1.357 97.984 1.00 72.35 ? 560 THR B CG2 1 ATOM 6319 N N . VAL D 1 195 ? 64.337 -2.751 98.241 1.00 60.47 ? 561 VAL B N 1 ATOM 6320 C CA . VAL D 1 195 ? 64.776 -4.009 97.652 1.00 59.71 ? 561 VAL B CA 1 ATOM 6321 C C . VAL D 1 195 ? 63.555 -4.734 97.096 1.00 62.28 ? 561 VAL B C 1 ATOM 6322 O O . VAL D 1 195 ? 62.541 -4.857 97.781 1.00 62.07 ? 561 VAL B O 1 ATOM 6323 C CB . VAL D 1 195 ? 65.504 -4.907 98.677 1.00 53.85 ? 561 VAL B CB 1 ATOM 6324 C CG1 . VAL D 1 195 ? 65.830 -6.260 98.064 1.00 54.91 ? 561 VAL B CG1 1 ATOM 6325 C CG2 . VAL D 1 195 ? 66.766 -4.227 99.183 1.00 47.93 ? 561 VAL B CG2 1 ATOM 6326 N N . ALA D 1 196 ? 63.656 -5.196 95.852 1.00 61.43 ? 562 ALA B N 1 ATOM 6327 C CA . ALA D 1 196 ? 62.542 -5.844 95.163 1.00 60.28 ? 562 ALA B CA 1 ATOM 6328 C C . ALA D 1 196 ? 61.944 -6.998 95.967 1.00 66.12 ? 562 ALA B C 1 ATOM 6329 O O . ALA D 1 196 ? 62.661 -7.738 96.639 1.00 61.05 ? 562 ALA B O 1 ATOM 6330 C CB . ALA D 1 196 ? 62.991 -6.339 93.798 1.00 64.42 ? 562 ALA B CB 1 ATOM 6331 N N . MET D 1 197 ? 60.624 -7.141 95.895 1.00 69.91 ? 563 MET B N 1 ATOM 6332 C CA . MET D 1 197 ? 59.928 -8.201 96.616 1.00 66.25 ? 563 MET B CA 1 ATOM 6333 C C . MET D 1 197 ? 60.194 -9.565 95.982 1.00 65.73 ? 563 MET B C 1 ATOM 6334 O O . MET D 1 197 ? 60.138 -9.718 94.761 1.00 68.57 ? 563 MET B O 1 ATOM 6335 C CB . MET D 1 197 ? 58.423 -7.920 96.661 1.00 67.74 ? 563 MET B CB 1 ATOM 6336 C CG . MET D 1 197 ? 57.604 -8.975 97.395 1.00 65.47 ? 563 MET B CG 1 ATOM 6337 S SD . MET D 1 197 ? 58.141 -9.262 99.093 1.00 70.09 ? 563 MET B SD 1 ATOM 6338 C CE . MET D 1 197 ? 57.888 -7.646 99.821 1.00 67.59 ? 563 MET B CE 1 ATOM 6339 N N . THR D 1 198 ? 60.488 -10.550 96.823 1.00 61.64 ? 564 THR B N 1 ATOM 6340 C CA . THR D 1 198 ? 60.763 -11.906 96.366 1.00 62.80 ? 564 THR B CA 1 ATOM 6341 C C . THR D 1 198 ? 59.467 -12.672 96.118 1.00 68.08 ? 564 THR B C 1 ATOM 6342 O O . THR D 1 198 ? 58.396 -12.219 96.510 1.00 71.77 ? 564 THR B O 1 ATOM 6343 C CB . THR D 1 198 ? 61.620 -12.665 97.386 1.00 56.30 ? 564 THR B CB 1 ATOM 6344 O OG1 . THR D 1 198 ? 61.007 -12.575 98.679 1.00 53.07 ? 564 THR B OG1 1 ATOM 6345 C CG2 . THR D 1 198 ? 63.010 -12.057 97.455 1.00 54.52 ? 564 THR B CG2 1 ATOM 6346 N N . GLU D 1 199 ? 59.565 -13.825 95.462 1.00 71.14 ? 565 GLU B N 1 ATOM 6347 C CA . GLU D 1 199 ? 58.385 -14.634 95.156 1.00 76.64 ? 565 GLU B CA 1 ATOM 6348 C C . GLU D 1 199 ? 57.719 -15.123 96.437 1.00 71.96 ? 565 GLU B C 1 ATOM 6349 O O . GLU D 1 199 ? 56.493 -15.152 96.542 1.00 70.43 ? 565 GLU B O 1 ATOM 6350 C CB . GLU D 1 199 ? 58.751 -15.824 94.264 1.00 85.31 ? 565 GLU B CB 1 ATOM 6351 C CG . GLU D 1 199 ? 57.578 -16.748 93.968 1.00 94.71 ? 565 GLU B CG 1 ATOM 6352 C CD . GLU D 1 199 ? 57.955 -17.916 93.078 1.00 105.44 ? 565 GLU B CD 1 ATOM 6353 O OE1 . GLU D 1 199 ? 57.296 -18.975 93.171 1.00 107.65 ? 565 GLU B OE1 1 ATOM 6354 O OE2 . GLU D 1 199 ? 58.907 -17.776 92.282 1.00 111.73 ? 565 GLU B OE2 1 ATOM 6355 N N . GLN D 1 200 ? 58.536 -15.507 97.409 1.00 70.32 ? 566 GLN B N 1 ATOM 6356 C CA . GLN D 1 200 ? 58.040 -15.844 98.735 1.00 65.80 ? 566 GLN B CA 1 ATOM 6357 C C . GLN D 1 200 ? 58.517 -14.801 99.734 1.00 63.91 ? 566 GLN B C 1 ATOM 6358 O O . GLN D 1 200 ? 59.682 -14.404 99.713 1.00 62.05 ? 566 GLN B O 1 ATOM 6359 C CB . GLN D 1 200 ? 58.507 -17.236 99.156 1.00 62.56 ? 566 GLN B CB 1 ATOM 6360 C CG . GLN D 1 200 ? 57.839 -18.375 98.413 1.00 66.55 ? 566 GLN B CG 1 ATOM 6361 C CD . GLN D 1 200 ? 58.424 -19.722 98.787 1.00 70.19 ? 566 GLN B CD 1 ATOM 6362 O OE1 . GLN D 1 200 ? 59.585 -19.817 99.183 1.00 72.46 ? 566 GLN B OE1 1 ATOM 6363 N NE2 . GLN D 1 200 ? 57.620 -20.771 98.669 1.00 75.27 ? 566 GLN B NE2 1 ATOM 6364 N N . LEU D 1 201 ? 57.616 -14.355 100.604 1.00 62.52 ? 567 LEU B N 1 ATOM 6365 C CA . LEU D 1 201 ? 57.960 -13.351 101.603 1.00 53.69 ? 567 LEU B CA 1 ATOM 6366 C C . LEU D 1 201 ? 59.009 -13.881 102.575 1.00 55.32 ? 567 LEU B C 1 ATOM 6367 O O . LEU D 1 201 ? 58.878 -14.983 103.112 1.00 56.04 ? 567 LEU B O 1 ATOM 6368 C CB . LEU D 1 201 ? 56.716 -12.896 102.370 1.00 51.93 ? 567 LEU B CB 1 ATOM 6369 C CG . LEU D 1 201 ? 56.946 -11.866 103.480 1.00 49.92 ? 567 LEU B CG 1 ATOM 6370 C CD1 . LEU D 1 201 ? 57.641 -10.626 102.938 1.00 45.83 ? 567 LEU B CD1 1 ATOM 6371 C CD2 . LEU D 1 201 ? 55.632 -11.495 104.153 1.00 52.80 ? 567 LEU B CD2 1 ATOM 6372 N N . GLN D 1 202 ? 60.052 -13.087 102.785 1.00 52.00 ? 568 GLN B N 1 ATOM 6373 C CA . GLN D 1 202 ? 61.127 -13.446 103.696 1.00 48.37 ? 568 GLN B CA 1 ATOM 6374 C C . GLN D 1 202 ? 61.107 -12.515 104.901 1.00 49.89 ? 568 GLN B C 1 ATOM 6375 O O . GLN D 1 202 ? 60.913 -11.306 104.759 1.00 52.20 ? 568 GLN B O 1 ATOM 6376 C CB . GLN D 1 202 ? 62.476 -13.385 102.980 1.00 45.16 ? 568 GLN B CB 1 ATOM 6377 C CG . GLN D 1 202 ? 62.581 -14.337 101.803 1.00 51.63 ? 568 GLN B CG 1 ATOM 6378 C CD . GLN D 1 202 ? 63.728 -13.997 100.875 1.00 55.16 ? 568 GLN B CD 1 ATOM 6379 O OE1 . GLN D 1 202 ? 64.354 -12.945 101.002 1.00 59.94 ? 568 GLN B OE1 1 ATOM 6380 N NE2 . GLN D 1 202 ? 64.009 -14.889 99.931 1.00 54.47 ? 568 GLN B NE2 1 ATOM 6381 N N . MET D 1 203 ? 61.302 -13.079 106.088 1.00 45.11 ? 569 MET B N 1 ATOM 6382 C CA . MET D 1 203 ? 61.176 -12.310 107.318 1.00 44.44 ? 569 MET B CA 1 ATOM 6383 C C . MET D 1 203 ? 62.378 -12.469 108.239 1.00 45.69 ? 569 MET B C 1 ATOM 6384 O O . MET D 1 203 ? 63.177 -13.396 108.091 1.00 48.21 ? 569 MET B O 1 ATOM 6385 C CB . MET D 1 203 ? 59.907 -12.719 108.066 1.00 46.48 ? 569 MET B CB 1 ATOM 6386 C CG . MET D 1 203 ? 58.626 -12.495 107.279 1.00 51.11 ? 569 MET B CG 1 ATOM 6387 S SD . MET D 1 203 ? 57.168 -13.091 108.152 1.00 52.11 ? 569 MET B SD 1 ATOM 6388 C CE . MET D 1 203 ? 57.143 -11.982 109.557 1.00 45.19 ? 569 MET B CE 1 ATOM 6389 N N . GLY D 1 204 ? 62.497 -11.552 109.191 1.00 42.21 ? 570 GLY B N 1 ATOM 6390 C CA . GLY D 1 204 ? 63.521 -11.639 110.212 1.00 38.00 ? 570 GLY B CA 1 ATOM 6391 C C . GLY D 1 204 ? 62.891 -11.710 111.588 1.00 38.40 ? 570 GLY B C 1 ATOM 6392 O O . GLY D 1 204 ? 62.012 -10.915 111.915 1.00 37.07 ? 570 GLY B O 1 ATOM 6393 N N . PHE D 1 205 ? 63.333 -12.671 112.393 1.00 41.85 ? 571 PHE B N 1 ATOM 6394 C CA . PHE D 1 205 ? 62.831 -12.815 113.756 1.00 43.41 ? 571 PHE B CA 1 ATOM 6395 C C . PHE D 1 205 ? 63.915 -12.522 114.786 1.00 43.73 ? 571 PHE B C 1 ATOM 6396 O O . PHE D 1 205 ? 64.917 -13.233 114.864 1.00 43.43 ? 571 PHE B O 1 ATOM 6397 C CB . PHE D 1 205 ? 62.274 -14.222 113.981 1.00 48.94 ? 571 PHE B CB 1 ATOM 6398 C CG . PHE D 1 205 ? 61.128 -14.575 113.078 1.00 56.51 ? 571 PHE B CG 1 ATOM 6399 C CD1 . PHE D 1 205 ? 60.270 -13.597 112.608 1.00 59.08 ? 571 PHE B CD1 1 ATOM 6400 C CD2 . PHE D 1 205 ? 60.911 -15.889 112.699 1.00 59.80 ? 571 PHE B CD2 1 ATOM 6401 C CE1 . PHE D 1 205 ? 59.216 -13.923 111.775 1.00 61.72 ? 571 PHE B CE1 1 ATOM 6402 C CE2 . PHE D 1 205 ? 59.858 -16.222 111.867 1.00 62.05 ? 571 PHE B CE2 1 ATOM 6403 C CZ . PHE D 1 205 ? 59.010 -15.237 111.405 1.00 61.20 ? 571 PHE B CZ 1 ATOM 6404 N N . GLY D 1 206 ? 63.707 -11.471 115.575 1.00 46.30 ? 572 GLY B N 1 ATOM 6405 C CA . GLY D 1 206 ? 64.623 -11.122 116.647 1.00 40.05 ? 572 GLY B CA 1 ATOM 6406 C C . GLY D 1 206 ? 64.098 -11.540 118.010 1.00 37.78 ? 572 GLY B C 1 ATOM 6407 O O . GLY D 1 206 ? 63.002 -11.149 118.409 1.00 38.37 ? 572 GLY B O 1 ATOM 6408 N N . ILE D 1 207 ? 64.884 -12.341 118.724 1.00 38.34 ? 573 ILE B N 1 ATOM 6409 C CA . ILE D 1 207 ? 64.508 -12.812 120.054 1.00 37.42 ? 573 ILE B CA 1 ATOM 6410 C C . ILE D 1 207 ? 65.473 -12.300 121.120 1.00 38.85 ? 573 ILE B C 1 ATOM 6411 O O . ILE D 1 207 ? 66.688 -12.348 120.938 1.00 41.40 ? 573 ILE B O 1 ATOM 6412 C CB . ILE D 1 207 ? 64.477 -14.349 120.119 1.00 40.67 ? 573 ILE B CB 1 ATOM 6413 C CG1 . ILE D 1 207 ? 63.652 -14.923 118.967 1.00 41.71 ? 573 ILE B CG1 1 ATOM 6414 C CG2 . ILE D 1 207 ? 63.925 -14.819 121.457 1.00 45.95 ? 573 ILE B CG2 1 ATOM 6415 C CD1 . ILE D 1 207 ? 63.556 -16.432 118.987 1.00 45.55 ? 573 ILE B CD1 1 ATOM 6416 N N . THR D 1 208 ? 64.928 -11.810 122.229 1.00 36.56 ? 574 THR B N 1 ATOM 6417 C CA . THR D 1 208 ? 65.741 -11.351 123.349 1.00 36.87 ? 574 THR B CA 1 ATOM 6418 C C . THR D 1 208 ? 65.111 -11.792 124.667 1.00 43.62 ? 574 THR B C 1 ATOM 6419 O O . THR D 1 208 ? 63.936 -11.518 124.919 1.00 53.91 ? 574 THR B O 1 ATOM 6420 C CB . THR D 1 208 ? 65.905 -9.821 123.339 1.00 36.09 ? 574 THR B CB 1 ATOM 6421 O OG1 . THR D 1 208 ? 66.497 -9.412 122.099 1.00 39.47 ? 574 THR B OG1 1 ATOM 6422 C CG2 . THR D 1 208 ? 66.784 -9.365 124.494 1.00 36.77 ? 574 THR B CG2 1 ATOM 6423 N N . VAL D 1 209 ? 65.882 -12.482 125.503 1.00 36.17 ? 575 VAL B N 1 ATOM 6424 C CA . VAL D 1 209 ? 65.350 -12.981 126.766 1.00 39.91 ? 575 VAL B CA 1 ATOM 6425 C C . VAL D 1 209 ? 65.964 -12.288 127.977 1.00 47.52 ? 575 VAL B C 1 ATOM 6426 O O . VAL D 1 209 ? 67.111 -11.838 127.943 1.00 51.12 ? 575 VAL B O 1 ATOM 6427 C CB . VAL D 1 209 ? 65.561 -14.501 126.911 1.00 38.66 ? 575 VAL B CB 1 ATOM 6428 C CG1 . VAL D 1 209 ? 64.676 -15.252 125.935 1.00 34.31 ? 575 VAL B CG1 1 ATOM 6429 C CG2 . VAL D 1 209 ? 67.026 -14.859 126.708 1.00 39.27 ? 575 VAL B CG2 1 ATOM 6430 N N . GLN D 1 210 ? 65.179 -12.208 129.046 1.00 47.11 ? 576 GLN B N 1 ATOM 6431 C CA . GLN D 1 210 ? 65.634 -11.649 130.308 1.00 40.03 ? 576 GLN B CA 1 ATOM 6432 C C . GLN D 1 210 ? 65.463 -12.683 131.415 1.00 41.37 ? 576 GLN B C 1 ATOM 6433 O O . GLN D 1 210 ? 64.343 -13.037 131.780 1.00 47.86 ? 576 GLN B O 1 ATOM 6434 C CB . GLN D 1 210 ? 64.865 -10.366 130.639 1.00 40.26 ? 576 GLN B CB 1 ATOM 6435 C CG . GLN D 1 210 ? 65.067 -9.852 132.059 1.00 43.90 ? 576 GLN B CG 1 ATOM 6436 C CD . GLN D 1 210 ? 66.477 -9.357 132.317 1.00 49.83 ? 576 GLN B CD 1 ATOM 6437 O OE1 . GLN D 1 210 ? 67.057 -8.642 131.499 1.00 55.48 ? 576 GLN B OE1 1 ATOM 6438 N NE2 . GLN D 1 210 ? 67.036 -9.738 133.458 1.00 50.54 ? 576 GLN B NE2 1 ATOM 6439 N N . TYR D 1 211 ? 66.578 -13.182 131.934 1.00 43.05 ? 577 TYR B N 1 ATOM 6440 C CA . TYR D 1 211 ? 66.540 -14.129 133.040 1.00 45.28 ? 577 TYR B CA 1 ATOM 6441 C C . TYR D 1 211 ? 66.311 -13.392 134.352 1.00 46.37 ? 577 TYR B C 1 ATOM 6442 O O . TYR D 1 211 ? 66.868 -12.319 134.578 1.00 45.12 ? 577 TYR B O 1 ATOM 6443 C CB . TYR D 1 211 ? 67.835 -14.945 133.113 1.00 48.20 ? 577 TYR B CB 1 ATOM 6444 C CG . TYR D 1 211 ? 67.912 -16.098 132.133 1.00 45.46 ? 577 TYR B CG 1 ATOM 6445 C CD1 . TYR D 1 211 ? 67.394 -17.346 132.457 1.00 40.99 ? 577 TYR B CD1 1 ATOM 6446 C CD2 . TYR D 1 211 ? 68.518 -15.944 130.894 1.00 48.06 ? 577 TYR B CD2 1 ATOM 6447 C CE1 . TYR D 1 211 ? 67.471 -18.404 131.574 1.00 43.51 ? 577 TYR B CE1 1 ATOM 6448 C CE2 . TYR D 1 211 ? 68.600 -16.999 130.001 1.00 48.72 ? 577 TYR B CE2 1 ATOM 6449 C CZ . TYR D 1 211 ? 68.076 -18.227 130.347 1.00 46.97 ? 577 TYR B CZ 1 ATOM 6450 O OH . TYR D 1 211 ? 68.154 -19.279 129.461 1.00 44.68 ? 577 TYR B OH 1 ATOM 6451 N N . GLY D 1 212 ? 65.481 -13.970 135.212 1.00 50.74 ? 578 GLY B N 1 ATOM 6452 C CA . GLY D 1 212 ? 65.218 -13.393 136.515 1.00 53.45 ? 578 GLY B CA 1 ATOM 6453 C C . GLY D 1 212 ? 66.031 -14.071 137.599 1.00 58.42 ? 578 GLY B C 1 ATOM 6454 O O . GLY D 1 212 ? 66.615 -15.130 137.378 1.00 59.70 ? 578 GLY B O 1 ATOM 6455 N N . THR D 1 213 ? 66.071 -13.459 138.775 1.00 65.90 ? 579 THR B N 1 ATOM 6456 C CA . THR D 1 213 ? 66.810 -14.023 139.896 1.00 76.73 ? 579 THR B CA 1 ATOM 6457 C C . THR D 1 213 ? 65.962 -15.031 140.662 1.00 86.94 ? 579 THR B C 1 ATOM 6458 O O . THR D 1 213 ? 66.468 -16.050 141.134 1.00 91.41 ? 579 THR B O 1 ATOM 6459 C CB . THR D 1 213 ? 67.287 -12.928 140.865 1.00 79.93 ? 579 THR B CB 1 ATOM 6460 O OG1 . THR D 1 213 ? 66.153 -12.212 141.372 1.00 83.19 ? 579 THR B OG1 1 ATOM 6461 C CG2 . THR D 1 213 ? 68.222 -11.958 140.156 1.00 78.05 ? 579 THR B CG2 1 ATOM 6462 N N . ASP D 1 214 ? 64.670 -14.741 140.781 1.00 94.35 ? 580 ASP B N 1 ATOM 6463 C CA . ASP D 1 214 ? 63.764 -15.591 141.544 1.00 100.35 ? 580 ASP B CA 1 ATOM 6464 C C . ASP D 1 214 ? 62.542 -16.003 140.730 1.00 99.50 ? 580 ASP B C 1 ATOM 6465 O O . ASP D 1 214 ? 61.956 -17.059 140.968 1.00 101.04 ? 580 ASP B O 1 ATOM 6466 C CB . ASP D 1 214 ? 63.313 -14.877 142.820 1.00 107.35 ? 580 ASP B CB 1 ATOM 6467 C CG . ASP D 1 214 ? 64.477 -14.413 143.672 1.00 110.98 ? 580 ASP B CG 1 ATOM 6468 O OD1 . ASP D 1 214 ? 65.493 -15.137 143.740 1.00 112.47 ? 580 ASP B OD1 1 ATOM 6469 O OD2 . ASP D 1 214 ? 64.375 -13.322 144.273 1.00 111.36 ? 580 ASP B OD2 1 ATOM 6470 N N . THR D 1 215 ? 62.160 -15.167 139.769 1.00 95.65 ? 581 THR B N 1 ATOM 6471 C CA . THR D 1 215 ? 60.938 -15.404 139.008 1.00 96.40 ? 581 THR B CA 1 ATOM 6472 C C . THR D 1 215 ? 61.183 -15.535 137.508 1.00 85.44 ? 581 THR B C 1 ATOM 6473 O O . THR D 1 215 ? 61.549 -14.570 136.838 1.00 83.98 ? 581 THR B O 1 ATOM 6474 C CB . THR D 1 215 ? 59.912 -14.280 139.243 1.00 103.31 ? 581 THR B CB 1 ATOM 6475 O OG1 . THR D 1 215 ? 60.503 -13.015 138.919 1.00 107.60 ? 581 THR B OG1 1 ATOM 6476 C CG2 . THR D 1 215 ? 59.464 -14.268 140.696 1.00 105.33 ? 581 THR B CG2 1 ATOM 6477 N N . ASN D 1 216 ? 60.970 -16.740 136.991 1.00 75.62 ? 582 ASN B N 1 ATOM 6478 C CA . ASN D 1 216 ? 61.050 -16.993 135.559 1.00 65.22 ? 582 ASN B CA 1 ATOM 6479 C C . ASN D 1 216 ? 59.798 -17.720 135.081 1.00 66.30 ? 582 ASN B C 1 ATOM 6480 O O . ASN D 1 216 ? 59.778 -18.947 134.992 1.00 69.08 ? 582 ASN B O 1 ATOM 6481 C CB . ASN D 1 216 ? 62.300 -17.805 135.220 1.00 57.12 ? 582 ASN B CB 1 ATOM 6482 C CG . ASN D 1 216 ? 63.585 -17.072 135.562 1.00 49.95 ? 582 ASN B CG 1 ATOM 6483 O OD1 . ASN D 1 216 ? 64.065 -16.243 134.789 1.00 45.99 ? 582 ASN B OD1 1 ATOM 6484 N ND2 . ASN D 1 216 ? 64.153 -17.381 136.722 1.00 46.25 ? 582 ASN B ND2 1 ATOM 6485 N N . SER D 1 217 ? 58.754 -16.955 134.777 1.00 64.35 ? 583 SER B N 1 ATOM 6486 C CA . SER D 1 217 ? 57.443 -17.526 134.486 1.00 65.64 ? 583 SER B CA 1 ATOM 6487 C C . SER D 1 217 ? 57.242 -17.862 133.011 1.00 65.20 ? 583 SER B C 1 ATOM 6488 O O . SER D 1 217 ? 56.238 -18.478 132.646 1.00 69.47 ? 583 SER B O 1 ATOM 6489 C CB . SER D 1 217 ? 56.340 -16.569 134.941 1.00 70.86 ? 583 SER B CB 1 ATOM 6490 O OG . SER D 1 217 ? 56.430 -16.309 136.329 1.00 82.07 ? 583 SER B OG 1 ATOM 6491 N N . VAL D 1 218 ? 58.180 -17.455 132.163 1.00 57.54 ? 584 VAL B N 1 ATOM 6492 C CA . VAL D 1 218 ? 58.065 -17.746 130.740 1.00 58.21 ? 584 VAL B CA 1 ATOM 6493 C C . VAL D 1 218 ? 58.807 -19.036 130.411 1.00 54.80 ? 584 VAL B C 1 ATOM 6494 O O . VAL D 1 218 ? 59.952 -19.014 129.966 1.00 54.08 ? 584 VAL B O 1 ATOM 6495 C CB . VAL D 1 218 ? 58.604 -16.596 129.873 1.00 54.95 ? 584 VAL B CB 1 ATOM 6496 C CG1 . VAL D 1 218 ? 58.214 -16.807 128.416 1.00 41.48 ? 584 VAL B CG1 1 ATOM 6497 C CG2 . VAL D 1 218 ? 58.068 -15.265 130.373 1.00 46.74 ? 584 VAL B CG2 1 ATOM 6498 N N . CYS D 1 219 ? 58.137 -20.160 130.639 1.00 54.55 ? 585 CYS B N 1 ATOM 6499 C CA . CYS D 1 219 ? 58.738 -21.474 130.454 1.00 54.50 ? 585 CYS B CA 1 ATOM 6500 C C . CYS D 1 219 ? 58.162 -22.161 129.220 1.00 54.36 ? 585 CYS B C 1 ATOM 6501 O O . CYS D 1 219 ? 57.061 -21.833 128.792 1.00 54.83 ? 585 CYS B O 1 ATOM 6502 C CB . CYS D 1 219 ? 58.514 -22.331 131.701 1.00 54.07 ? 585 CYS B CB 1 ATOM 6503 S SG . CYS D 1 219 ? 59.201 -21.618 133.209 1.00 67.01 ? 585 CYS B SG 1 ATOM 6504 N N . PRO D 1 220 ? 58.910 -23.111 128.636 1.00 53.34 ? 586 PRO B N 1 ATOM 6505 C CA . PRO D 1 220 ? 58.391 -23.820 127.461 1.00 48.06 ? 586 PRO B CA 1 ATOM 6506 C C . PRO D 1 220 ? 57.162 -24.664 127.787 1.00 51.31 ? 586 PRO B C 1 ATOM 6507 O O . PRO D 1 220 ? 56.999 -25.112 128.922 1.00 50.92 ? 586 PRO B O 1 ATOM 6508 C CB . PRO D 1 220 ? 59.567 -24.704 127.033 1.00 41.39 ? 586 PRO B CB 1 ATOM 6509 C CG . PRO D 1 220 ? 60.409 -24.839 128.252 1.00 47.56 ? 586 PRO B CG 1 ATOM 6510 C CD . PRO D 1 220 ? 60.280 -23.536 128.973 1.00 51.53 ? 586 PRO B CD 1 ATOM 6511 N N . LYS D 1 221 ? 56.306 -24.864 126.791 1.00 55.43 ? 587 LYS B N 1 ATOM 6512 C CA . LYS D 1 221 ? 55.088 -25.645 126.960 1.00 59.82 ? 587 LYS B CA 1 ATOM 6513 C C . LYS D 1 221 ? 55.357 -27.132 126.759 1.00 60.52 ? 587 LYS B C 1 ATOM 6514 O O . LYS D 1 221 ? 55.857 -27.542 125.713 1.00 57.83 ? 587 LYS B O 1 ATOM 6515 C CB . LYS D 1 221 ? 54.015 -25.165 125.981 1.00 65.48 ? 587 LYS B CB 1 ATOM 6516 C CG . LYS D 1 221 ? 52.697 -25.916 126.074 1.00 74.86 ? 587 LYS B CG 1 ATOM 6517 C CD . LYS D 1 221 ? 51.745 -25.480 124.972 1.00 76.51 ? 587 LYS B CD 1 ATOM 6518 C CE . LYS D 1 221 ? 50.421 -26.216 125.059 1.00 81.39 ? 587 LYS B CE 1 ATOM 6519 N NZ . LYS D 1 221 ? 49.532 -25.873 123.915 1.00 83.72 ? 587 LYS B NZ 1 ATOM 6520 N N . LEU D 1 222 ? 55.023 -27.935 127.766 1.00 61.39 ? 588 LEU B N 1 ATOM 6521 C CA . LEU D 1 222 ? 55.250 -29.376 127.704 1.00 67.14 ? 588 LEU B CA 1 ATOM 6522 C C . LEU D 1 222 ? 53.962 -30.143 127.424 1.00 79.71 ? 588 LEU B C 1 ATOM 6523 O O . LEU D 1 222 ? 52.864 -29.661 127.701 1.00 82.24 ? 588 LEU B O 1 ATOM 6524 C CB . LEU D 1 222 ? 55.876 -29.885 129.006 1.00 67.74 ? 588 LEU B CB 1 ATOM 6525 C CG . LEU D 1 222 ? 57.345 -29.566 129.305 1.00 64.49 ? 588 LEU B CG 1 ATOM 6526 C CD1 . LEU D 1 222 ? 58.202 -29.757 128.061 1.00 62.59 ? 588 LEU B CD1 1 ATOM 6527 C CD2 . LEU D 1 222 ? 57.510 -28.162 129.859 1.00 62.82 ? 588 LEU B CD2 1 ATOM 6528 N N . GLU D 1 223 ? 54.107 -31.345 126.875 1.00 88.88 ? 589 GLU B N 1 ATOM 6529 C CA . GLU D 1 223 ? 52.966 -32.208 126.601 1.00 98.98 ? 589 GLU B CA 1 ATOM 6530 C C . GLU D 1 223 ? 52.808 -33.256 127.694 1.00 107.46 ? 589 GLU B C 1 ATOM 6531 O O . GLU D 1 223 ? 53.666 -33.387 128.568 1.00 110.66 ? 589 GLU B O 1 ATOM 6532 C CB . GLU D 1 223 ? 53.116 -32.881 125.236 1.00 101.59 ? 589 GLU B CB 1 ATOM 6533 C CG . GLU D 1 223 ? 52.907 -31.936 124.068 1.00 100.65 ? 589 GLU B CG 1 ATOM 6534 C CD . GLU D 1 223 ? 53.185 -32.583 122.729 1.00 99.80 ? 589 GLU B CD 1 ATOM 6535 O OE1 . GLU D 1 223 ? 52.284 -32.566 121.864 1.00 100.63 ? 589 GLU B OE1 1 ATOM 6536 O OE2 . GLU D 1 223 ? 54.306 -33.098 122.536 1.00 99.53 ? 589 GLU B OE2 1 ATOM 6537 N N . PHE D 1 224 ? 51.706 -33.996 127.646 1.00 113.13 ? 590 PHE B N 1 ATOM 6538 C CA . PHE D 1 224 ? 51.443 -35.032 128.637 1.00 122.61 ? 590 PHE B CA 1 ATOM 6539 C C . PHE D 1 224 ? 50.994 -36.323 127.963 1.00 126.81 ? 590 PHE B C 1 ATOM 6540 O O . PHE D 1 224 ? 50.129 -37.034 128.472 1.00 133.23 ? 590 PHE B O 1 ATOM 6541 C CB . PHE D 1 224 ? 50.388 -34.562 129.639 1.00 127.45 ? 590 PHE B CB 1 ATOM 6542 C CG . PHE D 1 224 ? 50.657 -33.198 130.206 1.00 124.60 ? 590 PHE B CG 1 ATOM 6543 C CD1 . PHE D 1 224 ? 49.955 -32.094 129.752 1.00 121.51 ? 590 PHE B CD1 1 ATOM 6544 C CD2 . PHE D 1 224 ? 51.619 -33.017 131.187 1.00 125.25 ? 590 PHE B CD2 1 ATOM 6545 C CE1 . PHE D 1 224 ? 50.201 -30.837 130.269 1.00 120.33 ? 590 PHE B CE1 1 ATOM 6546 C CE2 . PHE D 1 224 ? 51.871 -31.762 131.708 1.00 122.33 ? 590 PHE B CE2 1 ATOM 6547 C CZ . PHE D 1 224 ? 51.161 -30.671 131.248 1.00 120.49 ? 590 PHE B CZ 1 ATOM 6548 N N . ALA D 1 225 ? 51.590 -36.615 126.812 1.00 124.92 ? 591 ALA B N 1 ATOM 6549 C CA . ALA D 1 225 ? 51.252 -37.812 126.054 1.00 129.96 ? 591 ALA B CA 1 ATOM 6550 C C . ALA D 1 225 ? 52.427 -38.255 125.192 1.00 132.53 ? 591 ALA B C 1 ATOM 6551 O O . ALA D 1 225 ? 52.265 -38.533 124.005 1.00 134.21 ? 591 ALA B O 1 ATOM 6552 C CB . ALA D 1 225 ? 50.025 -37.564 125.192 1.00 127.67 ? 591 ALA B CB 1 ATOM 6553 N N . GLN E 2 1 ? 65.935 35.134 102.556 1.00 101.26 ? 1 GLN D N 1 ATOM 6554 C CA . GLN E 2 1 ? 66.051 33.804 101.970 1.00 96.41 ? 1 GLN D CA 1 ATOM 6555 C C . GLN E 2 1 ? 67.366 33.648 101.212 1.00 95.60 ? 1 GLN D C 1 ATOM 6556 O O . GLN E 2 1 ? 68.023 34.633 100.877 1.00 96.24 ? 1 GLN D O 1 ATOM 6557 C CB . GLN E 2 1 ? 64.876 33.523 101.033 1.00 93.89 ? 1 GLN D CB 1 ATOM 6558 C CG . GLN E 2 1 ? 64.912 34.333 99.747 1.00 95.02 ? 1 GLN D CG 1 ATOM 6559 C CD . GLN E 2 1 ? 63.866 33.890 98.745 1.00 93.95 ? 1 GLN D CD 1 ATOM 6560 O OE1 . GLN E 2 1 ? 62.851 33.298 99.109 1.00 96.36 ? 1 GLN D OE1 1 ATOM 6561 N NE2 . GLN E 2 1 ? 64.113 34.169 97.470 1.00 90.26 ? 1 GLN D NE2 1 ATOM 6562 N N . VAL E 2 2 ? 67.743 32.404 100.939 1.00 93.40 ? 2 VAL D N 1 ATOM 6563 C CA . VAL E 2 2 ? 68.962 32.126 100.192 1.00 90.64 ? 2 VAL D CA 1 ATOM 6564 C C . VAL E 2 2 ? 68.729 32.374 98.700 1.00 88.58 ? 2 VAL D C 1 ATOM 6565 O O . VAL E 2 2 ? 67.606 32.250 98.207 1.00 86.15 ? 2 VAL D O 1 ATOM 6566 C CB . VAL E 2 2 ? 69.448 30.674 100.429 1.00 88.24 ? 2 VAL D CB 1 ATOM 6567 C CG1 . VAL E 2 2 ? 68.499 29.672 99.786 1.00 83.93 ? 2 VAL D CG1 1 ATOM 6568 C CG2 . VAL E 2 2 ? 70.865 30.484 99.911 1.00 89.32 ? 2 VAL D CG2 1 ATOM 6569 N N . GLN E 2 3 ? 69.787 32.750 97.989 1.00 93.28 ? 3 GLN D N 1 ATOM 6570 C CA . GLN E 2 3 ? 69.700 32.968 96.552 1.00 92.35 ? 3 GLN D CA 1 ATOM 6571 C C . GLN E 2 3 ? 70.516 31.919 95.808 1.00 88.23 ? 3 GLN D C 1 ATOM 6572 O O . GLN E 2 3 ? 71.499 31.402 96.336 1.00 88.26 ? 3 GLN D O 1 ATOM 6573 C CB . GLN E 2 3 ? 70.187 34.373 96.187 1.00 101.04 ? 3 GLN D CB 1 ATOM 6574 C CG . GLN E 2 3 ? 69.647 35.478 97.086 1.00 110.14 ? 3 GLN D CG 1 ATOM 6575 C CD . GLN E 2 3 ? 68.140 35.624 97.002 1.00 112.26 ? 3 GLN D CD 1 ATOM 6576 O OE1 . GLN E 2 3 ? 67.528 35.299 95.985 1.00 112.63 ? 3 GLN D OE1 1 ATOM 6577 N NE2 . GLN E 2 3 ? 67.533 36.117 98.077 1.00 112.80 ? 3 GLN D NE2 1 ATOM 6578 N N . LEU E 2 4 ? 70.103 31.602 94.585 1.00 84.88 ? 4 LEU D N 1 ATOM 6579 C CA . LEU E 2 4 ? 70.832 30.645 93.760 1.00 77.33 ? 4 LEU D CA 1 ATOM 6580 C C . LEU E 2 4 ? 71.478 31.337 92.564 1.00 70.66 ? 4 LEU D C 1 ATOM 6581 O O . LEU E 2 4 ? 70.795 31.728 91.617 1.00 66.25 ? 4 LEU D O 1 ATOM 6582 C CB . LEU E 2 4 ? 69.905 29.520 93.288 1.00 72.14 ? 4 LEU D CB 1 ATOM 6583 C CG . LEU E 2 4 ? 69.892 28.231 94.118 1.00 71.67 ? 4 LEU D CG 1 ATOM 6584 C CD1 . LEU E 2 4 ? 69.710 28.519 95.598 1.00 73.98 ? 4 LEU D CD1 1 ATOM 6585 C CD2 . LEU E 2 4 ? 68.814 27.279 93.619 1.00 67.93 ? 4 LEU D CD2 1 ATOM 6586 N N . VAL E 2 5 ? 72.799 31.490 92.618 1.00 69.53 ? 5 VAL D N 1 ATOM 6587 C CA . VAL E 2 5 ? 73.546 32.131 91.540 1.00 68.91 ? 5 VAL D CA 1 ATOM 6588 C C . VAL E 2 5 ? 74.286 31.100 90.692 1.00 67.04 ? 5 VAL D C 1 ATOM 6589 O O . VAL E 2 5 ? 75.090 30.318 91.204 1.00 67.96 ? 5 VAL D O 1 ATOM 6590 C CB . VAL E 2 5 ? 74.557 33.156 92.085 1.00 72.92 ? 5 VAL D CB 1 ATOM 6591 C CG1 . VAL E 2 5 ? 75.349 33.778 90.946 1.00 70.17 ? 5 VAL D CG1 1 ATOM 6592 C CG2 . VAL E 2 5 ? 73.841 34.228 92.895 1.00 76.90 ? 5 VAL D CG2 1 ATOM 6593 N N . GLN E 2 6 ? 74.009 31.106 89.392 1.00 64.14 ? 6 GLN D N 1 ATOM 6594 C CA . GLN E 2 6 ? 74.588 30.131 88.477 1.00 65.89 ? 6 GLN D CA 1 ATOM 6595 C C . GLN E 2 6 ? 75.786 30.705 87.727 1.00 74.56 ? 6 GLN D C 1 ATOM 6596 O O . GLN E 2 6 ? 76.044 31.908 87.781 1.00 78.97 ? 6 GLN D O 1 ATOM 6597 C CB . GLN E 2 6 ? 73.532 29.648 87.483 1.00 62.20 ? 6 GLN D CB 1 ATOM 6598 C CG . GLN E 2 6 ? 72.248 29.159 88.130 1.00 56.34 ? 6 GLN D CG 1 ATOM 6599 C CD . GLN E 2 6 ? 71.236 28.666 87.116 1.00 50.33 ? 6 GLN D CD 1 ATOM 6600 O OE1 . GLN E 2 6 ? 70.053 28.525 87.422 1.00 48.72 ? 6 GLN D OE1 1 ATOM 6601 N NE2 . GLN E 2 6 ? 71.698 28.398 85.901 1.00 50.20 ? 6 GLN D NE2 1 ATOM 6602 N N . SER E 2 7 ? 76.512 29.839 87.025 1.00 76.09 ? 7 SER D N 1 ATOM 6603 C CA . SER E 2 7 ? 77.669 30.266 86.245 1.00 75.66 ? 7 SER D CA 1 ATOM 6604 C C . SER E 2 7 ? 77.234 31.017 84.989 1.00 76.30 ? 7 SER D C 1 ATOM 6605 O O . SER E 2 7 ? 76.057 31.012 84.629 1.00 70.43 ? 7 SER D O 1 ATOM 6606 C CB . SER E 2 7 ? 78.541 29.065 85.870 1.00 77.13 ? 7 SER D CB 1 ATOM 6607 O OG . SER E 2 7 ? 77.829 28.137 85.069 1.00 78.89 ? 7 SER D OG 1 ATOM 6608 N N . GLY E 2 8 ? 78.191 31.661 84.328 1.00 81.30 ? 8 GLY D N 1 ATOM 6609 C CA . GLY E 2 8 ? 77.904 32.457 83.148 1.00 81.99 ? 8 GLY D CA 1 ATOM 6610 C C . GLY E 2 8 ? 77.507 31.617 81.950 1.00 85.01 ? 8 GLY D C 1 ATOM 6611 O O . GLY E 2 8 ? 77.511 30.389 82.014 1.00 90.24 ? 8 GLY D O 1 ATOM 6612 N N . ALA E 2 9 ? 77.166 32.284 80.852 1.00 85.05 ? 9 ALA D N 1 ATOM 6613 C CA . ALA E 2 9 ? 76.749 31.597 79.635 1.00 87.02 ? 9 ALA D CA 1 ATOM 6614 C C . ALA E 2 9 ? 77.898 30.798 79.026 1.00 90.21 ? 9 ALA D C 1 ATOM 6615 O O . ALA E 2 9 ? 79.048 31.235 79.037 1.00 95.08 ? 9 ALA D O 1 ATOM 6616 C CB . ALA E 2 9 ? 76.206 32.595 78.624 1.00 89.36 ? 9 ALA D CB 1 ATOM 6617 N N . GLU E 2 10 ? 77.577 29.623 78.494 1.00 86.98 ? 10 GLU D N 1 ATOM 6618 C CA . GLU E 2 10 ? 78.581 28.749 77.899 1.00 85.08 ? 10 GLU D CA 1 ATOM 6619 C C . GLU E 2 10 ? 78.352 28.568 76.403 1.00 89.59 ? 10 GLU D C 1 ATOM 6620 O O . GLU E 2 10 ? 77.216 28.414 75.954 1.00 88.31 ? 10 GLU D O 1 ATOM 6621 C CB . GLU E 2 10 ? 78.582 27.387 78.595 1.00 82.35 ? 10 GLU D CB 1 ATOM 6622 C CG . GLU E 2 10 ? 79.092 27.420 80.025 1.00 83.95 ? 10 GLU D CG 1 ATOM 6623 C CD . GLU E 2 10 ? 80.587 27.656 80.104 1.00 89.49 ? 10 GLU D CD 1 ATOM 6624 O OE1 . GLU E 2 10 ? 81.292 27.351 79.119 1.00 91.32 ? 10 GLU D OE1 1 ATOM 6625 O OE2 . GLU E 2 10 ? 81.058 28.149 81.150 1.00 92.41 ? 10 GLU D OE2 1 ATOM 6626 N N . VAL E 2 11 ? 79.438 28.596 75.636 1.00 94.04 ? 11 VAL D N 1 ATOM 6627 C CA . VAL E 2 11 ? 79.376 28.342 74.202 1.00 78.63 ? 11 VAL D CA 1 ATOM 6628 C C . VAL E 2 11 ? 80.263 27.154 73.853 1.00 89.84 ? 11 VAL D C 1 ATOM 6629 O O . VAL E 2 11 ? 81.471 27.301 73.674 1.00 84.71 ? 11 VAL D O 1 ATOM 6630 C CB . VAL E 2 11 ? 79.815 29.568 73.381 1.00 82.60 ? 11 VAL D CB 1 ATOM 6631 C CG1 . VAL E 2 11 ? 79.587 29.319 71.899 1.00 85.98 ? 11 VAL D CG1 1 ATOM 6632 C CG2 . VAL E 2 11 ? 79.064 30.807 73.833 1.00 81.02 ? 11 VAL D CG2 1 ATOM 6633 N N . LYS E 2 12 ? 79.657 25.975 73.763 1.00 87.08 ? 12 LYS D N 1 ATOM 6634 C CA . LYS E 2 12 ? 80.408 24.750 73.521 1.00 91.63 ? 12 LYS D CA 1 ATOM 6635 C C . LYS E 2 12 ? 80.106 24.152 72.152 1.00 93.10 ? 12 LYS D C 1 ATOM 6636 O O . LYS E 2 12 ? 79.015 24.327 71.611 1.00 89.95 ? 12 LYS D O 1 ATOM 6637 C CB . LYS E 2 12 ? 80.113 23.723 74.616 1.00 90.37 ? 12 LYS D CB 1 ATOM 6638 C CG . LYS E 2 12 ? 80.703 24.072 75.975 1.00 89.56 ? 12 LYS D CG 1 ATOM 6639 C CD . LYS E 2 12 ? 82.224 24.080 75.924 1.00 93.88 ? 12 LYS D CD 1 ATOM 6640 C CE . LYS E 2 12 ? 82.822 24.406 77.282 1.00 93.24 ? 12 LYS D CE 1 ATOM 6641 N NZ . LYS E 2 12 ? 82.384 25.738 77.780 1.00 91.71 ? 12 LYS D NZ 1 ATOM 6642 N N . LYS E 2 13 ? 81.087 23.445 71.599 1.00 97.57 ? 13 LYS D N 1 ATOM 6643 C CA . LYS E 2 13 ? 80.940 22.790 70.305 1.00 100.88 ? 13 LYS D CA 1 ATOM 6644 C C . LYS E 2 13 ? 80.208 21.460 70.463 1.00 101.48 ? 13 LYS D C 1 ATOM 6645 O O . LYS E 2 13 ? 80.218 20.874 71.545 1.00 103.19 ? 13 LYS D O 1 ATOM 6646 C CB . LYS E 2 13 ? 82.312 22.575 69.663 1.00 107.32 ? 13 LYS D CB 1 ATOM 6647 C CG . LYS E 2 13 ? 83.177 23.824 69.634 1.00 112.18 ? 13 LYS D CG 1 ATOM 6648 C CD . LYS E 2 13 ? 83.623 24.160 68.221 1.00 121.10 ? 13 LYS D CD 1 ATOM 6649 C CE . LYS E 2 13 ? 82.437 24.502 67.334 1.00 122.37 ? 13 LYS D CE 1 ATOM 6650 N NZ . LYS E 2 13 ? 82.867 24.851 65.952 1.00 129.62 ? 13 LYS D NZ 1 ATOM 6651 N N . PRO E 2 14 ? 79.554 20.985 69.389 1.00 100.43 ? 14 PRO D N 1 ATOM 6652 C CA . PRO E 2 14 ? 78.858 19.694 69.458 1.00 101.67 ? 14 PRO D CA 1 ATOM 6653 C C . PRO E 2 14 ? 79.811 18.530 69.724 1.00 105.24 ? 14 PRO D C 1 ATOM 6654 O O . PRO E 2 14 ? 80.730 18.284 68.942 1.00 110.64 ? 14 PRO D O 1 ATOM 6655 C CB . PRO E 2 14 ? 78.206 19.569 68.074 1.00 97.27 ? 14 PRO D CB 1 ATOM 6656 C CG . PRO E 2 14 ? 78.950 20.520 67.202 1.00 100.85 ? 14 PRO D CG 1 ATOM 6657 C CD . PRO E 2 14 ? 79.351 21.650 68.092 1.00 97.47 ? 14 PRO D CD 1 ATOM 6658 N N . GLY E 2 15 ? 79.587 17.827 70.829 1.00 106.12 ? 15 GLY D N 1 ATOM 6659 C CA . GLY E 2 15 ? 80.443 16.725 71.223 1.00 110.02 ? 15 GLY D CA 1 ATOM 6660 C C . GLY E 2 15 ? 81.286 17.063 72.439 1.00 111.00 ? 15 GLY D C 1 ATOM 6661 O O . GLY E 2 15 ? 81.901 16.184 73.043 1.00 113.63 ? 15 GLY D O 1 ATOM 6662 N N . SER E 2 16 ? 81.311 18.342 72.801 1.00 109.13 ? 16 SER D N 1 ATOM 6663 C CA . SER E 2 16 ? 82.102 18.800 73.937 1.00 107.06 ? 16 SER D CA 1 ATOM 6664 C C . SER E 2 16 ? 81.367 18.585 75.255 1.00 104.74 ? 16 SER D C 1 ATOM 6665 O O . SER E 2 16 ? 80.324 17.933 75.297 1.00 104.64 ? 16 SER D O 1 ATOM 6666 C CB . SER E 2 16 ? 82.463 20.278 73.774 1.00 105.37 ? 16 SER D CB 1 ATOM 6667 O OG . SER E 2 16 ? 83.157 20.502 72.559 1.00 112.01 ? 16 SER D OG 1 ATOM 6668 N N . SER E 2 17 ? 81.920 19.138 76.330 1.00 102.32 ? 17 SER D N 1 ATOM 6669 C CA . SER E 2 17 ? 81.319 19.015 77.653 1.00 95.88 ? 17 SER D CA 1 ATOM 6670 C C . SER E 2 17 ? 81.130 20.385 78.297 1.00 94.80 ? 17 SER D C 1 ATOM 6671 O O . SER E 2 17 ? 81.968 21.274 78.143 1.00 101.03 ? 17 SER D O 1 ATOM 6672 C CB . SER E 2 17 ? 82.179 18.123 78.551 1.00 100.24 ? 17 SER D CB 1 ATOM 6673 O OG . SER E 2 17 ? 81.652 18.056 79.865 1.00 97.26 ? 17 SER D OG 1 ATOM 6674 N N . VAL E 2 18 ? 80.023 20.547 79.015 1.00 83.66 ? 18 VAL D N 1 ATOM 6675 C CA . VAL E 2 18 ? 79.722 21.797 79.703 1.00 77.87 ? 18 VAL D CA 1 ATOM 6676 C C . VAL E 2 18 ? 79.395 21.524 81.171 1.00 78.15 ? 18 VAL D C 1 ATOM 6677 O O . VAL E 2 18 ? 78.734 20.537 81.494 1.00 80.64 ? 18 VAL D O 1 ATOM 6678 C CB . VAL E 2 18 ? 78.547 22.545 79.023 1.00 75.69 ? 18 VAL D CB 1 ATOM 6679 C CG1 . VAL E 2 18 ? 77.309 21.657 78.947 1.00 73.76 ? 18 VAL D CG1 1 ATOM 6680 C CG2 . VAL E 2 18 ? 78.238 23.850 79.745 1.00 66.78 ? 18 VAL D CG2 1 ATOM 6681 N N . LYS E 2 19 ? 79.873 22.389 82.061 1.00 75.32 ? 19 LYS D N 1 ATOM 6682 C CA . LYS E 2 19 ? 79.616 22.235 83.487 1.00 71.68 ? 19 LYS D CA 1 ATOM 6683 C C . LYS E 2 19 ? 79.095 23.536 84.091 1.00 74.03 ? 19 LYS D C 1 ATOM 6684 O O . LYS E 2 19 ? 79.831 24.516 84.206 1.00 73.76 ? 19 LYS D O 1 ATOM 6685 C CB . LYS E 2 19 ? 80.883 21.781 84.213 1.00 73.23 ? 19 LYS D CB 1 ATOM 6686 C CG . LYS E 2 19 ? 80.646 21.280 85.627 1.00 71.05 ? 19 LYS D CG 1 ATOM 6687 C CD . LYS E 2 19 ? 81.909 20.667 86.209 1.00 76.08 ? 19 LYS D CD 1 ATOM 6688 C CE . LYS E 2 19 ? 81.641 20.049 87.570 1.00 76.63 ? 19 LYS D CE 1 ATOM 6689 N NZ . LYS E 2 19 ? 82.855 19.389 88.126 1.00 87.51 ? 19 LYS D NZ 1 ATOM 6690 N N . VAL E 2 20 ? 77.820 23.533 84.473 1.00 74.47 ? 20 VAL D N 1 ATOM 6691 C CA . VAL E 2 20 ? 77.168 24.710 85.036 1.00 73.99 ? 20 VAL D CA 1 ATOM 6692 C C . VAL E 2 20 ? 77.152 24.649 86.562 1.00 75.25 ? 20 VAL D C 1 ATOM 6693 O O . VAL E 2 20 ? 76.840 23.609 87.143 1.00 76.14 ? 20 VAL D O 1 ATOM 6694 C CB . VAL E 2 20 ? 75.721 24.849 84.512 1.00 73.66 ? 20 VAL D CB 1 ATOM 6695 C CG1 . VAL E 2 20 ? 75.025 26.044 85.148 1.00 70.48 ? 20 VAL D CG1 1 ATOM 6696 C CG2 . VAL E 2 20 ? 75.716 24.969 82.994 1.00 73.62 ? 20 VAL D CG2 1 ATOM 6697 N N . SER E 2 21 ? 77.491 25.762 87.208 1.00 75.99 ? 21 SER D N 1 ATOM 6698 C CA . SER E 2 21 ? 77.518 25.818 88.667 1.00 78.25 ? 21 SER D CA 1 ATOM 6699 C C . SER E 2 21 ? 76.240 26.432 89.237 1.00 75.74 ? 21 SER D C 1 ATOM 6700 O O . SER E 2 21 ? 75.447 27.030 88.511 1.00 74.51 ? 21 SER D O 1 ATOM 6701 C CB . SER E 2 21 ? 78.737 26.607 89.154 1.00 84.77 ? 21 SER D CB 1 ATOM 6702 O OG . SER E 2 21 ? 78.595 27.991 88.889 1.00 87.21 ? 21 SER D OG 1 ATOM 6703 N N . CYS E 2 22 ? 76.052 26.273 90.543 1.00 79.24 ? 22 CYS D N 1 ATOM 6704 C CA . CYS E 2 22 ? 74.877 26.790 91.236 1.00 80.08 ? 22 CYS D CA 1 ATOM 6705 C C . CYS E 2 22 ? 75.218 27.084 92.696 1.00 83.63 ? 22 CYS D C 1 ATOM 6706 O O . CYS E 2 22 ? 75.032 26.236 93.568 1.00 86.66 ? 22 CYS D O 1 ATOM 6707 C CB . CYS E 2 22 ? 73.716 25.794 91.142 1.00 80.10 ? 22 CYS D CB 1 ATOM 6708 S SG . CYS E 2 22 ? 72.150 26.362 91.853 1.00 67.43 ? 22 CYS D SG 1 ATOM 6709 N N . LYS E 2 23 ? 75.726 28.286 92.950 1.00 83.91 ? 23 LYS D N 1 ATOM 6710 C CA . LYS E 2 23 ? 76.167 28.675 94.287 1.00 87.03 ? 23 LYS D CA 1 ATOM 6711 C C . LYS E 2 23 ? 75.037 29.310 95.090 1.00 85.81 ? 23 LYS D C 1 ATOM 6712 O O . LYS E 2 23 ? 74.196 30.019 94.539 1.00 86.92 ? 23 LYS D O 1 ATOM 6713 C CB . LYS E 2 23 ? 77.354 29.641 94.192 1.00 94.57 ? 23 LYS D CB 1 ATOM 6714 C CG . LYS E 2 23 ? 77.923 30.088 95.532 1.00 101.29 ? 23 LYS D CG 1 ATOM 6715 C CD . LYS E 2 23 ? 79.131 30.994 95.344 1.00 106.11 ? 23 LYS D CD 1 ATOM 6716 C CE . LYS E 2 23 ? 78.765 32.256 94.576 1.00 105.21 ? 23 LYS D CE 1 ATOM 6717 N NZ . LYS E 2 23 ? 77.756 33.078 95.301 1.00 105.39 ? 23 LYS D NZ 1 ATOM 6718 N N . ALA E 2 24 ? 75.019 29.049 96.393 1.00 86.83 ? 24 ALA D N 1 ATOM 6719 C CA . ALA E 2 24 ? 74.025 29.639 97.280 1.00 86.39 ? 24 ALA D CA 1 ATOM 6720 C C . ALA E 2 24 ? 74.540 30.941 97.887 1.00 89.89 ? 24 ALA D C 1 ATOM 6721 O O . ALA E 2 24 ? 75.580 30.959 98.546 1.00 94.44 ? 24 ALA D O 1 ATOM 6722 C CB . ALA E 2 24 ? 73.642 28.657 98.376 1.00 84.48 ? 24 ALA D CB 1 ATOM 6723 N N . SER E 2 25 ? 73.808 32.028 97.661 1.00 88.30 ? 25 SER D N 1 ATOM 6724 C CA . SER E 2 25 ? 74.192 33.337 98.183 1.00 91.26 ? 25 SER D CA 1 ATOM 6725 C C . SER E 2 25 ? 73.418 33.677 99.453 1.00 93.42 ? 25 SER D C 1 ATOM 6726 O O . SER E 2 25 ? 72.188 33.629 99.471 1.00 92.24 ? 25 SER D O 1 ATOM 6727 C CB . SER E 2 25 ? 73.969 34.421 97.126 1.00 90.19 ? 25 SER D CB 1 ATOM 6728 O OG . SER E 2 25 ? 74.296 35.706 97.630 1.00 94.42 ? 25 SER D OG 1 ATOM 6729 N N . GLY E 2 26 ? 74.146 34.023 100.510 1.00 99.04 ? 26 GLY D N 1 ATOM 6730 C CA . GLY E 2 26 ? 73.534 34.364 101.782 1.00 103.50 ? 26 GLY D CA 1 ATOM 6731 C C . GLY E 2 26 ? 72.781 33.196 102.389 1.00 104.19 ? 26 GLY D C 1 ATOM 6732 O O . GLY E 2 26 ? 71.550 33.183 102.413 1.00 102.75 ? 26 GLY D O 1 ATOM 6733 N N . GLY E 2 27 ? 73.526 32.213 102.883 1.00 106.84 ? 27 GLY D N 1 ATOM 6734 C CA . GLY E 2 27 ? 72.936 31.003 103.423 1.00 105.36 ? 27 GLY D CA 1 ATOM 6735 C C . GLY E 2 27 ? 73.349 29.797 102.605 1.00 103.18 ? 27 GLY D C 1 ATOM 6736 O O . GLY E 2 27 ? 73.670 29.920 101.425 1.00 103.29 ? 27 GLY D O 1 ATOM 6737 N N . THR E 2 28 ? 73.344 28.626 103.231 1.00 103.71 ? 28 THR D N 1 ATOM 6738 C CA . THR E 2 28 ? 73.761 27.406 102.551 1.00 103.52 ? 28 THR D CA 1 ATOM 6739 C C . THR E 2 28 ? 72.574 26.664 101.947 1.00 98.51 ? 28 THR D C 1 ATOM 6740 O O . THR E 2 28 ? 71.442 27.147 101.991 1.00 96.64 ? 28 THR D O 1 ATOM 6741 C CB . THR E 2 28 ? 74.513 26.467 103.507 1.00 109.69 ? 28 THR D CB 1 ATOM 6742 O OG1 . THR E 2 28 ? 73.747 26.293 104.706 1.00 113.20 ? 28 THR D OG1 1 ATOM 6743 C CG2 . THR E 2 28 ? 75.863 27.058 103.862 1.00 114.33 ? 28 THR D CG2 1 ATOM 6744 N N . PHE E 2 29 ? 72.839 25.489 101.383 1.00 95.09 ? 29 PHE D N 1 ATOM 6745 C CA . PHE E 2 29 ? 71.780 24.648 100.836 1.00 86.85 ? 29 PHE D CA 1 ATOM 6746 C C . PHE E 2 29 ? 70.933 24.055 101.954 1.00 89.20 ? 29 PHE D C 1 ATOM 6747 O O . PHE E 2 29 ? 69.841 23.540 101.707 1.00 90.92 ? 29 PHE D O 1 ATOM 6748 C CB . PHE E 2 29 ? 72.365 23.528 99.971 1.00 77.75 ? 29 PHE D CB 1 ATOM 6749 C CG . PHE E 2 29 ? 72.815 23.982 98.614 1.00 70.73 ? 29 PHE D CG 1 ATOM 6750 C CD1 . PHE E 2 29 ? 72.250 25.099 98.021 1.00 69.25 ? 29 PHE D CD1 1 ATOM 6751 C CD2 . PHE E 2 29 ? 73.803 23.294 97.930 1.00 71.83 ? 29 PHE D CD2 1 ATOM 6752 C CE1 . PHE E 2 29 ? 72.662 25.522 96.770 1.00 68.35 ? 29 PHE D CE1 1 ATOM 6753 C CE2 . PHE E 2 29 ? 74.220 23.711 96.678 1.00 72.50 ? 29 PHE D CE2 1 ATOM 6754 C CZ . PHE E 2 29 ? 73.648 24.827 96.098 1.00 69.43 ? 29 PHE D CZ 1 ATOM 6755 N N . SER E 2 30 ? 71.448 24.139 103.178 1.00 91.00 ? 30 SER D N 1 ATOM 6756 C CA . SER E 2 30 ? 70.781 23.592 104.354 1.00 94.64 ? 30 SER D CA 1 ATOM 6757 C C . SER E 2 30 ? 70.453 22.118 104.144 1.00 95.67 ? 30 SER D C 1 ATOM 6758 O O . SER E 2 30 ? 71.332 21.321 103.817 1.00 96.92 ? 30 SER D O 1 ATOM 6759 C CB . SER E 2 30 ? 69.512 24.386 104.680 1.00 93.68 ? 30 SER D CB 1 ATOM 6760 O OG . SER E 2 30 ? 68.911 23.924 105.877 1.00 98.69 ? 30 SER D OG 1 ATOM 6761 N N . SER E 2 31 ? 69.185 21.764 104.321 1.00 93.73 ? 31 SER D N 1 ATOM 6762 C CA . SER E 2 31 ? 68.748 20.383 104.162 1.00 88.65 ? 31 SER D CA 1 ATOM 6763 C C . SER E 2 31 ? 67.844 20.225 102.948 1.00 79.85 ? 31 SER D C 1 ATOM 6764 O O . SER E 2 31 ? 67.114 19.243 102.834 1.00 78.77 ? 31 SER D O 1 ATOM 6765 C CB . SER E 2 31 ? 68.015 19.906 105.414 1.00 90.34 ? 31 SER D CB 1 ATOM 6766 O OG . SER E 2 31 ? 66.799 20.612 105.580 1.00 87.04 ? 31 SER D OG 1 ATOM 6767 N N . TYR E 2 32 ? 67.890 21.198 102.045 1.00 74.20 ? 32 TYR D N 1 ATOM 6768 C CA . TYR E 2 32 ? 67.040 21.170 100.863 1.00 71.28 ? 32 TYR D CA 1 ATOM 6769 C C . TYR E 2 32 ? 67.761 20.547 99.673 1.00 75.27 ? 32 TYR D C 1 ATOM 6770 O O . TYR E 2 32 ? 68.949 20.789 99.457 1.00 79.29 ? 32 TYR D O 1 ATOM 6771 C CB . TYR E 2 32 ? 66.570 22.581 100.511 1.00 67.81 ? 32 TYR D CB 1 ATOM 6772 C CG . TYR E 2 32 ? 65.722 23.234 101.579 1.00 72.15 ? 32 TYR D CG 1 ATOM 6773 C CD1 . TYR E 2 32 ? 66.301 23.998 102.585 1.00 73.46 ? 32 TYR D CD1 1 ATOM 6774 C CD2 . TYR E 2 32 ? 64.341 23.088 101.581 1.00 75.96 ? 32 TYR D CD2 1 ATOM 6775 C CE1 . TYR E 2 32 ? 65.530 24.597 103.562 1.00 76.22 ? 32 TYR D CE1 1 ATOM 6776 C CE2 . TYR E 2 32 ? 63.559 23.684 102.556 1.00 79.51 ? 32 TYR D CE2 1 ATOM 6777 C CZ . TYR E 2 32 ? 64.160 24.437 103.544 1.00 79.19 ? 32 TYR D CZ 1 ATOM 6778 O OH . TYR E 2 32 ? 63.387 25.032 104.516 1.00 83.33 ? 32 TYR D OH 1 ATOM 6779 N N . ALA E 2 33 ? 67.035 19.740 98.907 1.00 72.68 ? 33 ALA D N 1 ATOM 6780 C CA . ALA E 2 33 ? 67.585 19.125 97.707 1.00 68.13 ? 33 ALA D CA 1 ATOM 6781 C C . ALA E 2 33 ? 67.552 20.111 96.548 1.00 69.01 ? 33 ALA D C 1 ATOM 6782 O O . ALA E 2 33 ? 66.713 21.011 96.515 1.00 71.82 ? 33 ALA D O 1 ATOM 6783 C CB . ALA E 2 33 ? 66.819 17.863 97.353 1.00 65.86 ? 33 ALA D CB 1 ATOM 6784 N N . ILE E 2 34 ? 68.470 19.939 95.602 1.00 68.10 ? 34 ILE D N 1 ATOM 6785 C CA . ILE E 2 34 ? 68.554 20.819 94.441 1.00 65.11 ? 34 ILE D CA 1 ATOM 6786 C C . ILE E 2 34 ? 68.320 20.030 93.157 1.00 68.58 ? 34 ILE D C 1 ATOM 6787 O O . ILE E 2 34 ? 68.883 18.952 92.974 1.00 77.41 ? 34 ILE D O 1 ATOM 6788 C CB . ILE E 2 34 ? 69.925 21.528 94.367 1.00 64.37 ? 34 ILE D CB 1 ATOM 6789 C CG1 . ILE E 2 34 ? 70.205 22.295 95.661 1.00 64.18 ? 34 ILE D CG1 1 ATOM 6790 C CG2 . ILE E 2 34 ? 69.988 22.463 93.167 1.00 59.77 ? 34 ILE D CG2 1 ATOM 6791 C CD1 . ILE E 2 34 ? 69.228 23.417 95.932 1.00 62.90 ? 34 ILE D CD1 1 ATOM 6792 N N . SER E 2 35 ? 67.482 20.563 92.273 1.00 65.53 ? 35 SER D N 1 ATOM 6793 C CA . SER E 2 35 ? 67.209 19.916 90.993 1.00 68.42 ? 35 SER D CA 1 ATOM 6794 C C . SER E 2 35 ? 67.641 20.790 89.821 1.00 70.35 ? 35 SER D C 1 ATOM 6795 O O . SER E 2 35 ? 67.938 21.973 89.992 1.00 68.86 ? 35 SER D O 1 ATOM 6796 C CB . SER E 2 35 ? 65.722 19.575 90.868 1.00 71.67 ? 35 SER D CB 1 ATOM 6797 O OG . SER E 2 35 ? 65.351 18.566 91.790 1.00 79.70 ? 35 SER D OG 1 ATOM 6798 N N . TRP E 2 36 ? 67.674 20.197 88.632 1.00 71.92 ? 36 TRP D N 1 ATOM 6799 C CA . TRP E 2 36 ? 68.050 20.920 87.424 1.00 70.00 ? 36 TRP D CA 1 ATOM 6800 C C . TRP E 2 36 ? 66.973 20.809 86.353 1.00 71.74 ? 36 TRP D C 1 ATOM 6801 O O . TRP E 2 36 ? 66.502 19.716 86.041 1.00 73.79 ? 36 TRP D O 1 ATOM 6802 C CB . TRP E 2 36 ? 69.383 20.403 86.883 1.00 68.32 ? 36 TRP D CB 1 ATOM 6803 C CG . TRP E 2 36 ? 70.550 20.789 87.730 1.00 66.97 ? 36 TRP D CG 1 ATOM 6804 C CD1 . TRP E 2 36 ? 71.053 20.102 88.793 1.00 70.40 ? 36 TRP D CD1 1 ATOM 6805 C CD2 . TRP E 2 36 ? 71.359 21.961 87.590 1.00 68.04 ? 36 TRP D CD2 1 ATOM 6806 N NE1 . TRP E 2 36 ? 72.128 20.771 89.323 1.00 73.01 ? 36 TRP D NE1 1 ATOM 6807 C CE2 . TRP E 2 36 ? 72.336 21.917 88.603 1.00 70.03 ? 36 TRP D CE2 1 ATOM 6808 C CE3 . TRP E 2 36 ? 71.352 23.044 86.705 1.00 70.84 ? 36 TRP D CE3 1 ATOM 6809 C CZ2 . TRP E 2 36 ? 73.298 22.913 88.756 1.00 71.49 ? 36 TRP D CZ2 1 ATOM 6810 C CZ3 . TRP E 2 36 ? 72.307 24.032 86.858 1.00 74.34 ? 36 TRP D CZ3 1 ATOM 6811 C CH2 . TRP E 2 36 ? 73.268 23.960 87.877 1.00 74.13 ? 36 TRP D CH2 1 ATOM 6812 N N . VAL E 2 37 ? 66.585 21.953 85.797 1.00 70.86 ? 37 VAL D N 1 ATOM 6813 C CA . VAL E 2 37 ? 65.564 22.003 84.757 1.00 71.24 ? 37 VAL D CA 1 ATOM 6814 C C . VAL E 2 37 ? 66.011 22.902 83.609 1.00 73.14 ? 37 VAL D C 1 ATOM 6815 O O . VAL E 2 37 ? 66.310 24.078 83.817 1.00 75.20 ? 37 VAL D O 1 ATOM 6816 C CB . VAL E 2 37 ? 64.218 22.518 85.308 1.00 71.30 ? 37 VAL D CB 1 ATOM 6817 C CG1 . VAL E 2 37 ? 63.225 22.728 84.177 1.00 73.69 ? 37 VAL D CG1 1 ATOM 6818 C CG2 . VAL E 2 37 ? 63.658 21.556 86.347 1.00 72.71 ? 37 VAL D CG2 1 ATOM 6819 N N . ARG E 2 38 ? 66.059 22.352 82.400 1.00 71.75 ? 38 ARG D N 1 ATOM 6820 C CA . ARG E 2 38 ? 66.438 23.142 81.234 1.00 67.34 ? 38 ARG D CA 1 ATOM 6821 C C . ARG E 2 38 ? 65.207 23.564 80.444 1.00 68.58 ? 38 ARG D C 1 ATOM 6822 O O . ARG E 2 38 ? 64.129 22.985 80.590 1.00 68.59 ? 38 ARG D O 1 ATOM 6823 C CB . ARG E 2 38 ? 67.399 22.364 80.332 1.00 63.05 ? 38 ARG D CB 1 ATOM 6824 C CG . ARG E 2 38 ? 66.742 21.266 79.514 1.00 61.03 ? 38 ARG D CG 1 ATOM 6825 C CD . ARG E 2 38 ? 67.730 20.630 78.554 1.00 59.63 ? 38 ARG D CD 1 ATOM 6826 N NE . ARG E 2 38 ? 67.093 19.620 77.716 1.00 64.03 ? 38 ARG D NE 1 ATOM 6827 C CZ . ARG E 2 38 ? 67.733 18.885 76.812 1.00 68.45 ? 38 ARG D CZ 1 ATOM 6828 N NH1 . ARG E 2 38 ? 69.037 19.044 76.624 1.00 64.73 ? 38 ARG D NH1 1 ATOM 6829 N NH2 . ARG E 2 38 ? 67.068 17.990 76.095 1.00 74.09 ? 38 ARG D NH2 1 ATOM 6830 N N . GLN E 2 39 ? 65.373 24.582 79.607 1.00 68.43 ? 39 GLN D N 1 ATOM 6831 C CA . GLN E 2 39 ? 64.280 25.076 78.783 1.00 67.83 ? 39 GLN D CA 1 ATOM 6832 C C . GLN E 2 39 ? 64.773 25.468 77.398 1.00 70.09 ? 39 GLN D C 1 ATOM 6833 O O . GLN E 2 39 ? 65.501 26.449 77.244 1.00 72.47 ? 39 GLN D O 1 ATOM 6834 C CB . GLN E 2 39 ? 63.598 26.270 79.453 1.00 67.23 ? 39 GLN D CB 1 ATOM 6835 C CG . GLN E 2 39 ? 62.426 26.839 78.674 1.00 67.85 ? 39 GLN D CG 1 ATOM 6836 C CD . GLN E 2 39 ? 61.812 28.046 79.356 1.00 65.71 ? 39 GLN D CD 1 ATOM 6837 O OE1 . GLN E 2 39 ? 62.390 28.605 80.287 1.00 61.43 ? 39 GLN D OE1 1 ATOM 6838 N NE2 . GLN E 2 39 ? 60.632 28.452 78.898 1.00 66.99 ? 39 GLN D NE2 1 ATOM 6839 N N . ALA E 2 40 ? 64.379 24.688 76.397 1.00 68.19 ? 40 ALA D N 1 ATOM 6840 C CA . ALA E 2 40 ? 64.688 25.002 75.008 1.00 71.80 ? 40 ALA D CA 1 ATOM 6841 C C . ALA E 2 40 ? 64.052 26.334 74.618 1.00 78.43 ? 40 ALA D C 1 ATOM 6842 O O . ALA E 2 40 ? 62.989 26.686 75.134 1.00 82.35 ? 40 ALA D O 1 ATOM 6843 C CB . ALA E 2 40 ? 64.206 23.885 74.093 1.00 73.89 ? 40 ALA D CB 1 ATOM 6844 N N . PRO E 2 41 ? 64.709 27.085 73.717 1.00 92.65 ? 41 PRO D N 1 ATOM 6845 C CA . PRO E 2 41 ? 64.225 28.398 73.273 1.00 89.95 ? 41 PRO D CA 1 ATOM 6846 C C . PRO E 2 41 ? 62.800 28.361 72.729 1.00 91.28 ? 41 PRO D C 1 ATOM 6847 O O . PRO E 2 41 ? 62.549 27.743 71.694 1.00 97.06 ? 41 PRO D O 1 ATOM 6848 C CB . PRO E 2 41 ? 65.213 28.777 72.167 1.00 91.92 ? 41 PRO D CB 1 ATOM 6849 C CG . PRO E 2 41 ? 66.458 28.052 72.520 1.00 94.97 ? 41 PRO D CG 1 ATOM 6850 C CD . PRO E 2 41 ? 66.008 26.748 73.109 1.00 95.59 ? 41 PRO D CD 1 ATOM 6851 N N . GLY E 2 42 ? 61.882 29.018 73.430 1.00 89.21 ? 42 GLY D N 1 ATOM 6852 C CA . GLY E 2 42 ? 60.498 29.097 73.002 1.00 91.23 ? 42 GLY D CA 1 ATOM 6853 C C . GLY E 2 42 ? 59.706 27.841 73.305 1.00 90.00 ? 42 GLY D C 1 ATOM 6854 O O . GLY E 2 42 ? 58.613 27.644 72.774 1.00 92.66 ? 42 GLY D O 1 ATOM 6855 N N . GLN E 2 43 ? 60.255 26.989 74.165 1.00 84.56 ? 43 GLN D N 1 ATOM 6856 C CA . GLN E 2 43 ? 59.597 25.736 74.515 1.00 83.75 ? 43 GLN D CA 1 ATOM 6857 C C . GLN E 2 43 ? 59.342 25.633 76.016 1.00 78.76 ? 43 GLN D C 1 ATOM 6858 O O . GLN E 2 43 ? 59.646 26.556 76.772 1.00 75.02 ? 43 GLN D O 1 ATOM 6859 C CB . GLN E 2 43 ? 60.431 24.546 74.039 1.00 85.85 ? 43 GLN D CB 1 ATOM 6860 C CG . GLN E 2 43 ? 60.693 24.539 72.541 1.00 92.31 ? 43 GLN D CG 1 ATOM 6861 C CD . GLN E 2 43 ? 61.353 23.258 72.072 1.00 100.81 ? 43 GLN D CD 1 ATOM 6862 O OE1 . GLN E 2 43 ? 61.254 22.221 72.726 1.00 103.81 ? 43 GLN D OE1 1 ATOM 6863 N NE2 . GLN E 2 43 ? 62.034 23.326 70.934 1.00 104.75 ? 43 GLN D NE2 1 ATOM 6864 N N . GLY E 2 44 ? 58.782 24.504 76.438 1.00 80.19 ? 44 GLY D N 1 ATOM 6865 C CA . GLY E 2 44 ? 58.419 24.301 77.829 1.00 76.60 ? 44 GLY D CA 1 ATOM 6866 C C . GLY E 2 44 ? 59.579 23.888 78.715 1.00 76.09 ? 44 GLY D C 1 ATOM 6867 O O . GLY E 2 44 ? 60.740 23.945 78.308 1.00 75.50 ? 44 GLY D O 1 ATOM 6868 N N . LEU E 2 45 ? 59.255 23.467 79.935 1.00 74.46 ? 45 LEU D N 1 ATOM 6869 C CA . LEU E 2 45 ? 60.259 23.061 80.911 1.00 72.43 ? 45 LEU D CA 1 ATOM 6870 C C . LEU E 2 45 ? 60.520 21.559 80.862 1.00 72.54 ? 45 LEU D C 1 ATOM 6871 O O . LEU E 2 45 ? 59.675 20.784 80.416 1.00 72.85 ? 45 LEU D O 1 ATOM 6872 C CB . LEU E 2 45 ? 59.826 23.467 82.322 1.00 68.69 ? 45 LEU D CB 1 ATOM 6873 C CG . LEU E 2 45 ? 59.629 24.964 82.559 1.00 67.48 ? 45 LEU D CG 1 ATOM 6874 C CD1 . LEU E 2 45 ? 59.192 25.221 83.989 1.00 66.83 ? 45 LEU D CD1 1 ATOM 6875 C CD2 . LEU E 2 45 ? 60.903 25.728 82.240 1.00 65.95 ? 45 LEU D CD2 1 ATOM 6876 N N . GLU E 2 46 ? 61.696 21.156 81.333 1.00 71.09 ? 46 GLU D N 1 ATOM 6877 C CA . GLU E 2 46 ? 62.082 19.752 81.326 1.00 68.64 ? 46 GLU D CA 1 ATOM 6878 C C . GLU E 2 46 ? 63.051 19.442 82.460 1.00 63.46 ? 46 GLU D C 1 ATOM 6879 O O . GLU E 2 46 ? 64.176 19.940 82.485 1.00 62.22 ? 46 GLU D O 1 ATOM 6880 C CB . GLU E 2 46 ? 62.704 19.380 79.979 1.00 75.26 ? 46 GLU D CB 1 ATOM 6881 C CG . GLU E 2 46 ? 62.977 17.898 79.802 1.00 80.76 ? 46 GLU D CG 1 ATOM 6882 C CD . GLU E 2 46 ? 63.508 17.570 78.420 1.00 91.64 ? 46 GLU D CD 1 ATOM 6883 O OE1 . GLU E 2 46 ? 64.349 18.339 77.909 1.00 99.35 ? 46 GLU D OE1 1 ATOM 6884 O OE2 . GLU E 2 46 ? 63.078 16.551 77.841 1.00 92.49 ? 46 GLU D OE2 1 ATOM 6885 N N . TRP E 2 47 ? 62.599 18.619 83.400 1.00 62.20 ? 47 TRP D N 1 ATOM 6886 C CA . TRP E 2 47 ? 63.421 18.195 84.525 1.00 56.57 ? 47 TRP D CA 1 ATOM 6887 C C . TRP E 2 47 ? 64.507 17.221 84.072 1.00 68.73 ? 47 TRP D C 1 ATOM 6888 O O . TRP E 2 47 ? 64.217 16.203 83.441 1.00 69.37 ? 47 TRP D O 1 ATOM 6889 C CB . TRP E 2 47 ? 62.543 17.554 85.601 1.00 54.73 ? 47 TRP D CB 1 ATOM 6890 C CG . TRP E 2 47 ? 63.275 17.131 86.837 1.00 54.15 ? 47 TRP D CG 1 ATOM 6891 C CD1 . TRP E 2 47 ? 63.616 17.917 87.897 1.00 50.54 ? 47 TRP D CD1 1 ATOM 6892 C CD2 . TRP E 2 47 ? 63.740 15.811 87.151 1.00 59.53 ? 47 TRP D CD2 1 ATOM 6893 N NE1 . TRP E 2 47 ? 64.271 17.173 88.848 1.00 47.37 ? 47 TRP D NE1 1 ATOM 6894 C CE2 . TRP E 2 47 ? 64.360 15.877 88.414 1.00 50.01 ? 47 TRP D CE2 1 ATOM 6895 C CE3 . TRP E 2 47 ? 63.697 14.582 86.483 1.00 63.88 ? 47 TRP D CE3 1 ATOM 6896 C CZ2 . TRP E 2 47 ? 64.931 14.762 89.025 1.00 55.09 ? 47 TRP D CZ2 1 ATOM 6897 C CZ3 . TRP E 2 47 ? 64.266 13.476 87.091 1.00 63.38 ? 47 TRP D CZ3 1 ATOM 6898 C CH2 . TRP E 2 47 ? 64.875 13.575 88.349 1.00 57.43 ? 47 TRP D CH2 1 ATOM 6899 N N . MET E 2 48 ? 65.758 17.541 84.394 1.00 68.25 ? 48 MET D N 1 ATOM 6900 C CA . MET E 2 48 ? 66.887 16.703 84.003 1.00 72.23 ? 48 MET D CA 1 ATOM 6901 C C . MET E 2 48 ? 67.343 15.790 85.136 1.00 78.09 ? 48 MET D C 1 ATOM 6902 O O . MET E 2 48 ? 67.604 14.605 84.924 1.00 83.75 ? 48 MET D O 1 ATOM 6903 C CB . MET E 2 48 ? 68.061 17.566 83.540 1.00 72.23 ? 48 MET D CB 1 ATOM 6904 C CG . MET E 2 48 ? 67.767 18.425 82.325 1.00 77.41 ? 48 MET D CG 1 ATOM 6905 S SD . MET E 2 48 ? 69.258 19.213 81.693 1.00 96.18 ? 48 MET D SD 1 ATOM 6906 C CE . MET E 2 48 ? 69.896 19.961 83.189 1.00 82.50 ? 48 MET D CE 1 ATOM 6907 N N . GLY E 2 49 ? 67.449 16.347 86.338 1.00 74.85 ? 49 GLY D N 1 ATOM 6908 C CA . GLY E 2 49 ? 67.907 15.582 87.481 1.00 74.53 ? 49 GLY D CA 1 ATOM 6909 C C . GLY E 2 49 ? 67.986 16.388 88.762 1.00 75.74 ? 49 GLY D C 1 ATOM 6910 O O . GLY E 2 49 ? 67.687 17.583 88.778 1.00 78.40 ? 49 GLY D O 1 ATOM 6911 N N . GLY E 2 50 ? 68.395 15.727 89.841 1.00 73.28 ? 50 GLY D N 1 ATOM 6912 C CA . GLY E 2 50 ? 68.529 16.373 91.134 1.00 70.91 ? 50 GLY D CA 1 ATOM 6913 C C . GLY E 2 50 ? 69.592 15.714 91.994 1.00 74.51 ? 50 GLY D C 1 ATOM 6914 O O . GLY E 2 50 ? 70.181 14.707 91.602 1.00 78.04 ? 50 GLY D O 1 ATOM 6915 N N . ILE E 2 51 ? 69.836 16.282 93.171 1.00 72.01 ? 51 ILE D N 1 ATOM 6916 C CA . ILE E 2 51 ? 70.841 15.747 94.083 1.00 70.32 ? 51 ILE D CA 1 ATOM 6917 C C . ILE E 2 51 ? 70.558 16.171 95.526 1.00 66.89 ? 51 ILE D C 1 ATOM 6918 O O . ILE E 2 51 ? 69.918 17.196 95.770 1.00 59.76 ? 51 ILE D O 1 ATOM 6919 C CB . ILE E 2 51 ? 72.266 16.200 93.675 1.00 72.32 ? 51 ILE D CB 1 ATOM 6920 C CG1 . ILE E 2 51 ? 73.331 15.352 94.376 1.00 73.39 ? 51 ILE D CG1 1 ATOM 6921 C CG2 . ILE E 2 51 ? 72.466 17.689 93.940 1.00 69.59 ? 51 ILE D CG2 1 ATOM 6922 C CD1 . ILE E 2 51 ? 74.743 15.792 94.093 1.00 75.31 ? 51 ILE D CD1 1 ATOM 6923 N N . ILE E 2 52 ? 71.022 15.364 96.477 1.00 67.40 ? 52 ILE D N 1 ATOM 6924 C CA . ILE E 2 52 ? 70.889 15.673 97.896 1.00 65.91 ? 52 ILE D CA 1 ATOM 6925 C C . ILE E 2 52 ? 72.231 16.103 98.480 1.00 64.63 ? 52 ILE D C 1 ATOM 6926 O O . ILE E 2 52 ? 73.092 15.264 98.734 1.00 67.26 ? 52 ILE D O 1 ATOM 6927 C CB . ILE E 2 52 ? 70.358 14.467 98.687 1.00 69.51 ? 52 ILE D CB 1 ATOM 6928 C CG1 . ILE E 2 52 ? 69.062 13.948 98.062 1.00 70.17 ? 52 ILE D CG1 1 ATOM 6929 C CG2 . ILE E 2 52 ? 70.143 14.840 100.144 1.00 68.57 ? 52 ILE D CG2 1 ATOM 6930 C CD1 . ILE E 2 52 ? 68.600 12.630 98.635 1.00 73.63 ? 52 ILE D CD1 1 ATOM 6931 N N . PRO E 2 53 A 72.405 17.416 98.697 1.00 66.79 ? 52 PRO D N 1 ATOM 6932 C CA . PRO E 2 53 A 73.663 18.025 99.153 1.00 71.32 ? 52 PRO D CA 1 ATOM 6933 C C . PRO E 2 53 A 74.227 17.405 100.431 1.00 72.88 ? 52 PRO D C 1 ATOM 6934 O O . PRO E 2 53 A 75.441 17.420 100.628 1.00 72.37 ? 52 PRO D O 1 ATOM 6935 C CB . PRO E 2 53 A 73.272 19.486 99.398 1.00 73.84 ? 52 PRO D CB 1 ATOM 6936 C CG . PRO E 2 53 A 72.107 19.717 98.503 1.00 71.68 ? 52 PRO D CG 1 ATOM 6937 C CD . PRO E 2 53 A 71.349 18.423 98.492 1.00 68.51 ? 52 PRO D CD 1 ATOM 6938 N N . ILE E 2 54 ? 73.357 16.869 101.280 1.00 76.00 ? 53 ILE D N 1 ATOM 6939 C CA . ILE E 2 54 ? 73.785 16.286 102.548 1.00 77.82 ? 53 ILE D CA 1 ATOM 6940 C C . ILE E 2 54 ? 74.400 14.898 102.368 1.00 78.58 ? 53 ILE D C 1 ATOM 6941 O O . ILE E 2 54 ? 75.441 14.589 102.949 1.00 81.32 ? 53 ILE D O 1 ATOM 6942 C CB . ILE E 2 54 ? 72.608 16.186 103.539 1.00 79.37 ? 53 ILE D CB 1 ATOM 6943 C CG1 . ILE E 2 54 ? 71.975 17.562 103.749 1.00 81.11 ? 53 ILE D CG1 1 ATOM 6944 C CG2 . ILE E 2 54 ? 73.071 15.607 104.868 1.00 80.75 ? 53 ILE D CG2 1 ATOM 6945 C CD1 . ILE E 2 54 ? 72.929 18.580 104.318 1.00 82.65 ? 53 ILE D CD1 1 ATOM 6946 N N . PHE E 2 55 ? 73.752 14.068 101.560 1.00 75.31 ? 54 PHE D N 1 ATOM 6947 C CA . PHE E 2 55 ? 74.187 12.688 101.376 1.00 74.83 ? 54 PHE D CA 1 ATOM 6948 C C . PHE E 2 55 ? 74.992 12.505 100.092 1.00 78.66 ? 54 PHE D C 1 ATOM 6949 O O . PHE E 2 55 ? 75.932 11.711 100.047 1.00 81.19 ? 54 PHE D O 1 ATOM 6950 C CB . PHE E 2 55 ? 72.977 11.752 101.370 1.00 68.75 ? 54 PHE D CB 1 ATOM 6951 C CG . PHE E 2 55 ? 72.148 11.827 102.620 1.00 59.76 ? 54 PHE D CG 1 ATOM 6952 C CD1 . PHE E 2 55 ? 72.744 12.044 103.851 1.00 60.93 ? 54 PHE D CD1 1 ATOM 6953 C CD2 . PHE E 2 55 ? 70.773 11.688 102.563 1.00 54.70 ? 54 PHE D CD2 1 ATOM 6954 C CE1 . PHE E 2 55 ? 71.985 12.115 105.001 1.00 60.25 ? 54 PHE D CE1 1 ATOM 6955 C CE2 . PHE E 2 55 ? 70.007 11.759 103.710 1.00 55.34 ? 54 PHE D CE2 1 ATOM 6956 C CZ . PHE E 2 55 ? 70.613 11.973 104.931 1.00 58.08 ? 54 PHE D CZ 1 ATOM 6957 N N . GLY E 2 56 ? 74.620 13.243 99.052 1.00 79.35 ? 55 GLY D N 1 ATOM 6958 C CA . GLY E 2 56 ? 75.278 13.131 97.764 1.00 81.32 ? 55 GLY D CA 1 ATOM 6959 C C . GLY E 2 56 ? 74.462 12.305 96.789 1.00 82.20 ? 55 GLY D C 1 ATOM 6960 O O . GLY E 2 56 ? 74.881 12.069 95.656 1.00 86.21 ? 55 GLY D O 1 ATOM 6961 N N . THR E 2 57 ? 73.291 11.864 97.236 1.00 81.65 ? 56 THR D N 1 ATOM 6962 C CA . THR E 2 57 ? 72.406 11.049 96.412 1.00 81.88 ? 56 THR D CA 1 ATOM 6963 C C . THR E 2 57 ? 71.865 11.841 95.227 1.00 82.31 ? 56 THR D C 1 ATOM 6964 O O . THR E 2 57 ? 71.055 12.754 95.395 1.00 79.16 ? 56 THR D O 1 ATOM 6965 C CB . THR E 2 57 ? 71.223 10.500 97.226 1.00 80.96 ? 56 THR D CB 1 ATOM 6966 O OG1 . THR E 2 57 ? 71.716 9.722 98.323 1.00 89.12 ? 56 THR D OG1 1 ATOM 6967 C CG2 . THR E 2 57 ? 70.329 9.632 96.352 1.00 79.51 ? 56 THR D CG2 1 ATOM 6968 N N . ALA E 2 58 ? 72.315 11.483 94.030 1.00 83.41 ? 57 ALA D N 1 ATOM 6969 C CA . ALA E 2 58 ? 71.877 12.158 92.817 1.00 79.19 ? 57 ALA D CA 1 ATOM 6970 C C . ALA E 2 58 ? 70.872 11.306 92.050 1.00 76.05 ? 57 ALA D C 1 ATOM 6971 O O . ALA E 2 58 ? 71.028 10.091 91.942 1.00 78.41 ? 57 ALA D O 1 ATOM 6972 C CB . ALA E 2 58 ? 73.072 12.493 91.936 1.00 79.08 ? 57 ALA D CB 1 ATOM 6973 N N . SER E 2 59 ? 69.836 11.952 91.526 1.00 72.86 ? 58 SER D N 1 ATOM 6974 C CA . SER E 2 59 ? 68.842 11.272 90.706 1.00 73.08 ? 58 SER D CA 1 ATOM 6975 C C . SER E 2 59 ? 68.845 11.839 89.294 1.00 72.14 ? 58 SER D C 1 ATOM 6976 O O . SER E 2 59 ? 68.796 13.052 89.106 1.00 69.02 ? 58 SER D O 1 ATOM 6977 C CB . SER E 2 59 ? 67.448 11.399 91.323 1.00 76.19 ? 58 SER D CB 1 ATOM 6978 O OG . SER E 2 59 ? 67.410 10.819 92.615 1.00 82.06 ? 58 SER D OG 1 ATOM 6979 N N . TYR E 2 60 ? 68.906 10.957 88.303 1.00 79.38 ? 59 TYR D N 1 ATOM 6980 C CA . TYR E 2 60 ? 68.938 11.381 86.909 1.00 84.35 ? 59 TYR D CA 1 ATOM 6981 C C . TYR E 2 60 ? 67.731 10.866 86.137 1.00 88.29 ? 59 TYR D C 1 ATOM 6982 O O . TYR E 2 60 ? 67.305 9.725 86.320 1.00 88.97 ? 59 TYR D O 1 ATOM 6983 C CB . TYR E 2 60 ? 70.227 10.907 86.234 1.00 87.16 ? 59 TYR D CB 1 ATOM 6984 C CG . TYR E 2 60 ? 71.485 11.371 86.929 1.00 85.02 ? 59 TYR D CG 1 ATOM 6985 C CD1 . TYR E 2 60 ? 71.868 12.703 86.892 1.00 85.90 ? 59 TYR D CD1 1 ATOM 6986 C CD2 . TYR E 2 60 ? 72.292 10.477 87.619 1.00 83.75 ? 59 TYR D CD2 1 ATOM 6987 C CE1 . TYR E 2 60 ? 73.015 13.135 87.524 1.00 86.10 ? 59 TYR D CE1 1 ATOM 6988 C CE2 . TYR E 2 60 ? 73.444 10.900 88.256 1.00 84.25 ? 59 TYR D CE2 1 ATOM 6989 C CZ . TYR E 2 60 ? 73.800 12.231 88.204 1.00 86.77 ? 59 TYR D CZ 1 ATOM 6990 O OH . TYR E 2 60 ? 74.944 12.663 88.835 1.00 90.20 ? 59 TYR D OH 1 ATOM 6991 N N . ALA E 2 61 ? 67.184 11.716 85.274 1.00 92.36 ? 60 ALA D N 1 ATOM 6992 C CA . ALA E 2 61 ? 66.090 11.317 84.399 1.00 94.19 ? 60 ALA D CA 1 ATOM 6993 C C . ALA E 2 61 ? 66.555 10.213 83.459 1.00 101.49 ? 60 ALA D C 1 ATOM 6994 O O . ALA E 2 61 ? 67.752 10.055 83.219 1.00 108.58 ? 60 ALA D O 1 ATOM 6995 C CB . ALA E 2 61 ? 65.571 12.506 83.611 1.00 92.77 ? 60 ALA D CB 1 ATOM 6996 N N . GLN E 2 62 ? 65.605 9.451 82.930 1.00 100.49 ? 61 GLN D N 1 ATOM 6997 C CA . GLN E 2 62 ? 65.929 8.305 82.091 1.00 101.79 ? 61 GLN D CA 1 ATOM 6998 C C . GLN E 2 62 ? 66.644 8.725 80.808 1.00 103.33 ? 61 GLN D C 1 ATOM 6999 O O . GLN E 2 62 ? 67.482 7.988 80.289 1.00 108.55 ? 61 GLN D O 1 ATOM 7000 C CB . GLN E 2 62 ? 64.658 7.520 81.760 1.00 104.56 ? 61 GLN D CB 1 ATOM 7001 C CG . GLN E 2 62 ? 64.908 6.150 81.153 1.00 112.15 ? 61 GLN D CG 1 ATOM 7002 C CD . GLN E 2 62 ? 63.636 5.338 81.017 1.00 116.90 ? 61 GLN D CD 1 ATOM 7003 O OE1 . GLN E 2 62 ? 62.551 5.801 81.372 1.00 116.97 ? 61 GLN D OE1 1 ATOM 7004 N NE2 . GLN E 2 62 ? 63.761 4.119 80.504 1.00 122.10 ? 61 GLN D NE2 1 ATOM 7005 N N . LYS E 2 63 ? 66.321 9.914 80.307 1.00 100.48 ? 62 LYS D N 1 ATOM 7006 C CA . LYS E 2 63 ? 66.928 10.415 79.076 1.00 102.79 ? 62 LYS D CA 1 ATOM 7007 C C . LYS E 2 63 ? 68.396 10.772 79.273 1.00 109.29 ? 62 LYS D C 1 ATOM 7008 O O . LYS E 2 63 ? 69.258 10.354 78.500 1.00 113.32 ? 62 LYS D O 1 ATOM 7009 C CB . LYS E 2 63 ? 66.171 11.639 78.559 1.00 93.51 ? 62 LYS D CB 1 ATOM 7010 C CG . LYS E 2 63 ? 64.701 11.398 78.279 1.00 91.72 ? 62 LYS D CG 1 ATOM 7011 C CD . LYS E 2 63 ? 64.208 12.306 77.164 1.00 95.07 ? 62 LYS D CD 1 ATOM 7012 C CE . LYS E 2 63 ? 64.608 13.752 77.406 1.00 91.04 ? 62 LYS D CE 1 ATOM 7013 N NZ . LYS E 2 63 ? 64.181 14.641 76.288 1.00 92.41 ? 62 LYS D NZ 1 ATOM 7014 N N . PHE E 2 64 ? 68.671 11.552 80.311 1.00 111.41 ? 63 PHE D N 1 ATOM 7015 C CA . PHE E 2 64 ? 70.028 11.992 80.604 1.00 113.85 ? 63 PHE D CA 1 ATOM 7016 C C . PHE E 2 64 ? 70.708 11.032 81.574 1.00 114.89 ? 63 PHE D C 1 ATOM 7017 O O . PHE E 2 64 ? 71.588 11.427 82.339 1.00 116.51 ? 63 PHE D O 1 ATOM 7018 C CB . PHE E 2 64 ? 70.017 13.408 81.184 1.00 110.68 ? 63 PHE D CB 1 ATOM 7019 C CG . PHE E 2 64 ? 69.143 14.368 80.429 1.00 113.75 ? 63 PHE D CG 1 ATOM 7020 C CD1 . PHE E 2 64 ? 69.620 15.027 79.308 1.00 118.34 ? 63 PHE D CD1 1 ATOM 7021 C CD2 . PHE E 2 64 ? 67.845 14.618 80.846 1.00 112.05 ? 63 PHE D CD2 1 ATOM 7022 C CE1 . PHE E 2 64 ? 68.818 15.914 78.613 1.00 119.81 ? 63 PHE D CE1 1 ATOM 7023 C CE2 . PHE E 2 64 ? 67.037 15.503 80.155 1.00 113.09 ? 63 PHE D CE2 1 ATOM 7024 C CZ . PHE E 2 64 ? 67.524 16.152 79.038 1.00 117.25 ? 63 PHE D CZ 1 ATOM 7025 N N . GLN E 2 65 ? 70.290 9.770 81.535 1.00 114.50 ? 64 GLN D N 1 ATOM 7026 C CA . GLN E 2 65 ? 70.793 8.754 82.452 1.00 111.31 ? 64 GLN D CA 1 ATOM 7027 C C . GLN E 2 65 ? 72.300 8.549 82.319 1.00 113.21 ? 64 GLN D C 1 ATOM 7028 O O . GLN E 2 65 ? 73.031 8.602 83.308 1.00 113.05 ? 64 GLN D O 1 ATOM 7029 C CB . GLN E 2 65 ? 70.066 7.428 82.221 1.00 113.38 ? 64 GLN D CB 1 ATOM 7030 C CG . GLN E 2 65 ? 70.535 6.293 83.116 1.00 113.53 ? 64 GLN D CG 1 ATOM 7031 C CD . GLN E 2 65 ? 70.151 6.496 84.567 1.00 108.15 ? 64 GLN D CD 1 ATOM 7032 O OE1 . GLN E 2 65 ? 69.165 7.167 84.871 1.00 107.53 ? 64 GLN D OE1 1 ATOM 7033 N NE2 . GLN E 2 65 ? 70.930 5.917 85.473 1.00 105.65 ? 64 GLN D NE2 1 ATOM 7034 N N . GLY E 2 66 ? 72.758 8.315 81.094 1.00 114.17 ? 65 GLY D N 1 ATOM 7035 C CA . GLY E 2 66 ? 74.165 8.058 80.851 1.00 116.18 ? 65 GLY D CA 1 ATOM 7036 C C . GLY E 2 66 ? 74.876 9.209 80.168 1.00 116.24 ? 65 GLY D C 1 ATOM 7037 O O . GLY E 2 66 ? 75.856 9.004 79.454 1.00 121.79 ? 65 GLY D O 1 ATOM 7038 N N . ARG E 2 67 ? 74.385 10.424 80.389 1.00 111.65 ? 66 ARG D N 1 ATOM 7039 C CA . ARG E 2 67 ? 74.976 11.607 79.770 1.00 111.33 ? 66 ARG D CA 1 ATOM 7040 C C . ARG E 2 67 ? 75.346 12.672 80.796 1.00 107.71 ? 66 ARG D C 1 ATOM 7041 O O . ARG E 2 67 ? 76.468 13.179 80.797 1.00 110.54 ? 66 ARG D O 1 ATOM 7042 C CB . ARG E 2 67 ? 74.020 12.197 78.730 1.00 107.88 ? 66 ARG D CB 1 ATOM 7043 C CG . ARG E 2 67 ? 74.381 11.856 77.294 1.00 110.82 ? 66 ARG D CG 1 ATOM 7044 C CD . ARG E 2 67 ? 73.256 12.219 76.337 1.00 110.44 ? 66 ARG D CD 1 ATOM 7045 N NE . ARG E 2 67 ? 72.806 13.597 76.510 1.00 105.42 ? 66 ARG D NE 1 ATOM 7046 C CZ . ARG E 2 67 ? 73.307 14.637 75.852 1.00 105.18 ? 66 ARG D CZ 1 ATOM 7047 N NH1 . ARG E 2 67 ? 74.283 14.461 74.974 1.00 110.37 ? 66 ARG D NH1 1 ATOM 7048 N NH2 . ARG E 2 67 ? 72.832 15.855 76.075 1.00 102.35 ? 66 ARG D NH2 1 ATOM 7049 N N . VAL E 2 68 ? 74.402 13.008 81.668 1.00 102.05 ? 67 VAL D N 1 ATOM 7050 C CA . VAL E 2 68 ? 74.607 14.086 82.627 1.00 98.74 ? 67 VAL D CA 1 ATOM 7051 C C . VAL E 2 68 ? 75.056 13.555 83.990 1.00 96.74 ? 67 VAL D C 1 ATOM 7052 O O . VAL E 2 68 ? 74.815 12.395 84.332 1.00 97.06 ? 67 VAL D O 1 ATOM 7053 C CB . VAL E 2 68 ? 73.323 14.931 82.795 1.00 98.70 ? 67 VAL D CB 1 ATOM 7054 C CG1 . VAL E 2 68 ? 72.367 14.273 83.777 1.00 95.87 ? 67 VAL D CG1 1 ATOM 7055 C CG2 . VAL E 2 68 ? 73.664 16.343 83.248 1.00 98.91 ? 67 VAL D CG2 1 ATOM 7056 N N . THR E 2 69 ? 75.726 14.411 84.756 1.00 94.00 ? 68 THR D N 1 ATOM 7057 C CA . THR E 2 69 ? 76.192 14.063 86.093 1.00 87.86 ? 68 THR D CA 1 ATOM 7058 C C . THR E 2 69 ? 76.074 15.273 87.018 1.00 82.03 ? 68 THR D C 1 ATOM 7059 O O . THR E 2 69 ? 76.543 16.363 86.691 1.00 82.21 ? 68 THR D O 1 ATOM 7060 C CB . THR E 2 69 ? 77.650 13.560 86.070 1.00 87.48 ? 68 THR D CB 1 ATOM 7061 O OG1 . THR E 2 69 ? 77.729 12.354 85.300 1.00 90.36 ? 68 THR D OG1 1 ATOM 7062 C CG2 . THR E 2 69 ? 78.145 13.281 87.478 1.00 82.89 ? 68 THR D CG2 1 ATOM 7063 N N . ILE E 2 70 ? 75.440 15.077 88.169 1.00 78.42 ? 69 ILE D N 1 ATOM 7064 C CA . ILE E 2 70 ? 75.205 16.169 89.105 1.00 77.51 ? 69 ILE D CA 1 ATOM 7065 C C . ILE E 2 70 ? 75.953 15.957 90.419 1.00 78.53 ? 69 ILE D C 1 ATOM 7066 O O . ILE E 2 70 ? 75.803 14.924 91.069 1.00 81.85 ? 69 ILE D O 1 ATOM 7067 C CB . ILE E 2 70 ? 73.703 16.333 89.397 1.00 77.66 ? 69 ILE D CB 1 ATOM 7068 C CG1 . ILE E 2 70 ? 72.943 16.635 88.103 1.00 77.39 ? 69 ILE D CG1 1 ATOM 7069 C CG2 . ILE E 2 70 ? 73.473 17.433 90.422 1.00 77.81 ? 69 ILE D CG2 1 ATOM 7070 C CD1 . ILE E 2 70 ? 71.442 16.668 88.268 1.00 73.59 ? 69 ILE D CD1 1 ATOM 7071 N N . THR E 2 71 ? 76.762 16.942 90.799 1.00 76.48 ? 70 THR D N 1 ATOM 7072 C CA . THR E 2 71 ? 77.525 16.880 92.041 1.00 77.27 ? 70 THR D CA 1 ATOM 7073 C C . THR E 2 71 ? 77.258 18.134 92.872 1.00 77.66 ? 70 THR D C 1 ATOM 7074 O O . THR E 2 71 ? 76.729 19.120 92.362 1.00 80.55 ? 70 THR D O 1 ATOM 7075 C CB . THR E 2 71 ? 79.038 16.744 91.769 1.00 82.00 ? 70 THR D CB 1 ATOM 7076 O OG1 . THR E 2 71 ? 79.244 15.979 90.576 1.00 85.64 ? 70 THR D OG1 1 ATOM 7077 C CG2 . THR E 2 71 ? 79.744 16.057 92.935 1.00 82.81 ? 70 THR D CG2 1 ATOM 7078 N N . ALA E 2 72 ? 77.616 18.092 94.152 1.00 79.38 ? 71 ALA D N 1 ATOM 7079 C CA . ALA E 2 72 ? 77.428 19.237 95.036 1.00 80.09 ? 71 ALA D CA 1 ATOM 7080 C C . ALA E 2 72 ? 78.465 19.253 96.159 1.00 86.85 ? 71 ALA D C 1 ATOM 7081 O O . ALA E 2 72 ? 78.706 18.235 96.808 1.00 91.01 ? 71 ALA D O 1 ATOM 7082 C CB . ALA E 2 72 ? 76.019 19.230 95.615 1.00 75.06 ? 71 ALA D CB 1 ATOM 7083 N N . ASP E 2 73 ? 79.079 20.412 96.377 1.00 89.03 ? 72 ASP D N 1 ATOM 7084 C CA . ASP E 2 73 ? 80.022 20.587 97.479 1.00 93.64 ? 72 ASP D CA 1 ATOM 7085 C C . ASP E 2 73 ? 79.357 21.308 98.646 1.00 95.59 ? 72 ASP D C 1 ATOM 7086 O O . ASP E 2 73 ? 79.092 22.506 98.572 1.00 93.88 ? 72 ASP D O 1 ATOM 7087 C CB . ASP E 2 73 ? 81.259 21.362 97.020 1.00 94.75 ? 72 ASP D CB 1 ATOM 7088 C CG . ASP E 2 73 ? 82.183 20.528 96.155 1.00 97.96 ? 72 ASP D CG 1 ATOM 7089 O OD1 . ASP E 2 73 ? 82.291 19.309 96.402 1.00 95.31 ? 72 ASP D OD1 1 ATOM 7090 O OD2 . ASP E 2 73 ? 82.802 21.092 95.228 1.00 104.62 ? 72 ASP D OD2 1 ATOM 7091 N N . LYS E 2 74 ? 79.094 20.575 99.724 1.00 101.21 ? 73 LYS D N 1 ATOM 7092 C CA . LYS E 2 74 ? 78.412 21.143 100.881 1.00 102.44 ? 73 LYS D CA 1 ATOM 7093 C C . LYS E 2 74 ? 79.321 22.110 101.638 1.00 105.58 ? 73 LYS D C 1 ATOM 7094 O O . LYS E 2 74 ? 78.851 22.924 102.434 1.00 106.95 ? 73 LYS D O 1 ATOM 7095 C CB . LYS E 2 74 ? 77.922 20.033 101.815 1.00 105.94 ? 73 LYS D CB 1 ATOM 7096 C CG . LYS E 2 74 ? 76.872 20.487 102.824 1.00 107.19 ? 73 LYS D CG 1 ATOM 7097 C CD . LYS E 2 74 ? 75.657 21.082 102.124 1.00 103.92 ? 73 LYS D CD 1 ATOM 7098 C CE . LYS E 2 74 ? 74.658 21.648 103.122 1.00 101.25 ? 73 LYS D CE 1 ATOM 7099 N NZ . LYS E 2 74 ? 75.233 22.776 103.904 1.00 103.55 ? 73 LYS D NZ 1 ATOM 7100 N N . SER E 2 75 ? 80.622 22.022 101.381 1.00 127.15 ? 74 SER D N 1 ATOM 7101 C CA . SER E 2 75 ? 81.587 22.919 102.007 1.00 130.91 ? 74 SER D CA 1 ATOM 7102 C C . SER E 2 75 ? 81.438 24.343 101.477 1.00 126.19 ? 74 SER D C 1 ATOM 7103 O O . SER E 2 75 ? 81.519 25.310 102.235 1.00 130.15 ? 74 SER D O 1 ATOM 7104 C CB . SER E 2 75 ? 83.015 22.420 101.774 1.00 135.77 ? 74 SER D CB 1 ATOM 7105 O OG . SER E 2 75 ? 83.327 22.397 100.391 1.00 134.16 ? 74 SER D OG 1 ATOM 7106 N N . THR E 2 76 ? 81.219 24.462 100.171 1.00 120.42 ? 75 THR D N 1 ATOM 7107 C CA . THR E 2 76 ? 81.069 25.763 99.531 1.00 116.08 ? 75 THR D CA 1 ATOM 7108 C C . THR E 2 76 ? 79.612 26.043 99.180 1.00 110.75 ? 75 THR D C 1 ATOM 7109 O O . THR E 2 76 ? 79.283 27.116 98.671 1.00 106.26 ? 75 THR D O 1 ATOM 7110 C CB . THR E 2 76 ? 81.918 25.862 98.254 1.00 110.37 ? 75 THR D CB 1 ATOM 7111 O OG1 . THR E 2 76 ? 81.474 24.884 97.305 1.00 103.35 ? 75 THR D OG1 1 ATOM 7112 C CG2 . THR E 2 76 ? 83.384 25.622 98.573 1.00 112.60 ? 75 THR D CG2 1 ATOM 7113 N N . SER E 2 77 ? 78.754 25.064 99.455 1.00 112.11 ? 76 SER D N 1 ATOM 7114 C CA . SER E 2 77 ? 77.322 25.154 99.173 1.00 108.41 ? 76 SER D CA 1 ATOM 7115 C C . SER E 2 77 ? 77.057 25.465 97.702 1.00 104.97 ? 76 SER D C 1 ATOM 7116 O O . SER E 2 77 ? 76.225 26.311 97.376 1.00 104.68 ? 76 SER D O 1 ATOM 7117 C CB . SER E 2 77 ? 76.662 26.209 100.065 1.00 112.44 ? 76 SER D CB 1 ATOM 7118 O OG . SER E 2 77 ? 75.254 26.196 99.913 1.00 111.06 ? 76 SER D OG 1 ATOM 7119 N N . THR E 2 78 ? 77.775 24.777 96.819 1.00 101.39 ? 77 THR D N 1 ATOM 7120 C CA . THR E 2 78 ? 77.600 24.952 95.382 1.00 90.30 ? 77 THR D CA 1 ATOM 7121 C C . THR E 2 78 ? 77.197 23.639 94.719 1.00 80.76 ? 77 THR D C 1 ATOM 7122 O O . THR E 2 78 ? 77.709 22.574 95.064 1.00 74.95 ? 77 THR D O 1 ATOM 7123 C CB . THR E 2 78 ? 78.884 25.482 94.710 1.00 88.81 ? 77 THR D CB 1 ATOM 7124 O OG1 . THR E 2 78 ? 79.915 24.490 94.788 1.00 92.24 ? 77 THR D OG1 1 ATOM 7125 C CG2 . THR E 2 78 ? 79.360 26.755 95.390 1.00 88.81 ? 77 THR D CG2 1 ATOM 7126 N N . ALA E 2 79 ? 76.272 23.722 93.768 1.00 81.03 ? 78 ALA D N 1 ATOM 7127 C CA . ALA E 2 79 ? 75.838 22.552 93.015 1.00 77.73 ? 78 ALA D CA 1 ATOM 7128 C C . ALA E 2 79 ? 76.384 22.609 91.594 1.00 80.89 ? 78 ALA D C 1 ATOM 7129 O O . ALA E 2 79 ? 76.563 23.691 91.036 1.00 85.11 ? 78 ALA D O 1 ATOM 7130 C CB . ALA E 2 79 ? 74.320 22.456 93.002 1.00 74.21 ? 78 ALA D CB 1 ATOM 7131 N N . TYR E 2 80 ? 76.652 21.444 91.013 1.00 79.23 ? 79 TYR D N 1 ATOM 7132 C CA . TYR E 2 80 ? 77.186 21.377 89.657 1.00 81.18 ? 79 TYR D CA 1 ATOM 7133 C C . TYR E 2 80 ? 76.378 20.433 88.773 1.00 80.04 ? 79 TYR D C 1 ATOM 7134 O O . TYR E 2 80 ? 75.733 19.503 89.259 1.00 77.62 ? 79 TYR D O 1 ATOM 7135 C CB . TYR E 2 80 ? 78.651 20.935 89.677 1.00 83.77 ? 79 TYR D CB 1 ATOM 7136 C CG . TYR E 2 80 ? 79.578 21.871 90.421 1.00 83.89 ? 79 TYR D CG 1 ATOM 7137 C CD1 . TYR E 2 80 ? 80.107 22.996 89.802 1.00 82.30 ? 79 TYR D CD1 1 ATOM 7138 C CD2 . TYR E 2 80 ? 79.932 21.622 91.741 1.00 85.56 ? 79 TYR D CD2 1 ATOM 7139 C CE1 . TYR E 2 80 ? 80.958 23.851 90.479 1.00 85.67 ? 79 TYR D CE1 1 ATOM 7140 C CE2 . TYR E 2 80 ? 80.783 22.471 92.426 1.00 88.75 ? 79 TYR D CE2 1 ATOM 7141 C CZ . TYR E 2 80 ? 81.293 23.584 91.791 1.00 88.77 ? 79 TYR D CZ 1 ATOM 7142 O OH . TYR E 2 80 ? 82.140 24.431 92.470 1.00 90.84 ? 79 TYR D OH 1 ATOM 7143 N N . MET E 2 81 ? 76.421 20.682 87.470 1.00 81.74 ? 80 MET D N 1 ATOM 7144 C CA . MET E 2 81 ? 75.754 19.829 86.495 1.00 82.61 ? 80 MET D CA 1 ATOM 7145 C C . MET E 2 81 ? 76.588 19.756 85.223 1.00 82.30 ? 80 MET D C 1 ATOM 7146 O O . MET E 2 81 ? 76.767 20.756 84.530 1.00 80.51 ? 80 MET D O 1 ATOM 7147 C CB . MET E 2 81 ? 74.347 20.350 86.191 1.00 82.25 ? 80 MET D CB 1 ATOM 7148 C CG . MET E 2 81 ? 73.535 19.479 85.237 1.00 82.74 ? 80 MET D CG 1 ATOM 7149 S SD . MET E 2 81 ? 73.774 19.878 83.491 1.00 78.86 ? 80 MET D SD 1 ATOM 7150 C CE . MET E 2 81 ? 73.318 21.610 83.473 1.00 79.21 ? 80 MET D CE 1 ATOM 7151 N N . GLU E 2 82 ? 77.099 18.566 84.922 1.00 84.49 ? 81 GLU D N 1 ATOM 7152 C CA . GLU E 2 82 ? 77.963 18.381 83.764 1.00 88.04 ? 81 GLU D CA 1 ATOM 7153 C C . GLU E 2 82 ? 77.276 17.554 82.679 1.00 89.35 ? 81 GLU D C 1 ATOM 7154 O O . GLU E 2 82 ? 77.027 16.362 82.855 1.00 90.18 ? 81 GLU D O 1 ATOM 7155 C CB . GLU E 2 82 ? 79.278 17.721 84.182 1.00 90.57 ? 81 GLU D CB 1 ATOM 7156 C CG . GLU E 2 82 ? 80.325 17.677 83.083 1.00 94.20 ? 81 GLU D CG 1 ATOM 7157 C CD . GLU E 2 82 ? 81.678 17.219 83.588 1.00 99.54 ? 81 GLU D CD 1 ATOM 7158 O OE1 . GLU E 2 82 ? 82.606 17.086 82.762 1.00 106.07 ? 81 GLU D OE1 1 ATOM 7159 O OE2 . GLU E 2 82 ? 81.815 16.994 84.810 1.00 97.48 ? 81 GLU D OE2 1 ATOM 7160 N N . LEU E 2 83 ? 76.973 18.199 81.557 1.00 87.07 ? 82 LEU D N 1 ATOM 7161 C CA . LEU E 2 83 ? 76.313 17.532 80.442 1.00 83.41 ? 82 LEU D CA 1 ATOM 7162 C C . LEU E 2 83 ? 77.296 17.303 79.299 1.00 85.69 ? 82 LEU D C 1 ATOM 7163 O O . LEU E 2 83 ? 77.723 18.250 78.638 1.00 89.24 ? 82 LEU D O 1 ATOM 7164 C CB . LEU E 2 83 ? 75.114 18.353 79.962 1.00 76.50 ? 82 LEU D CB 1 ATOM 7165 C CG . LEU E 2 83 ? 74.233 17.731 78.877 1.00 76.10 ? 82 LEU D CG 1 ATOM 7166 C CD1 . LEU E 2 83 ? 73.682 16.392 79.338 1.00 80.13 ? 82 LEU D CD1 1 ATOM 7167 C CD2 . LEU E 2 83 ? 73.102 18.676 78.503 1.00 70.04 ? 82 LEU D CD2 1 ATOM 7168 N N . SER E 2 84 A 77.656 16.043 79.075 1.00 86.55 ? 82 SER D N 1 ATOM 7169 C CA . SER E 2 84 A 78.633 15.699 78.047 1.00 91.57 ? 82 SER D CA 1 ATOM 7170 C C . SER E 2 84 A 77.956 15.208 76.772 1.00 97.64 ? 82 SER D C 1 ATOM 7171 O O . SER E 2 84 A 76.735 15.033 76.739 1.00 98.97 ? 82 SER D O 1 ATOM 7172 C CB . SER E 2 84 A 79.606 14.637 78.567 1.00 93.93 ? 82 SER D CB 1 ATOM 7173 O OG . SER E 2 84 A 78.922 13.457 78.953 1.00 93.13 ? 82 SER D OG 1 ATOM 7174 N N . SER E 2 85 B 78.762 14.990 75.734 1.00 100.68 ? 82 SER D N 1 ATOM 7175 C CA . SER E 2 85 B 78.280 14.543 74.428 1.00 93.44 ? 82 SER D CA 1 ATOM 7176 C C . SER E 2 85 B 77.173 15.453 73.905 1.00 107.64 ? 82 SER D C 1 ATOM 7177 O O . SER E 2 85 B 76.115 14.984 73.484 1.00 91.86 ? 82 SER D O 1 ATOM 7178 C CB . SER E 2 85 B 77.786 13.096 74.503 1.00 96.74 ? 82 SER D CB 1 ATOM 7179 O OG . SER E 2 85 B 77.353 12.640 73.234 1.00 110.65 ? 82 SER D OG 1 ATOM 7180 N N . LEU E 2 86 C 77.432 16.757 73.934 1.00 102.12 ? 82 LEU D N 1 ATOM 7181 C CA . LEU E 2 86 C 76.430 17.761 73.590 1.00 104.14 ? 82 LEU D CA 1 ATOM 7182 C C . LEU E 2 86 C 75.951 17.664 72.144 1.00 113.77 ? 82 LEU D C 1 ATOM 7183 O O . LEU E 2 86 C 76.746 17.487 71.221 1.00 116.89 ? 82 LEU D O 1 ATOM 7184 C CB . LEU E 2 86 C 76.980 19.166 73.849 1.00 100.72 ? 82 LEU D CB 1 ATOM 7185 C CG . LEU E 2 86 C 77.262 19.543 75.305 1.00 96.09 ? 82 LEU D CG 1 ATOM 7186 C CD1 . LEU E 2 86 C 77.937 20.902 75.378 1.00 95.27 ? 82 LEU D CD1 1 ATOM 7187 C CD2 . LEU E 2 86 C 75.978 19.539 76.119 1.00 89.61 ? 82 LEU D CD2 1 ATOM 7188 N N . ARG E 2 87 ? 74.639 17.779 71.965 1.00 120.35 ? 83 ARG D N 1 ATOM 7189 C CA . ARG E 2 87 ? 74.032 17.829 70.642 1.00 125.04 ? 83 ARG D CA 1 ATOM 7190 C C . ARG E 2 87 ? 73.397 19.197 70.418 1.00 121.27 ? 83 ARG D C 1 ATOM 7191 O O . ARG E 2 87 ? 73.368 20.029 71.325 1.00 117.27 ? 83 ARG D O 1 ATOM 7192 C CB . ARG E 2 87 ? 72.985 16.725 70.480 1.00 131.49 ? 83 ARG D CB 1 ATOM 7193 C CG . ARG E 2 87 ? 73.525 15.316 70.659 1.00 142.23 ? 83 ARG D CG 1 ATOM 7194 C CD . ARG E 2 87 ? 72.435 14.273 70.455 1.00 151.03 ? 83 ARG D CD 1 ATOM 7195 N NE . ARG E 2 87 ? 72.956 12.912 70.574 1.00 159.65 ? 83 ARG D NE 1 ATOM 7196 C CZ . ARG E 2 87 ? 72.218 11.813 70.451 1.00 164.70 ? 83 ARG D CZ 1 ATOM 7197 N NH1 . ARG E 2 87 ? 70.918 11.907 70.206 1.00 166.62 ? 83 ARG D NH1 1 ATOM 7198 N NH2 . ARG E 2 87 ? 72.780 10.618 70.574 1.00 166.98 ? 83 ARG D NH2 1 ATOM 7199 N N . SER E 2 88 ? 72.885 19.425 69.213 1.00 121.77 ? 84 SER D N 1 ATOM 7200 C CA . SER E 2 88 ? 72.260 20.701 68.879 1.00 110.70 ? 84 SER D CA 1 ATOM 7201 C C . SER E 2 88 ? 70.980 20.931 69.680 1.00 103.52 ? 84 SER D C 1 ATOM 7202 O O . SER E 2 88 ? 70.603 22.072 69.948 1.00 99.08 ? 84 SER D O 1 ATOM 7203 C CB . SER E 2 88 ? 71.959 20.771 67.381 1.00 108.76 ? 84 SER D CB 1 ATOM 7204 O OG . SER E 2 88 ? 71.087 19.726 66.987 1.00 111.44 ? 84 SER D OG 1 ATOM 7205 N N . GLU E 2 89 ? 70.320 19.844 70.067 1.00 103.52 ? 85 GLU D N 1 ATOM 7206 C CA . GLU E 2 89 ? 69.063 19.930 70.802 1.00 101.19 ? 85 GLU D CA 1 ATOM 7207 C C . GLU E 2 89 ? 69.282 20.317 72.263 1.00 96.16 ? 85 GLU D C 1 ATOM 7208 O O . GLU E 2 89 ? 68.326 20.592 72.990 1.00 93.39 ? 85 GLU D O 1 ATOM 7209 C CB . GLU E 2 89 ? 68.303 18.602 70.727 1.00 107.20 ? 85 GLU D CB 1 ATOM 7210 C CG . GLU E 2 89 ? 68.039 18.104 69.312 1.00 117.15 ? 85 GLU D CG 1 ATOM 7211 C CD . GLU E 2 89 ? 69.175 17.258 68.768 1.00 124.09 ? 85 GLU D CD 1 ATOM 7212 O OE1 . GLU E 2 89 ? 69.337 17.195 67.531 1.00 129.64 ? 85 GLU D OE1 1 ATOM 7213 O OE2 . GLU E 2 89 ? 69.903 16.649 69.580 1.00 124.22 ? 85 GLU D OE2 1 ATOM 7214 N N . ASP E 2 90 ? 70.541 20.338 72.690 1.00 93.57 ? 86 ASP D N 1 ATOM 7215 C CA . ASP E 2 90 ? 70.873 20.681 74.069 1.00 84.91 ? 86 ASP D CA 1 ATOM 7216 C C . ASP E 2 90 ? 70.933 22.192 74.274 1.00 78.56 ? 86 ASP D C 1 ATOM 7217 O O . ASP E 2 90 ? 70.992 22.671 75.407 1.00 72.56 ? 86 ASP D O 1 ATOM 7218 C CB . ASP E 2 90 ? 72.204 20.046 74.474 1.00 82.25 ? 86 ASP D CB 1 ATOM 7219 C CG . ASP E 2 90 ? 72.152 18.532 74.468 1.00 85.16 ? 86 ASP D CG 1 ATOM 7220 O OD1 . ASP E 2 90 ? 71.047 17.976 74.637 1.00 88.92 ? 86 ASP D OD1 1 ATOM 7221 O OD2 . ASP E 2 90 ? 73.214 17.898 74.298 1.00 85.14 ? 86 ASP D OD2 1 ATOM 7222 N N . THR E 2 91 ? 70.923 22.934 73.172 1.00 78.63 ? 87 THR D N 1 ATOM 7223 C CA . THR E 2 91 ? 70.956 24.390 73.224 1.00 69.14 ? 87 THR D CA 1 ATOM 7224 C C . THR E 2 91 ? 69.727 24.921 73.950 1.00 73.30 ? 87 THR D C 1 ATOM 7225 O O . THR E 2 91 ? 68.628 24.949 73.395 1.00 75.59 ? 87 THR D O 1 ATOM 7226 C CB . THR E 2 91 ? 71.026 25.004 71.816 1.00 72.67 ? 87 THR D CB 1 ATOM 7227 O OG1 . THR E 2 91 ? 72.177 24.498 71.132 1.00 75.99 ? 87 THR D OG1 1 ATOM 7228 C CG2 . THR E 2 91 ? 71.119 26.518 71.900 1.00 71.09 ? 87 THR D CG2 1 ATOM 7229 N N . ALA E 2 92 ? 69.922 25.341 75.196 1.00 69.66 ? 88 ALA D N 1 ATOM 7230 C CA . ALA E 2 92 ? 68.816 25.779 76.036 1.00 70.83 ? 88 ALA D CA 1 ATOM 7231 C C . ALA E 2 92 ? 69.308 26.578 77.237 1.00 70.66 ? 88 ALA D C 1 ATOM 7232 O O . ALA E 2 92 ? 70.513 26.727 77.446 1.00 72.73 ? 88 ALA D O 1 ATOM 7233 C CB . ALA E 2 92 ? 68.004 24.579 76.502 1.00 73.20 ? 88 ALA D CB 1 ATOM 7234 N N . VAL E 2 93 ? 68.366 27.093 78.021 1.00 67.08 ? 89 VAL D N 1 ATOM 7235 C CA . VAL E 2 93 ? 68.689 27.762 79.274 1.00 64.32 ? 89 VAL D CA 1 ATOM 7236 C C . VAL E 2 93 ? 68.583 26.761 80.414 1.00 62.77 ? 89 VAL D C 1 ATOM 7237 O O . VAL E 2 93 ? 67.548 26.121 80.588 1.00 62.77 ? 89 VAL D O 1 ATOM 7238 C CB . VAL E 2 93 ? 67.755 28.952 79.549 1.00 68.18 ? 89 VAL D CB 1 ATOM 7239 C CG1 . VAL E 2 93 ? 68.189 29.682 80.812 1.00 68.07 ? 89 VAL D CG1 1 ATOM 7240 C CG2 . VAL E 2 93 ? 67.737 29.900 78.362 1.00 68.12 ? 89 VAL D CG2 1 ATOM 7241 N N . TYR E 2 94 ? 69.655 26.625 81.187 1.00 64.55 ? 90 TYR D N 1 ATOM 7242 C CA . TYR E 2 94 ? 69.694 25.641 82.263 1.00 64.83 ? 90 TYR D CA 1 ATOM 7243 C C . TYR E 2 94 ? 69.497 26.292 83.629 1.00 64.78 ? 90 TYR D C 1 ATOM 7244 O O . TYR E 2 94 ? 70.250 27.183 84.020 1.00 65.73 ? 90 TYR D O 1 ATOM 7245 C CB . TYR E 2 94 ? 71.014 24.867 82.223 1.00 66.05 ? 90 TYR D CB 1 ATOM 7246 C CG . TYR E 2 94 ? 71.142 23.969 81.012 1.00 69.67 ? 90 TYR D CG 1 ATOM 7247 C CD1 . TYR E 2 94 ? 71.529 24.481 79.779 1.00 70.61 ? 90 TYR D CD1 1 ATOM 7248 C CD2 . TYR E 2 94 ? 70.864 22.612 81.098 1.00 68.05 ? 90 TYR D CD2 1 ATOM 7249 C CE1 . TYR E 2 94 ? 71.639 23.663 78.667 1.00 69.59 ? 90 TYR D CE1 1 ATOM 7250 C CE2 . TYR E 2 94 ? 70.973 21.787 79.993 1.00 68.79 ? 90 TYR D CE2 1 ATOM 7251 C CZ . TYR E 2 94 ? 71.360 22.317 78.781 1.00 71.46 ? 90 TYR D CZ 1 ATOM 7252 O OH . TYR E 2 94 ? 71.468 21.497 77.680 1.00 78.32 ? 90 TYR D OH 1 ATOM 7253 N N . TYR E 2 95 ? 68.474 25.837 84.347 1.00 64.37 ? 91 TYR D N 1 ATOM 7254 C CA . TYR E 2 95 ? 68.149 26.375 85.663 1.00 63.56 ? 91 TYR D CA 1 ATOM 7255 C C . TYR E 2 95 ? 68.460 25.381 86.778 1.00 64.22 ? 91 TYR D C 1 ATOM 7256 O O . TYR E 2 95 ? 68.331 24.171 86.597 1.00 62.73 ? 91 TYR D O 1 ATOM 7257 C CB . TYR E 2 95 ? 66.668 26.760 85.740 1.00 64.39 ? 91 TYR D CB 1 ATOM 7258 C CG . TYR E 2 95 ? 66.230 27.826 84.765 1.00 67.53 ? 91 TYR D CG 1 ATOM 7259 C CD1 . TYR E 2 95 ? 66.303 29.172 85.098 1.00 68.17 ? 91 TYR D CD1 1 ATOM 7260 C CD2 . TYR E 2 95 ? 65.721 27.487 83.519 1.00 71.14 ? 91 TYR D CD2 1 ATOM 7261 C CE1 . TYR E 2 95 ? 65.896 30.150 84.213 1.00 70.49 ? 91 TYR D CE1 1 ATOM 7262 C CE2 . TYR E 2 95 ? 65.310 28.459 82.627 1.00 73.88 ? 91 TYR D CE2 1 ATOM 7263 C CZ . TYR E 2 95 ? 65.399 29.788 82.980 1.00 72.30 ? 91 TYR D CZ 1 ATOM 7264 O OH . TYR E 2 95 ? 64.992 30.760 82.096 1.00 73.31 ? 91 TYR D OH 1 ATOM 7265 N N . CYS E 2 96 ? 68.865 25.901 87.932 1.00 66.45 ? 92 CYS D N 1 ATOM 7266 C CA . CYS E 2 96 ? 68.951 25.092 89.141 1.00 67.74 ? 92 CYS D CA 1 ATOM 7267 C C . CYS E 2 96 ? 67.859 25.545 90.102 1.00 69.98 ? 92 CYS D C 1 ATOM 7268 O O . CYS E 2 96 ? 67.674 26.741 90.319 1.00 75.75 ? 92 CYS D O 1 ATOM 7269 C CB . CYS E 2 96 ? 70.334 25.197 89.791 1.00 70.12 ? 92 CYS D CB 1 ATOM 7270 S SG . CYS E 2 96 ? 70.765 26.828 90.442 1.00 88.57 ? 92 CYS D SG 1 ATOM 7271 N N . ALA E 2 97 ? 67.123 24.590 90.659 1.00 66.67 ? 93 ALA D N 1 ATOM 7272 C CA . ALA E 2 97 ? 66.000 24.921 91.525 1.00 65.43 ? 93 ALA D CA 1 ATOM 7273 C C . ALA E 2 97 ? 66.095 24.211 92.867 1.00 63.44 ? 93 ALA D C 1 ATOM 7274 O O . ALA E 2 97 ? 66.689 23.140 92.975 1.00 63.81 ? 93 ALA D O 1 ATOM 7275 C CB . ALA E 2 97 ? 64.687 24.577 90.840 1.00 66.97 ? 93 ALA D CB 1 ATOM 7276 N N . ARG E 2 98 ? 65.505 24.820 93.889 1.00 61.69 ? 94 ARG D N 1 ATOM 7277 C CA . ARG E 2 98 ? 65.495 24.233 95.220 1.00 63.47 ? 94 ARG D CA 1 ATOM 7278 C C . ARG E 2 98 ? 64.149 23.584 95.517 1.00 66.63 ? 94 ARG D C 1 ATOM 7279 O O . ARG E 2 98 ? 63.099 24.187 95.294 1.00 71.01 ? 94 ARG D O 1 ATOM 7280 C CB . ARG E 2 98 ? 65.809 25.290 96.279 1.00 67.50 ? 94 ARG D CB 1 ATOM 7281 C CG . ARG E 2 98 ? 66.032 24.710 97.665 1.00 71.13 ? 94 ARG D CG 1 ATOM 7282 C CD . ARG E 2 98 ? 66.147 25.788 98.729 1.00 72.74 ? 94 ARG D CD 1 ATOM 7283 N NE . ARG E 2 98 ? 64.842 26.303 99.129 1.00 74.71 ? 94 ARG D NE 1 ATOM 7284 C CZ . ARG E 2 98 ? 64.633 27.026 100.224 1.00 79.25 ? 94 ARG D CZ 1 ATOM 7285 N NH1 . ARG E 2 98 ? 65.645 27.316 101.030 1.00 81.79 ? 94 ARG D NH1 1 ATOM 7286 N NH2 . ARG E 2 98 ? 63.413 27.455 100.517 1.00 80.98 ? 94 ARG D NH2 1 ATOM 7287 N N . VAL E 2 99 ? 64.181 22.352 96.014 1.00 65.41 ? 95 VAL D N 1 ATOM 7288 C CA . VAL E 2 99 ? 62.957 21.678 96.428 1.00 66.11 ? 95 VAL D CA 1 ATOM 7289 C C . VAL E 2 99 ? 62.495 22.237 97.768 1.00 67.22 ? 95 VAL D C 1 ATOM 7290 O O . VAL E 2 99 ? 62.901 21.755 98.825 1.00 70.12 ? 95 VAL D O 1 ATOM 7291 C CB . VAL E 2 99 ? 63.150 20.155 96.544 1.00 66.77 ? 95 VAL D CB 1 ATOM 7292 C CG1 . VAL E 2 99 ? 61.817 19.475 96.807 1.00 66.93 ? 95 VAL D CG1 1 ATOM 7293 C CG2 . VAL E 2 99 ? 63.787 19.604 95.279 1.00 66.14 ? 95 VAL D CG2 1 ATOM 7294 N N . GLY E 2 100 ? 61.653 23.264 97.716 1.00 66.33 ? 96 GLY D N 1 ATOM 7295 C CA . GLY E 2 100 ? 61.201 23.946 98.915 1.00 67.37 ? 96 GLY D CA 1 ATOM 7296 C C . GLY E 2 100 ? 60.163 23.175 99.704 1.00 78.30 ? 96 GLY D C 1 ATOM 7297 O O . GLY E 2 100 ? 60.296 23.002 100.915 1.00 79.22 ? 96 GLY D O 1 ATOM 7298 N N . TYR E 2 101 ? 59.125 22.712 99.017 1.00 83.66 ? 97 TYR D N 1 ATOM 7299 C CA . TYR E 2 101 ? 58.038 21.996 99.671 1.00 88.67 ? 97 TYR D CA 1 ATOM 7300 C C . TYR E 2 101 ? 58.023 20.521 99.277 1.00 92.09 ? 97 TYR D C 1 ATOM 7301 O O . TYR E 2 101 ? 57.967 20.187 98.094 1.00 94.85 ? 97 TYR D O 1 ATOM 7302 C CB . TYR E 2 101 ? 56.697 22.647 99.334 1.00 89.26 ? 97 TYR D CB 1 ATOM 7303 C CG . TYR E 2 101 ? 56.616 24.108 99.715 1.00 94.16 ? 97 TYR D CG 1 ATOM 7304 C CD1 . TYR E 2 101 ? 56.269 24.490 101.004 1.00 99.07 ? 97 TYR D CD1 1 ATOM 7305 C CD2 . TYR E 2 101 ? 56.885 25.105 98.787 1.00 94.65 ? 97 TYR D CD2 1 ATOM 7306 C CE1 . TYR E 2 101 ? 56.192 25.825 101.359 1.00 103.70 ? 97 TYR D CE1 1 ATOM 7307 C CE2 . TYR E 2 101 ? 56.810 26.443 99.132 1.00 98.73 ? 97 TYR D CE2 1 ATOM 7308 C CZ . TYR E 2 101 ? 56.463 26.796 100.419 1.00 105.00 ? 97 TYR D CZ 1 ATOM 7309 O OH . TYR E 2 101 ? 56.386 28.126 100.770 1.00 111.58 ? 97 TYR D OH 1 ATOM 7310 N N . CYS E 2 102 ? 58.074 19.645 100.276 1.00 92.26 ? 98 CYS D N 1 ATOM 7311 C CA . CYS E 2 102 ? 58.077 18.206 100.037 1.00 87.35 ? 98 CYS D CA 1 ATOM 7312 C C . CYS E 2 102 ? 56.732 17.731 99.503 1.00 92.69 ? 98 CYS D C 1 ATOM 7313 O O . CYS E 2 102 ? 55.686 18.270 99.862 1.00 99.94 ? 98 CYS D O 1 ATOM 7314 C CB . CYS E 2 102 ? 58.423 17.446 101.322 1.00 81.95 ? 98 CYS D CB 1 ATOM 7315 S SG . CYS E 2 102 ? 60.120 17.667 101.909 1.00 127.14 ? 98 CYS D SG 1 ATOM 7316 N N . SER E 2 103 ? 56.765 16.717 98.644 1.00 91.68 ? 99 SER D N 1 ATOM 7317 C CA . SER E 2 103 ? 55.543 16.116 98.122 1.00 94.20 ? 99 SER D CA 1 ATOM 7318 C C . SER E 2 103 ? 54.945 15.163 99.148 1.00 98.87 ? 99 SER D C 1 ATOM 7319 O O . SER E 2 103 ? 55.445 15.053 100.267 1.00 101.29 ? 99 SER D O 1 ATOM 7320 C CB . SER E 2 103 ? 55.818 15.374 96.812 1.00 91.25 ? 99 SER D CB 1 ATOM 7321 O OG . SER E 2 103 ? 56.672 14.261 97.026 1.00 88.41 ? 99 SER D OG 1 ATOM 7322 N N . SER E 2 104 ? 53.876 14.473 98.764 1.00 85.82 ? 100 SER D N 1 ATOM 7323 C CA . SER E 2 104 ? 53.246 13.492 99.642 1.00 92.52 ? 100 SER D CA 1 ATOM 7324 C C . SER E 2 104 ? 53.888 12.122 99.462 1.00 99.80 ? 100 SER D C 1 ATOM 7325 O O . SER E 2 104 ? 53.200 11.102 99.424 1.00 106.13 ? 100 SER D O 1 ATOM 7326 C CB . SER E 2 104 ? 51.743 13.409 99.368 1.00 94.30 ? 100 SER D CB 1 ATOM 7327 O OG . SER E 2 104 ? 51.488 12.962 98.047 1.00 94.62 ? 100 SER D OG 1 ATOM 7328 N N . THR E 2 105 A 55.213 12.107 99.354 1.00 98.39 ? 100 THR D N 1 ATOM 7329 C CA . THR E 2 105 A 55.945 10.884 99.057 1.00 96.90 ? 100 THR D CA 1 ATOM 7330 C C . THR E 2 105 A 57.407 10.988 99.488 1.00 92.69 ? 100 THR D C 1 ATOM 7331 O O . THR E 2 105 A 57.930 10.098 100.161 1.00 94.39 ? 100 THR D O 1 ATOM 7332 C CB . THR E 2 105 A 55.873 10.550 97.553 1.00 100.02 ? 100 THR D CB 1 ATOM 7333 O OG1 . THR E 2 105 A 54.572 10.041 97.237 1.00 104.43 ? 100 THR D OG1 1 ATOM 7334 C CG2 . THR E 2 105 A 56.908 9.515 97.183 1.00 99.75 ? 100 THR D CG2 1 ATOM 7335 N N . SER E 2 106 B 58.062 12.079 99.104 1.00 89.52 ? 100 SER D N 1 ATOM 7336 C CA . SER E 2 106 B 59.462 12.291 99.458 1.00 90.26 ? 100 SER D CA 1 ATOM 7337 C C . SER E 2 106 B 59.819 13.775 99.458 1.00 91.42 ? 100 SER D C 1 ATOM 7338 O O . SER E 2 106 B 58.976 14.623 99.167 1.00 91.38 ? 100 SER D O 1 ATOM 7339 C CB . SER E 2 106 B 60.373 11.530 98.497 1.00 90.80 ? 100 SER D CB 1 ATOM 7340 O OG . SER E 2 106 B 60.193 11.979 97.165 1.00 93.69 ? 100 SER D OG 1 ATOM 7341 N N . CYS E 2 107 C 61.071 14.084 99.785 1.00 89.88 ? 100 CYS D N 1 ATOM 7342 C CA . CYS E 2 107 C 61.517 15.473 99.865 1.00 80.76 ? 100 CYS D CA 1 ATOM 7343 C C . CYS E 2 107 C 62.527 15.833 98.779 1.00 71.68 ? 100 CYS D C 1 ATOM 7344 O O . CYS E 2 107 C 62.906 16.996 98.642 1.00 66.08 ? 100 CYS D O 1 ATOM 7345 C CB . CYS E 2 107 C 62.110 15.764 101.246 1.00 81.20 ? 100 CYS D CB 1 ATOM 7346 S SG . CYS E 2 107 C 60.877 15.896 102.563 1.00 110.87 ? 100 CYS D SG 1 ATOM 7347 N N . ASN E 2 108 D 62.965 14.840 98.011 1.00 70.81 ? 100 ASN D N 1 ATOM 7348 C CA . ASN E 2 108 D 63.774 15.111 96.827 1.00 72.22 ? 100 ASN D CA 1 ATOM 7349 C C . ASN E 2 108 D 62.863 15.344 95.627 1.00 73.08 ? 100 ASN D C 1 ATOM 7350 O O . ASN E 2 108 D 63.320 15.665 94.531 1.00 72.20 ? 100 ASN D O 1 ATOM 7351 C CB . ASN E 2 108 D 64.754 13.968 96.551 1.00 70.60 ? 100 ASN D CB 1 ATOM 7352 C CG . ASN E 2 108 D 64.070 12.621 96.456 1.00 81.77 ? 100 ASN D CG 1 ATOM 7353 O OD1 . ASN E 2 108 D 63.086 12.364 97.147 1.00 79.39 ? 100 ASN D OD1 1 ATOM 7354 N ND2 . ASN E 2 108 D 64.590 11.750 95.599 1.00 83.04 ? 100 ASN D ND2 1 ATOM 7355 N N . ARG E 2 109 E 61.564 15.175 95.856 1.00 76.03 ? 100 ARG D N 1 ATOM 7356 C CA . ARG E 2 109 E 60.542 15.492 94.866 1.00 76.81 ? 100 ARG D CA 1 ATOM 7357 C C . ARG E 2 109 E 59.531 16.461 95.461 1.00 79.30 ? 100 ARG D C 1 ATOM 7358 O O . ARG E 2 109 E 59.071 16.276 96.587 1.00 85.53 ? 100 ARG D O 1 ATOM 7359 C CB . ARG E 2 109 E 59.836 14.225 94.381 1.00 77.89 ? 100 ARG D CB 1 ATOM 7360 C CG . ARG E 2 109 E 60.684 13.342 93.486 1.00 78.47 ? 100 ARG D CG 1 ATOM 7361 C CD . ARG E 2 109 E 59.880 12.162 92.964 1.00 80.30 ? 100 ARG D CD 1 ATOM 7362 N NE . ARG E 2 109 E 59.430 11.289 94.044 1.00 81.35 ? 100 ARG D NE 1 ATOM 7363 C CZ . ARG E 2 109 E 60.129 10.260 94.508 1.00 82.31 ? 100 ARG D CZ 1 ATOM 7364 N NH1 . ARG E 2 109 E 61.313 9.975 93.986 1.00 81.48 ? 100 ARG D NH1 1 ATOM 7365 N NH2 . ARG E 2 109 E 59.648 9.517 95.493 1.00 85.31 ? 100 ARG D NH2 1 ATOM 7366 N N . GLY E 2 110 F 59.188 17.496 94.704 1.00 78.14 ? 100 GLY D N 1 ATOM 7367 C CA . GLY E 2 110 F 58.250 18.496 95.179 1.00 75.47 ? 100 GLY D CA 1 ATOM 7368 C C . GLY E 2 110 F 58.248 19.747 94.325 1.00 76.26 ? 100 GLY D C 1 ATOM 7369 O O . GLY E 2 110 F 58.732 19.740 93.191 1.00 76.14 ? 100 GLY D O 1 ATOM 7370 N N . ALA E 2 111 G 57.698 20.826 94.872 1.00 74.36 ? 100 ALA D N 1 ATOM 7371 C CA . ALA E 2 111 G 57.614 22.089 94.152 1.00 67.83 ? 100 ALA D CA 1 ATOM 7372 C C . ALA E 2 111 G 58.907 22.885 94.288 1.00 60.98 ? 100 ALA D C 1 ATOM 7373 O O . ALA E 2 111 G 59.559 22.852 95.333 1.00 57.43 ? 100 ALA D O 1 ATOM 7374 C CB . ALA E 2 111 G 56.434 22.904 94.651 1.00 68.45 ? 100 ALA D CB 1 ATOM 7375 N N . PHE E 2 112 H 59.267 23.598 93.225 1.00 59.28 ? 100 PHE D N 1 ATOM 7376 C CA . PHE E 2 112 H 60.476 24.414 93.208 1.00 59.56 ? 100 PHE D CA 1 ATOM 7377 C C . PHE E 2 112 H 60.159 25.870 93.541 1.00 65.79 ? 100 PHE D C 1 ATOM 7378 O O . PHE E 2 112 H 59.485 26.557 92.771 1.00 67.59 ? 100 PHE D O 1 ATOM 7379 C CB . PHE E 2 112 H 61.158 24.325 91.843 1.00 62.73 ? 100 PHE D CB 1 ATOM 7380 C CG . PHE E 2 112 H 61.508 22.923 91.429 1.00 69.73 ? 100 PHE D CG 1 ATOM 7381 C CD1 . PHE E 2 112 H 61.900 21.985 92.369 1.00 72.92 ? 100 PHE D CD1 1 ATOM 7382 C CD2 . PHE E 2 112 H 61.438 22.543 90.100 1.00 71.94 ? 100 PHE D CD2 1 ATOM 7383 C CE1 . PHE E 2 112 H 62.221 20.695 91.990 1.00 73.20 ? 100 PHE D CE1 1 ATOM 7384 C CE2 . PHE E 2 112 H 61.758 21.253 89.714 1.00 71.57 ? 100 PHE D CE2 1 ATOM 7385 C CZ . PHE E 2 112 H 62.149 20.328 90.660 1.00 71.27 ? 100 PHE D CZ 1 ATOM 7386 N N . ASP E 2 113 ? 60.654 26.340 94.683 1.00 66.46 ? 101 ASP D N 1 ATOM 7387 C CA . ASP E 2 113 ? 60.355 27.693 95.143 1.00 63.03 ? 101 ASP D CA 1 ATOM 7388 C C . ASP E 2 113 ? 61.509 28.665 94.897 1.00 59.26 ? 101 ASP D C 1 ATOM 7389 O O . ASP E 2 113 ? 61.288 29.858 94.695 1.00 61.17 ? 101 ASP D O 1 ATOM 7390 C CB . ASP E 2 113 ? 59.992 27.678 96.631 1.00 68.20 ? 101 ASP D CB 1 ATOM 7391 C CG . ASP E 2 113 ? 61.105 27.121 97.499 1.00 68.99 ? 101 ASP D CG 1 ATOM 7392 O OD1 . ASP E 2 113 ? 61.983 26.408 96.964 1.00 72.16 ? 101 ASP D OD1 1 ATOM 7393 O OD2 . ASP E 2 113 ? 61.097 27.390 98.720 1.00 64.61 ? 101 ASP D OD2 1 ATOM 7394 N N . ILE E 2 114 ? 62.736 28.155 94.917 1.00 56.02 ? 102 ILE D N 1 ATOM 7395 C CA . ILE E 2 114 ? 63.908 28.992 94.684 1.00 58.16 ? 102 ILE D CA 1 ATOM 7396 C C . ILE E 2 114 ? 64.647 28.580 93.418 1.00 65.03 ? 102 ILE D C 1 ATOM 7397 O O . ILE E 2 114 ? 65.213 27.488 93.343 1.00 70.02 ? 102 ILE D O 1 ATOM 7398 C CB . ILE E 2 114 ? 64.885 28.943 95.868 1.00 63.88 ? 102 ILE D CB 1 ATOM 7399 C CG1 . ILE E 2 114 ? 64.192 29.410 97.146 1.00 63.83 ? 102 ILE D CG1 1 ATOM 7400 C CG2 . ILE E 2 114 ? 66.102 29.811 95.585 1.00 69.02 ? 102 ILE D CG2 1 ATOM 7401 C CD1 . ILE E 2 114 ? 63.649 30.815 97.055 1.00 64.50 ? 102 ILE D CD1 1 ATOM 7402 N N . TRP E 2 115 ? 64.643 29.467 92.428 1.00 65.23 ? 103 TRP D N 1 ATOM 7403 C CA . TRP E 2 115 ? 65.279 29.202 91.144 1.00 62.66 ? 103 TRP D CA 1 ATOM 7404 C C . TRP E 2 115 ? 66.533 30.046 90.956 1.00 64.47 ? 103 TRP D C 1 ATOM 7405 O O . TRP E 2 115 ? 66.729 31.046 91.645 1.00 62.23 ? 103 TRP D O 1 ATOM 7406 C CB . TRP E 2 115 ? 64.303 29.476 89.997 1.00 59.83 ? 103 TRP D CB 1 ATOM 7407 C CG . TRP E 2 115 ? 63.125 28.555 89.954 1.00 55.22 ? 103 TRP D CG 1 ATOM 7408 C CD1 . TRP E 2 115 ? 62.096 28.495 90.848 1.00 52.98 ? 103 TRP D CD1 1 ATOM 7409 C CD2 . TRP E 2 115 ? 62.843 27.573 88.951 1.00 54.35 ? 103 TRP D CD2 1 ATOM 7410 N NE1 . TRP E 2 115 ? 61.197 27.529 90.470 1.00 57.04 ? 103 TRP D NE1 1 ATOM 7411 C CE2 . TRP E 2 115 ? 61.631 26.949 89.307 1.00 54.61 ? 103 TRP D CE2 1 ATOM 7412 C CE3 . TRP E 2 115 ? 63.500 27.158 87.788 1.00 54.09 ? 103 TRP D CE3 1 ATOM 7413 C CZ2 . TRP E 2 115 ? 61.062 25.932 88.544 1.00 55.33 ? 103 TRP D CZ2 1 ATOM 7414 C CZ3 . TRP E 2 115 ? 62.935 26.149 87.031 1.00 56.04 ? 103 TRP D CZ3 1 ATOM 7415 C CH2 . TRP E 2 115 ? 61.727 25.547 87.412 1.00 57.84 ? 103 TRP D CH2 1 ATOM 7416 N N . GLY E 2 116 ? 67.375 29.638 90.012 1.00 70.55 ? 104 GLY D N 1 ATOM 7417 C CA . GLY E 2 116 ? 68.543 30.415 89.642 1.00 71.90 ? 104 GLY D CA 1 ATOM 7418 C C . GLY E 2 116 ? 68.200 31.377 88.522 1.00 71.54 ? 104 GLY D C 1 ATOM 7419 O O . GLY E 2 116 ? 67.084 31.355 88.004 1.00 72.37 ? 104 GLY D O 1 ATOM 7420 N N . GLN E 2 117 ? 69.154 32.221 88.141 1.00 71.45 ? 105 GLN D N 1 ATOM 7421 C CA . GLN E 2 117 ? 68.911 33.199 87.085 1.00 71.45 ? 105 GLN D CA 1 ATOM 7422 C C . GLN E 2 117 ? 68.939 32.539 85.709 1.00 70.79 ? 105 GLN D C 1 ATOM 7423 O O . GLN E 2 117 ? 68.505 33.129 84.721 1.00 70.67 ? 105 GLN D O 1 ATOM 7424 C CB . GLN E 2 117 ? 69.936 34.338 87.149 1.00 76.10 ? 105 GLN D CB 1 ATOM 7425 C CG . GLN E 2 117 ? 71.305 34.014 86.560 1.00 79.78 ? 105 GLN D CG 1 ATOM 7426 C CD . GLN E 2 117 ? 72.212 33.282 87.530 1.00 84.92 ? 105 GLN D CD 1 ATOM 7427 O OE1 . GLN E 2 117 ? 71.809 32.943 88.643 1.00 88.23 ? 105 GLN D OE1 1 ATOM 7428 N NE2 . GLN E 2 117 ? 73.448 33.038 87.111 1.00 85.03 ? 105 GLN D NE2 1 ATOM 7429 N N . GLY E 2 118 ? 69.445 31.310 85.654 1.00 68.97 ? 106 GLY D N 1 ATOM 7430 C CA . GLY E 2 118 ? 69.519 30.568 84.409 1.00 63.56 ? 106 GLY D CA 1 ATOM 7431 C C . GLY E 2 118 ? 70.883 30.660 83.754 1.00 62.33 ? 106 GLY D C 1 ATOM 7432 O O . GLY E 2 118 ? 71.582 31.664 83.889 1.00 57.52 ? 106 GLY D O 1 ATOM 7433 N N . THR E 2 119 ? 71.263 29.603 83.044 1.00 65.36 ? 107 THR D N 1 ATOM 7434 C CA . THR E 2 119 ? 72.535 29.570 82.330 1.00 65.52 ? 107 THR D CA 1 ATOM 7435 C C . THR E 2 119 ? 72.330 29.206 80.866 1.00 66.80 ? 107 THR D C 1 ATOM 7436 O O . THR E 2 119 ? 71.942 28.083 80.545 1.00 68.79 ? 107 THR D O 1 ATOM 7437 C CB . THR E 2 119 ? 73.519 28.568 82.961 1.00 64.37 ? 107 THR D CB 1 ATOM 7438 O OG1 . THR E 2 119 ? 73.826 28.973 84.300 1.00 60.70 ? 107 THR D OG1 1 ATOM 7439 C CG2 . THR E 2 119 ? 74.803 28.505 82.154 1.00 60.68 ? 107 THR D CG2 1 ATOM 7440 N N . MET E 2 120 ? 72.588 30.164 79.983 1.00 68.59 ? 108 MET D N 1 ATOM 7441 C CA . MET E 2 120 ? 72.469 29.935 78.548 1.00 71.22 ? 108 MET D CA 1 ATOM 7442 C C . MET E 2 120 ? 73.622 29.082 78.032 1.00 73.87 ? 108 MET D C 1 ATOM 7443 O O . MET E 2 120 ? 74.789 29.423 78.217 1.00 76.46 ? 108 MET D O 1 ATOM 7444 C CB . MET E 2 120 ? 72.423 31.265 77.791 1.00 72.27 ? 108 MET D CB 1 ATOM 7445 C CG . MET E 2 120 ? 72.379 31.115 76.279 1.00 74.31 ? 108 MET D CG 1 ATOM 7446 S SD . MET E 2 120 ? 70.824 30.419 75.685 1.00 99.37 ? 108 MET D SD 1 ATOM 7447 C CE . MET E 2 120 ? 69.716 31.803 75.947 1.00 86.01 ? 108 MET D CE 1 ATOM 7448 N N . VAL E 2 121 ? 73.289 27.968 77.389 1.00 75.21 ? 109 VAL D N 1 ATOM 7449 C CA . VAL E 2 121 ? 74.298 27.096 76.801 1.00 76.80 ? 109 VAL D CA 1 ATOM 7450 C C . VAL E 2 121 ? 74.019 26.885 75.316 1.00 75.19 ? 109 VAL D C 1 ATOM 7451 O O . VAL E 2 121 ? 73.015 26.281 74.941 1.00 72.05 ? 109 VAL D O 1 ATOM 7452 C CB . VAL E 2 121 ? 74.357 25.729 77.514 1.00 73.55 ? 109 VAL D CB 1 ATOM 7453 C CG1 . VAL E 2 121 ? 75.335 24.802 76.807 1.00 72.88 ? 109 VAL D CG1 1 ATOM 7454 C CG2 . VAL E 2 121 ? 74.744 25.908 78.975 1.00 69.80 ? 109 VAL D CG2 1 ATOM 7455 N N . THR E 2 122 ? 74.913 27.395 74.476 1.00 77.12 ? 110 THR D N 1 ATOM 7456 C CA . THR E 2 122 ? 74.760 27.282 73.031 1.00 75.73 ? 110 THR D CA 1 ATOM 7457 C C . THR E 2 122 ? 75.646 26.180 72.464 1.00 78.50 ? 110 THR D C 1 ATOM 7458 O O . THR E 2 122 ? 76.861 26.189 72.655 1.00 81.29 ? 110 THR D O 1 ATOM 7459 C CB . THR E 2 122 ? 75.099 28.609 72.325 1.00 74.80 ? 110 THR D CB 1 ATOM 7460 O OG1 . THR E 2 122 ? 74.272 29.655 72.848 1.00 76.58 ? 110 THR D OG1 1 ATOM 7461 C CG2 . THR E 2 122 ? 74.878 28.488 70.824 1.00 71.99 ? 110 THR D CG2 1 ATOM 7462 N N . VAL E 2 123 ? 75.030 25.230 71.770 1.00 79.68 ? 111 VAL D N 1 ATOM 7463 C CA . VAL E 2 123 ? 75.776 24.165 71.114 1.00 84.53 ? 111 VAL D CA 1 ATOM 7464 C C . VAL E 2 123 ? 75.660 24.297 69.603 1.00 89.31 ? 111 VAL D C 1 ATOM 7465 O O . VAL E 2 123 ? 74.608 24.025 69.025 1.00 92.38 ? 111 VAL D O 1 ATOM 7466 C CB . VAL E 2 123 ? 75.284 22.772 71.541 1.00 85.50 ? 111 VAL D CB 1 ATOM 7467 C CG1 . VAL E 2 123 ? 76.109 21.693 70.858 1.00 87.86 ? 111 VAL D CG1 1 ATOM 7468 C CG2 . VAL E 2 123 ? 75.353 22.625 73.052 1.00 84.99 ? 111 VAL D CG2 1 ATOM 7469 N N . SER E 2 124 ? 76.748 24.719 68.968 1.00 90.87 ? 112 SER D N 1 ATOM 7470 C CA . SER E 2 124 ? 76.748 24.952 67.530 1.00 89.23 ? 112 SER D CA 1 ATOM 7471 C C . SER E 2 124 ? 78.149 24.795 66.947 1.00 91.49 ? 112 SER D C 1 ATOM 7472 O O . SER E 2 124 ? 79.143 25.132 67.592 1.00 89.67 ? 112 SER D O 1 ATOM 7473 C CB . SER E 2 124 ? 76.194 26.346 67.220 1.00 86.90 ? 112 SER D CB 1 ATOM 7474 O OG . SER E 2 124 ? 76.123 26.578 65.824 1.00 93.15 ? 112 SER D OG 1 ATOM 7475 N N . SER E 2 125 ? 78.222 24.279 65.725 1.00 93.59 ? 113 SER D N 1 ATOM 7476 C CA . SER E 2 125 ? 79.498 24.105 65.042 1.00 94.08 ? 113 SER D CA 1 ATOM 7477 C C . SER E 2 125 ? 80.048 25.445 64.570 1.00 84.66 ? 113 SER D C 1 ATOM 7478 O O . SER E 2 125 ? 81.215 25.550 64.198 1.00 87.93 ? 113 SER D O 1 ATOM 7479 C CB . SER E 2 125 ? 79.351 23.149 63.856 1.00 93.33 ? 113 SER D CB 1 ATOM 7480 O OG . SER E 2 125 ? 79.005 21.843 64.286 1.00 90.84 ? 113 SER D OG 1 ATOM 7481 N N . ALA E 2 126 ? 79.198 26.467 64.593 1.00 90.77 ? 114 ALA D N 1 ATOM 7482 C CA . ALA E 2 126 ? 79.580 27.804 64.149 1.00 92.41 ? 114 ALA D CA 1 ATOM 7483 C C . ALA E 2 126 ? 80.652 28.415 65.046 1.00 92.04 ? 114 ALA D C 1 ATOM 7484 O O . ALA E 2 126 ? 80.676 28.179 66.255 1.00 88.79 ? 114 ALA D O 1 ATOM 7485 C CB . ALA E 2 126 ? 78.360 28.710 64.097 1.00 74.38 ? 114 ALA D CB 1 ATOM 7486 N N . SER E 2 127 ? 81.540 29.198 64.441 1.00 96.21 ? 115 SER D N 1 ATOM 7487 C CA . SER E 2 127 ? 82.594 29.886 65.178 1.00 99.64 ? 115 SER D CA 1 ATOM 7488 C C . SER E 2 127 ? 82.151 31.293 65.566 1.00 96.64 ? 115 SER D C 1 ATOM 7489 O O . SER E 2 127 ? 81.161 31.807 65.043 1.00 93.30 ? 115 SER D O 1 ATOM 7490 C CB . SER E 2 127 ? 83.877 29.945 64.347 1.00 106.36 ? 115 SER D CB 1 ATOM 7491 O OG . SER E 2 127 ? 84.903 30.630 65.042 1.00 111.91 ? 115 SER D OG 1 ATOM 7492 N N . THR E 2 128 ? 82.888 31.913 66.483 1.00 91.67 ? 116 THR D N 1 ATOM 7493 C CA . THR E 2 128 ? 82.568 33.261 66.936 1.00 86.83 ? 116 THR D CA 1 ATOM 7494 C C . THR E 2 128 ? 82.786 34.277 65.818 1.00 88.54 ? 116 THR D C 1 ATOM 7495 O O . THR E 2 128 ? 83.867 34.345 65.232 1.00 94.82 ? 116 THR D O 1 ATOM 7496 C CB . THR E 2 128 ? 83.414 33.662 68.158 1.00 86.70 ? 116 THR D CB 1 ATOM 7497 O OG1 . THR E 2 128 ? 83.190 32.731 69.224 1.00 90.95 ? 116 THR D OG1 1 ATOM 7498 C CG2 . THR E 2 128 ? 83.044 35.060 68.626 1.00 80.83 ? 116 THR D CG2 1 ATOM 7499 N N . LYS E 2 129 ? 81.754 35.064 65.524 1.00 82.55 ? 117 LYS D N 1 ATOM 7500 C CA . LYS E 2 129 ? 81.823 36.048 64.449 1.00 82.97 ? 117 LYS D CA 1 ATOM 7501 C C . LYS E 2 129 ? 81.097 37.341 64.809 1.00 79.71 ? 117 LYS D C 1 ATOM 7502 O O . LYS E 2 129 ? 80.008 37.317 65.380 1.00 76.59 ? 117 LYS D O 1 ATOM 7503 C CB . LYS E 2 129 ? 81.239 35.467 63.158 1.00 80.39 ? 117 LYS D CB 1 ATOM 7504 C CG . LYS E 2 129 ? 81.234 36.438 61.985 1.00 74.53 ? 117 LYS D CG 1 ATOM 7505 C CD . LYS E 2 129 ? 80.515 35.856 60.780 1.00 74.20 ? 117 LYS D CD 1 ATOM 7506 C CE . LYS E 2 129 ? 80.483 36.847 59.628 1.00 75.42 ? 117 LYS D CE 1 ATOM 7507 N NZ . LYS E 2 129 ? 79.770 38.103 59.995 1.00 74.18 ? 117 LYS D NZ 1 ATOM 7508 N N . GLY E 2 130 ? 81.709 38.471 64.468 1.00 80.67 ? 118 GLY D N 1 ATOM 7509 C CA . GLY E 2 130 ? 81.102 39.767 64.700 1.00 78.56 ? 118 GLY D CA 1 ATOM 7510 C C . GLY E 2 130 ? 80.035 40.079 63.668 1.00 75.80 ? 118 GLY D C 1 ATOM 7511 O O . GLY E 2 130 ? 80.098 39.595 62.538 1.00 76.25 ? 118 GLY D O 1 ATOM 7512 N N . PRO E 2 131 ? 79.044 40.894 64.054 1.00 73.34 ? 119 PRO D N 1 ATOM 7513 C CA . PRO E 2 131 ? 77.922 41.250 63.180 1.00 70.77 ? 119 PRO D CA 1 ATOM 7514 C C . PRO E 2 131 ? 78.242 42.373 62.198 1.00 73.49 ? 119 PRO D C 1 ATOM 7515 O O . PRO E 2 131 ? 79.155 43.165 62.430 1.00 71.09 ? 119 PRO D O 1 ATOM 7516 C CB . PRO E 2 131 ? 76.849 41.701 64.169 1.00 62.07 ? 119 PRO D CB 1 ATOM 7517 C CG . PRO E 2 131 ? 77.624 42.278 65.300 1.00 64.34 ? 119 PRO D CG 1 ATOM 7518 C CD . PRO E 2 131 ? 78.885 41.455 65.408 1.00 72.46 ? 119 PRO D CD 1 ATOM 7519 N N . SER E 2 132 ? 77.483 42.429 61.109 1.00 78.22 ? 120 SER D N 1 ATOM 7520 C CA . SER E 2 132 ? 77.553 43.542 60.172 1.00 80.56 ? 120 SER D CA 1 ATOM 7521 C C . SER E 2 132 ? 76.313 44.414 60.339 1.00 82.85 ? 120 SER D C 1 ATOM 7522 O O . SER E 2 132 ? 75.189 43.914 60.308 1.00 87.05 ? 120 SER D O 1 ATOM 7523 C CB . SER E 2 132 ? 77.668 43.039 58.732 1.00 81.30 ? 120 SER D CB 1 ATOM 7524 O OG . SER E 2 132 ? 78.841 42.265 58.551 1.00 85.48 ? 120 SER D OG 1 ATOM 7525 N N . VAL E 2 133 ? 76.518 45.713 60.525 1.00 81.62 ? 121 VAL D N 1 ATOM 7526 C CA . VAL E 2 133 ? 75.408 46.623 60.786 1.00 78.09 ? 121 VAL D CA 1 ATOM 7527 C C . VAL E 2 133 ? 75.020 47.419 59.545 1.00 77.82 ? 121 VAL D C 1 ATOM 7528 O O . VAL E 2 133 ? 75.752 48.310 59.115 1.00 80.92 ? 121 VAL D O 1 ATOM 7529 C CB . VAL E 2 133 ? 75.743 47.603 61.923 1.00 75.96 ? 121 VAL D CB 1 ATOM 7530 C CG1 . VAL E 2 133 ? 74.540 48.479 62.234 1.00 71.65 ? 121 VAL D CG1 1 ATOM 7531 C CG2 . VAL E 2 133 ? 76.188 46.841 63.160 1.00 77.21 ? 121 VAL D CG2 1 ATOM 7532 N N . PHE E 2 134 ? 73.864 47.092 58.976 1.00 75.02 ? 122 PHE D N 1 ATOM 7533 C CA . PHE E 2 134 ? 73.373 47.784 57.791 1.00 73.56 ? 122 PHE D CA 1 ATOM 7534 C C . PHE E 2 134 ? 72.195 48.687 58.142 1.00 73.48 ? 122 PHE D C 1 ATOM 7535 O O . PHE E 2 134 ? 71.330 48.305 58.930 1.00 72.90 ? 122 PHE D O 1 ATOM 7536 C CB . PHE E 2 134 ? 72.968 46.782 56.707 1.00 70.52 ? 122 PHE D CB 1 ATOM 7537 C CG . PHE E 2 134 ? 74.051 45.802 56.352 1.00 71.44 ? 122 PHE D CG 1 ATOM 7538 C CD1 . PHE E 2 134 ? 75.170 46.211 55.645 1.00 69.19 ? 122 PHE D CD1 1 ATOM 7539 C CD2 . PHE E 2 134 ? 73.944 44.469 56.717 1.00 72.96 ? 122 PHE D CD2 1 ATOM 7540 C CE1 . PHE E 2 134 ? 76.168 45.310 55.317 1.00 69.61 ? 122 PHE D CE1 1 ATOM 7541 C CE2 . PHE E 2 134 ? 74.937 43.564 56.390 1.00 72.03 ? 122 PHE D CE2 1 ATOM 7542 C CZ . PHE E 2 134 ? 76.050 43.986 55.688 1.00 71.18 ? 122 PHE D CZ 1 ATOM 7543 N N . PRO E 2 135 ? 72.161 49.893 57.556 1.00 75.03 ? 123 PRO D N 1 ATOM 7544 C CA . PRO E 2 135 ? 71.112 50.875 57.850 1.00 74.98 ? 123 PRO D CA 1 ATOM 7545 C C . PRO E 2 135 ? 69.791 50.578 57.144 1.00 73.30 ? 123 PRO D C 1 ATOM 7546 O O . PRO E 2 135 ? 69.783 50.067 56.025 1.00 75.04 ? 123 PRO D O 1 ATOM 7547 C CB . PRO E 2 135 ? 71.714 52.183 57.335 1.00 75.71 ? 123 PRO D CB 1 ATOM 7548 C CG . PRO E 2 135 ? 72.592 51.758 56.212 1.00 75.85 ? 123 PRO D CG 1 ATOM 7549 C CD . PRO E 2 135 ? 73.163 50.423 56.614 1.00 76.28 ? 123 PRO D CD 1 ATOM 7550 N N . LEU E 2 136 ? 68.686 50.897 57.809 1.00 79.94 ? 124 LEU D N 1 ATOM 7551 C CA . LEU E 2 136 ? 67.364 50.800 57.204 1.00 75.46 ? 124 LEU D CA 1 ATOM 7552 C C . LEU E 2 136 ? 66.790 52.198 56.997 1.00 75.65 ? 124 LEU D C 1 ATOM 7553 O O . LEU E 2 136 ? 66.042 52.700 57.835 1.00 77.03 ? 124 LEU D O 1 ATOM 7554 C CB . LEU E 2 136 ? 66.425 49.962 58.075 1.00 72.54 ? 124 LEU D CB 1 ATOM 7555 C CG . LEU E 2 136 ? 66.848 48.522 58.372 1.00 67.26 ? 124 LEU D CG 1 ATOM 7556 C CD1 . LEU E 2 136 ? 65.881 47.878 59.354 1.00 63.26 ? 124 LEU D CD1 1 ATOM 7557 C CD2 . LEU E 2 136 ? 66.937 47.708 57.089 1.00 65.96 ? 124 LEU D CD2 1 ATOM 7558 N N . ALA E 2 137 ? 67.153 52.822 55.881 1.00 76.62 ? 125 ALA D N 1 ATOM 7559 C CA . ALA E 2 137 ? 66.740 54.192 55.588 1.00 78.61 ? 125 ALA D CA 1 ATOM 7560 C C . ALA E 2 137 ? 65.233 54.306 55.380 1.00 81.58 ? 125 ALA D C 1 ATOM 7561 O O . ALA E 2 137 ? 64.614 53.418 54.792 1.00 82.28 ? 125 ALA D O 1 ATOM 7562 C CB . ALA E 2 137 ? 67.480 54.711 54.364 1.00 80.41 ? 125 ALA D CB 1 ATOM 7563 N N . PRO E 2 138 ? 64.639 55.406 55.868 1.00 85.84 ? 126 PRO D N 1 ATOM 7564 C CA . PRO E 2 138 ? 63.205 55.679 55.703 1.00 86.86 ? 126 PRO D CA 1 ATOM 7565 C C . PRO E 2 138 ? 62.789 55.744 54.235 1.00 86.94 ? 126 PRO D C 1 ATOM 7566 O O . PRO E 2 138 ? 62.743 56.840 53.672 1.00 87.50 ? 126 PRO D O 1 ATOM 7567 C CB . PRO E 2 138 ? 63.027 57.044 56.376 1.00 90.41 ? 126 PRO D CB 1 ATOM 7568 C CG . PRO E 2 138 ? 64.170 57.154 57.327 1.00 88.29 ? 126 PRO D CG 1 ATOM 7569 C CD . PRO E 2 138 ? 65.310 56.443 56.670 1.00 87.48 ? 126 PRO D CD 1 ATOM 7570 N N . THR E 2 147 ? 55.869 61.075 60.246 1.00 107.91 ? 135 THR D N 1 ATOM 7571 C CA . THR E 2 147 ? 55.803 59.756 60.866 1.00 105.24 ? 135 THR D CA 1 ATOM 7572 C C . THR E 2 147 ? 56.413 58.690 59.960 1.00 99.61 ? 135 THR D C 1 ATOM 7573 O O . THR E 2 147 ? 55.713 58.057 59.169 1.00 99.77 ? 135 THR D O 1 ATOM 7574 C CB . THR E 2 147 ? 54.354 59.363 61.200 1.00 108.54 ? 135 THR D CB 1 ATOM 7575 O OG1 . THR E 2 147 ? 53.699 60.456 61.856 1.00 115.55 ? 135 THR D OG1 1 ATOM 7576 C CG2 . THR E 2 147 ? 54.329 58.139 62.105 1.00 102.80 ? 135 THR D CG2 1 ATOM 7577 N N . ALA E 2 148 ? 57.723 58.498 60.078 1.00 94.12 ? 136 ALA D N 1 ATOM 7578 C CA . ALA E 2 148 ? 58.425 57.507 59.273 1.00 92.71 ? 136 ALA D CA 1 ATOM 7579 C C . ALA E 2 148 ? 59.054 56.432 60.153 1.00 89.66 ? 136 ALA D C 1 ATOM 7580 O O . ALA E 2 148 ? 58.939 56.472 61.378 1.00 89.17 ? 136 ALA D O 1 ATOM 7581 C CB . ALA E 2 148 ? 59.486 58.176 58.413 1.00 94.77 ? 136 ALA D CB 1 ATOM 7582 N N . ALA E 2 149 ? 59.723 55.474 59.521 1.00 85.50 ? 137 ALA D N 1 ATOM 7583 C CA . ALA E 2 149 ? 60.357 54.380 60.245 1.00 78.99 ? 137 ALA D CA 1 ATOM 7584 C C . ALA E 2 149 ? 61.762 54.107 59.721 1.00 77.61 ? 137 ALA D C 1 ATOM 7585 O O . ALA E 2 149 ? 61.983 54.044 58.512 1.00 80.83 ? 137 ALA D O 1 ATOM 7586 C CB . ALA E 2 149 ? 59.506 53.124 60.153 1.00 77.28 ? 137 ALA D CB 1 ATOM 7587 N N . LEU E 2 150 ? 62.709 53.950 60.640 1.00 74.75 ? 138 LEU D N 1 ATOM 7588 C CA . LEU E 2 150 ? 64.087 53.632 60.283 1.00 73.09 ? 138 LEU D CA 1 ATOM 7589 C C . LEU E 2 150 ? 64.690 52.675 61.303 1.00 70.90 ? 138 LEU D C 1 ATOM 7590 O O . LEU E 2 150 ? 64.126 52.470 62.378 1.00 63.96 ? 138 LEU D O 1 ATOM 7591 C CB . LEU E 2 150 ? 64.927 54.907 60.182 1.00 74.91 ? 138 LEU D CB 1 ATOM 7592 C CG . LEU E 2 150 ? 64.928 55.841 61.395 1.00 77.10 ? 138 LEU D CG 1 ATOM 7593 C CD1 . LEU E 2 150 ? 66.116 55.568 62.307 1.00 78.53 ? 138 LEU D CD1 1 ATOM 7594 C CD2 . LEU E 2 150 ? 64.916 57.291 60.948 1.00 83.46 ? 138 LEU D CD2 1 ATOM 7595 N N . GLY E 2 151 ? 65.837 52.091 60.969 1.00 76.42 ? 139 GLY D N 1 ATOM 7596 C CA . GLY E 2 151 ? 66.484 51.166 61.878 1.00 75.66 ? 139 GLY D CA 1 ATOM 7597 C C . GLY E 2 151 ? 67.809 50.601 61.406 1.00 75.17 ? 139 GLY D C 1 ATOM 7598 O O . GLY E 2 151 ? 68.372 51.041 60.403 1.00 75.39 ? 139 GLY D O 1 ATOM 7599 N N . CYS E 2 152 ? 68.310 49.622 62.153 1.00 74.02 ? 140 CYS D N 1 ATOM 7600 C CA . CYS E 2 152 ? 69.556 48.944 61.819 1.00 73.98 ? 140 CYS D CA 1 ATOM 7601 C C . CYS E 2 152 ? 69.307 47.457 61.620 1.00 72.37 ? 140 CYS D C 1 ATOM 7602 O O . CYS E 2 152 ? 68.408 46.884 62.236 1.00 71.81 ? 140 CYS D O 1 ATOM 7603 C CB . CYS E 2 152 ? 70.606 49.152 62.915 1.00 74.79 ? 140 CYS D CB 1 ATOM 7604 S SG . CYS E 2 152 ? 71.160 50.857 63.155 1.00 110.15 ? 140 CYS D SG 1 ATOM 7605 N N . LEU E 2 153 ? 70.105 46.833 60.762 1.00 72.00 ? 141 LEU D N 1 ATOM 7606 C CA . LEU E 2 153 ? 70.014 45.395 60.562 1.00 71.47 ? 141 LEU D CA 1 ATOM 7607 C C . LEU E 2 153 ? 71.292 44.709 61.033 1.00 74.11 ? 141 LEU D C 1 ATOM 7608 O O . LEU E 2 153 ? 72.295 44.680 60.319 1.00 78.01 ? 141 LEU D O 1 ATOM 7609 C CB . LEU E 2 153 ? 69.741 45.064 59.094 1.00 69.63 ? 141 LEU D CB 1 ATOM 7610 C CG . LEU E 2 153 ? 69.487 43.587 58.781 1.00 65.56 ? 141 LEU D CG 1 ATOM 7611 C CD1 . LEU E 2 153 ? 68.273 43.074 59.544 1.00 63.42 ? 141 LEU D CD1 1 ATOM 7612 C CD2 . LEU E 2 153 ? 69.311 43.373 57.288 1.00 64.47 ? 141 LEU D CD2 1 ATOM 7613 N N . VAL E 2 154 ? 71.249 44.170 62.247 1.00 71.00 ? 142 VAL D N 1 ATOM 7614 C CA . VAL E 2 154 ? 72.370 43.427 62.806 1.00 73.32 ? 142 VAL D CA 1 ATOM 7615 C C . VAL E 2 154 ? 72.381 42.007 62.245 1.00 75.29 ? 142 VAL D C 1 ATOM 7616 O O . VAL E 2 154 ? 71.713 41.115 62.770 1.00 79.01 ? 142 VAL D O 1 ATOM 7617 C CB . VAL E 2 154 ? 72.299 43.384 64.346 1.00 78.03 ? 142 VAL D CB 1 ATOM 7618 C CG1 . VAL E 2 154 ? 73.518 42.686 64.923 1.00 82.27 ? 142 VAL D CG1 1 ATOM 7619 C CG2 . VAL E 2 154 ? 72.173 44.792 64.906 1.00 77.72 ? 142 VAL D CG2 1 ATOM 7620 N N . LYS E 2 155 ? 73.141 41.802 61.174 1.00 72.76 ? 143 LYS D N 1 ATOM 7621 C CA . LYS E 2 155 ? 73.112 40.532 60.457 1.00 69.92 ? 143 LYS D CA 1 ATOM 7622 C C . LYS E 2 155 ? 74.401 39.727 60.618 1.00 68.19 ? 143 LYS D C 1 ATOM 7623 O O . LYS E 2 155 ? 75.494 40.292 60.682 1.00 65.50 ? 143 LYS D O 1 ATOM 7624 C CB . LYS E 2 155 ? 72.836 40.781 58.969 1.00 66.67 ? 143 LYS D CB 1 ATOM 7625 C CG . LYS E 2 155 ? 72.619 39.516 58.148 1.00 66.68 ? 143 LYS D CG 1 ATOM 7626 C CD . LYS E 2 155 ? 72.372 39.833 56.683 1.00 68.79 ? 143 LYS D CD 1 ATOM 7627 C CE . LYS E 2 155 ? 72.311 38.565 55.844 1.00 75.06 ? 143 LYS D CE 1 ATOM 7628 N NZ . LYS E 2 155 ? 71.208 37.662 56.272 1.00 75.66 ? 143 LYS D NZ 1 ATOM 7629 N N . ASP E 2 156 ? 74.247 38.406 60.697 1.00 70.68 ? 144 ASP D N 1 ATOM 7630 C CA . ASP E 2 156 ? 75.360 37.455 60.693 1.00 75.24 ? 144 ASP D CA 1 ATOM 7631 C C . ASP E 2 156 ? 76.330 37.635 61.860 1.00 76.38 ? 144 ASP D C 1 ATOM 7632 O O . ASP E 2 156 ? 77.355 38.302 61.729 1.00 81.05 ? 144 ASP D O 1 ATOM 7633 C CB . ASP E 2 156 ? 76.128 37.550 59.369 1.00 78.34 ? 144 ASP D CB 1 ATOM 7634 C CG . ASP E 2 156 ? 75.258 37.234 58.166 1.00 79.27 ? 144 ASP D CG 1 ATOM 7635 O OD1 . ASP E 2 156 ? 74.361 36.373 58.288 1.00 81.35 ? 144 ASP D OD1 1 ATOM 7636 O OD2 . ASP E 2 156 ? 75.471 37.847 57.098 1.00 77.06 ? 144 ASP D OD2 1 ATOM 7637 N N . TYR E 2 157 ? 76.004 37.027 62.996 1.00 74.80 ? 145 TYR D N 1 ATOM 7638 C CA . TYR E 2 157 ? 76.905 37.023 64.143 1.00 77.46 ? 145 TYR D CA 1 ATOM 7639 C C . TYR E 2 157 ? 76.720 35.769 64.990 1.00 78.39 ? 145 TYR D C 1 ATOM 7640 O O . TYR E 2 157 ? 75.717 35.065 64.867 1.00 77.41 ? 145 TYR D O 1 ATOM 7641 C CB . TYR E 2 157 ? 76.697 38.270 65.006 1.00 74.93 ? 145 TYR D CB 1 ATOM 7642 C CG . TYR E 2 157 ? 75.351 38.343 65.690 1.00 72.25 ? 145 TYR D CG 1 ATOM 7643 C CD1 . TYR E 2 157 ? 74.259 38.916 65.054 1.00 69.53 ? 145 TYR D CD1 1 ATOM 7644 C CD2 . TYR E 2 157 ? 75.175 37.848 66.978 1.00 73.86 ? 145 TYR D CD2 1 ATOM 7645 C CE1 . TYR E 2 157 ? 73.028 38.988 65.675 1.00 69.06 ? 145 TYR D CE1 1 ATOM 7646 C CE2 . TYR E 2 157 ? 73.948 37.915 67.607 1.00 73.22 ? 145 TYR D CE2 1 ATOM 7647 C CZ . TYR E 2 157 ? 72.879 38.487 66.951 1.00 72.29 ? 145 TYR D CZ 1 ATOM 7648 O OH . TYR E 2 157 ? 71.656 38.557 67.574 1.00 73.49 ? 145 TYR D OH 1 ATOM 7649 N N . PHE E 2 158 ? 77.695 35.505 65.853 1.00 79.34 ? 146 PHE D N 1 ATOM 7650 C CA . PHE E 2 158 ? 77.665 34.334 66.717 1.00 82.23 ? 146 PHE D CA 1 ATOM 7651 C C . PHE E 2 158 ? 78.639 34.497 67.879 1.00 87.49 ? 146 PHE D C 1 ATOM 7652 O O . PHE E 2 158 ? 79.779 34.917 67.683 1.00 90.39 ? 146 PHE D O 1 ATOM 7653 C CB . PHE E 2 158 ? 78.000 33.069 65.918 1.00 84.81 ? 146 PHE D CB 1 ATOM 7654 C CG . PHE E 2 158 ? 77.886 31.797 66.714 1.00 87.20 ? 146 PHE D CG 1 ATOM 7655 C CD1 . PHE E 2 158 ? 76.680 31.120 66.793 1.00 82.71 ? 146 PHE D CD1 1 ATOM 7656 C CD2 . PHE E 2 158 ? 78.985 31.278 67.378 1.00 85.46 ? 146 PHE D CD2 1 ATOM 7657 C CE1 . PHE E 2 158 ? 76.572 29.953 67.522 1.00 86.39 ? 146 PHE D CE1 1 ATOM 7658 C CE2 . PHE E 2 158 ? 78.882 30.112 68.109 1.00 91.12 ? 146 PHE D CE2 1 ATOM 7659 C CZ . PHE E 2 158 ? 77.674 29.449 68.181 1.00 91.00 ? 146 PHE D CZ 1 ATOM 7660 N N . PRO E 2 159 ? 78.189 34.172 69.099 1.00 93.49 ? 147 PRO D N 1 ATOM 7661 C CA . PRO E 2 159 ? 76.814 33.764 69.393 1.00 94.03 ? 147 PRO D CA 1 ATOM 7662 C C . PRO E 2 159 ? 75.966 34.926 69.902 1.00 91.64 ? 147 PRO D C 1 ATOM 7663 O O . PRO E 2 159 ? 76.277 36.088 69.637 1.00 88.82 ? 147 PRO D O 1 ATOM 7664 C CB . PRO E 2 159 ? 77.004 32.718 70.486 1.00 99.74 ? 147 PRO D CB 1 ATOM 7665 C CG . PRO E 2 159 ? 78.174 33.248 71.260 1.00 102.22 ? 147 PRO D CG 1 ATOM 7666 C CD . PRO E 2 159 ? 79.072 33.955 70.259 1.00 99.91 ? 147 PRO D CD 1 ATOM 7667 N N . GLU E 2 160 ? 74.902 34.600 70.628 1.00 75.67 ? 148 GLU D N 1 ATOM 7668 C CA . GLU E 2 160 ? 74.088 35.599 71.307 1.00 69.76 ? 148 GLU D CA 1 ATOM 7669 C C . GLU E 2 160 ? 74.845 36.153 72.514 1.00 71.91 ? 148 GLU D C 1 ATOM 7670 O O . GLU E 2 160 ? 75.725 35.483 73.051 1.00 74.81 ? 148 GLU D O 1 ATOM 7671 C CB . GLU E 2 160 ? 72.752 34.988 71.744 1.00 70.36 ? 148 GLU D CB 1 ATOM 7672 C CG . GLU E 2 160 ? 71.795 34.671 70.604 1.00 70.89 ? 148 GLU D CG 1 ATOM 7673 C CD . GLU E 2 160 ? 70.928 35.855 70.218 1.00 72.27 ? 148 GLU D CD 1 ATOM 7674 O OE1 . GLU E 2 160 ? 71.445 36.992 70.167 1.00 69.50 ? 148 GLU D OE1 1 ATOM 7675 O OE2 . GLU E 2 160 ? 69.721 35.650 69.971 1.00 77.17 ? 148 GLU D OE2 1 ATOM 7676 N N . PRO E 2 161 ? 74.509 37.380 72.947 1.00 71.31 ? 149 PRO D N 1 ATOM 7677 C CA . PRO E 2 161 ? 73.539 38.295 72.347 1.00 73.91 ? 149 PRO D CA 1 ATOM 7678 C C . PRO E 2 161 ? 74.172 39.564 71.782 1.00 77.39 ? 149 PRO D C 1 ATOM 7679 O O . PRO E 2 161 ? 75.396 39.690 71.740 1.00 78.23 ? 149 PRO D O 1 ATOM 7680 C CB . PRO E 2 161 ? 72.633 38.635 73.531 1.00 71.43 ? 149 PRO D CB 1 ATOM 7681 C CG . PRO E 2 161 ? 73.557 38.492 74.765 1.00 69.47 ? 149 PRO D CG 1 ATOM 7682 C CD . PRO E 2 161 ? 74.843 37.817 74.310 1.00 69.92 ? 149 PRO D CD 1 ATOM 7683 N N . VAL E 2 162 ? 73.327 40.494 71.351 1.00 81.92 ? 150 VAL D N 1 ATOM 7684 C CA . VAL E 2 162 ? 73.774 41.817 70.934 1.00 84.30 ? 150 VAL D CA 1 ATOM 7685 C C . VAL E 2 162 ? 72.845 42.876 71.514 1.00 85.94 ? 150 VAL D C 1 ATOM 7686 O O . VAL E 2 162 ? 71.623 42.713 71.517 1.00 88.72 ? 150 VAL D O 1 ATOM 7687 C CB . VAL E 2 162 ? 73.823 41.957 69.396 1.00 84.04 ? 150 VAL D CB 1 ATOM 7688 C CG1 . VAL E 2 162 ? 75.007 41.192 68.827 1.00 87.47 ? 150 VAL D CG1 1 ATOM 7689 C CG2 . VAL E 2 162 ? 72.519 41.486 68.770 1.00 83.82 ? 150 VAL D CG2 1 ATOM 7690 N N . THR E 2 163 ? 73.427 43.956 72.022 1.00 85.41 ? 151 THR D N 1 ATOM 7691 C CA . THR E 2 163 ? 72.638 45.037 72.597 1.00 84.50 ? 151 THR D CA 1 ATOM 7692 C C . THR E 2 163 ? 72.517 46.184 71.605 1.00 83.25 ? 151 THR D C 1 ATOM 7693 O O . THR E 2 163 ? 73.505 46.597 70.998 1.00 88.20 ? 151 THR D O 1 ATOM 7694 C CB . THR E 2 163 ? 73.256 45.553 73.906 1.00 88.27 ? 151 THR D CB 1 ATOM 7695 O OG1 . THR E 2 163 ? 74.547 46.113 73.638 1.00 91.29 ? 151 THR D OG1 1 ATOM 7696 C CG2 . THR E 2 163 ? 73.397 44.417 74.906 1.00 90.21 ? 151 THR D CG2 1 ATOM 7697 N N . VAL E 2 164 ? 71.301 46.690 71.435 1.00 79.57 ? 152 VAL D N 1 ATOM 7698 C CA . VAL E 2 164 ? 71.062 47.778 70.498 1.00 79.30 ? 152 VAL D CA 1 ATOM 7699 C C . VAL E 2 164 ? 70.354 48.949 71.169 1.00 78.85 ? 152 VAL D C 1 ATOM 7700 O O . VAL E 2 164 ? 69.264 48.797 71.720 1.00 78.53 ? 152 VAL D O 1 ATOM 7701 C CB . VAL E 2 164 ? 70.226 47.314 69.289 1.00 78.16 ? 152 VAL D CB 1 ATOM 7702 C CG1 . VAL E 2 164 ? 69.953 48.483 68.354 1.00 75.57 ? 152 VAL D CG1 1 ATOM 7703 C CG2 . VAL E 2 164 ? 70.936 46.190 68.549 1.00 81.16 ? 152 VAL D CG2 1 ATOM 7704 N N . SER E 2 165 ? 70.989 50.115 71.122 1.00 78.33 ? 153 SER D N 1 ATOM 7705 C CA . SER E 2 165 ? 70.383 51.342 71.622 1.00 78.96 ? 153 SER D CA 1 ATOM 7706 C C . SER E 2 165 ? 70.433 52.415 70.541 1.00 77.10 ? 153 SER D C 1 ATOM 7707 O O . SER E 2 165 ? 71.034 52.216 69.485 1.00 75.63 ? 153 SER D O 1 ATOM 7708 C CB . SER E 2 165 ? 71.090 51.826 72.891 1.00 82.10 ? 153 SER D CB 1 ATOM 7709 O OG . SER E 2 165 ? 72.424 52.217 72.621 1.00 84.51 ? 153 SER D OG 1 ATOM 7710 N N . TRP E 2 166 ? 69.799 53.552 70.804 1.00 78.51 ? 154 TRP D N 1 ATOM 7711 C CA . TRP E 2 166 ? 69.762 54.634 69.831 1.00 80.97 ? 154 TRP D CA 1 ATOM 7712 C C . TRP E 2 166 ? 70.224 55.951 70.438 1.00 85.98 ? 154 TRP D C 1 ATOM 7713 O O . TRP E 2 166 ? 69.760 56.351 71.506 1.00 86.54 ? 154 TRP D O 1 ATOM 7714 C CB . TRP E 2 166 ? 68.355 54.778 69.253 1.00 80.28 ? 154 TRP D CB 1 ATOM 7715 C CG . TRP E 2 166 ? 67.994 53.663 68.325 1.00 79.35 ? 154 TRP D CG 1 ATOM 7716 C CD1 . TRP E 2 166 ? 67.373 52.492 68.650 1.00 76.60 ? 154 TRP D CD1 1 ATOM 7717 C CD2 . TRP E 2 166 ? 68.245 53.607 66.917 1.00 79.87 ? 154 TRP D CD2 1 ATOM 7718 N NE1 . TRP E 2 166 ? 67.217 51.713 67.529 1.00 74.40 ? 154 TRP D NE1 1 ATOM 7719 C CE2 . TRP E 2 166 ? 67.744 52.375 66.452 1.00 75.22 ? 154 TRP D CE2 1 ATOM 7720 C CE3 . TRP E 2 166 ? 68.842 54.480 66.003 1.00 83.59 ? 154 TRP D CE3 1 ATOM 7721 C CZ2 . TRP E 2 166 ? 67.822 51.996 65.114 1.00 73.27 ? 154 TRP D CZ2 1 ATOM 7722 C CZ3 . TRP E 2 166 ? 68.918 54.102 64.675 1.00 82.20 ? 154 TRP D CZ3 1 ATOM 7723 C CH2 . TRP E 2 166 ? 68.411 52.871 64.244 1.00 77.44 ? 154 TRP D CH2 1 ATOM 7724 N N . ASN E 2 167 ? 71.142 56.614 69.737 1.00 91.13 ? 155 ASN D N 1 ATOM 7725 C CA . ASN E 2 167 ? 71.748 57.859 70.198 1.00 95.77 ? 155 ASN D CA 1 ATOM 7726 C C . ASN E 2 167 ? 72.353 57.713 71.592 1.00 95.28 ? 155 ASN D C 1 ATOM 7727 O O . ASN E 2 167 ? 72.176 58.577 72.450 1.00 96.90 ? 155 ASN D O 1 ATOM 7728 C CB . ASN E 2 167 ? 70.722 58.996 70.178 1.00 97.08 ? 155 ASN D CB 1 ATOM 7729 C CG . ASN E 2 167 ? 70.220 59.304 68.778 1.00 95.68 ? 155 ASN D CG 1 ATOM 7730 O OD1 . ASN E 2 167 ? 70.313 58.472 67.876 1.00 93.39 ? 155 ASN D OD1 1 ATOM 7731 N ND2 . ASN E 2 167 ? 69.687 60.506 68.592 1.00 97.43 ? 155 ASN D ND2 1 ATOM 7732 N N . SER E 2 168 ? 73.062 56.604 71.798 1.00 93.28 ? 156 SER D N 1 ATOM 7733 C CA . SER E 2 168 ? 73.728 56.301 73.065 1.00 94.52 ? 156 SER D CA 1 ATOM 7734 C C . SER E 2 168 ? 72.761 56.296 74.246 1.00 92.52 ? 156 SER D C 1 ATOM 7735 O O . SER E 2 168 ? 73.130 56.659 75.362 1.00 95.44 ? 156 SER D O 1 ATOM 7736 C CB . SER E 2 168 ? 74.864 57.294 73.324 1.00 100.85 ? 156 SER D CB 1 ATOM 7737 O OG . SER E 2 168 ? 75.856 57.209 72.315 1.00 101.87 ? 156 SER D OG 1 ATOM 7738 N N . GLY E 2 169 ? 71.523 55.883 73.994 1.00 87.85 ? 157 GLY D N 1 ATOM 7739 C CA . GLY E 2 169 ? 70.530 55.772 75.046 1.00 83.52 ? 157 GLY D CA 1 ATOM 7740 C C . GLY E 2 169 ? 69.545 56.924 75.085 1.00 83.57 ? 157 GLY D C 1 ATOM 7741 O O . GLY E 2 169 ? 68.556 56.872 75.814 1.00 84.57 ? 157 GLY D O 1 ATOM 7742 N N . ALA E 2 170 ? 69.814 57.965 74.302 1.00 87.86 ? 158 ALA D N 1 ATOM 7743 C CA . ALA E 2 170 ? 68.945 59.139 74.264 1.00 90.10 ? 158 ALA D CA 1 ATOM 7744 C C . ALA E 2 170 ? 67.566 58.777 73.725 1.00 90.94 ? 158 ALA D C 1 ATOM 7745 O O . ALA E 2 170 ? 66.558 58.948 74.410 1.00 89.90 ? 158 ALA D O 1 ATOM 7746 C CB . ALA E 2 170 ? 69.572 60.239 73.424 1.00 92.89 ? 158 ALA D CB 1 ATOM 7747 N N . LEU E 2 171 ? 67.530 58.279 72.493 1.00 91.74 ? 159 LEU D N 1 ATOM 7748 C CA . LEU E 2 171 ? 66.286 57.809 71.899 1.00 86.62 ? 159 LEU D CA 1 ATOM 7749 C C . LEU E 2 171 ? 65.913 56.467 72.516 1.00 88.53 ? 159 LEU D C 1 ATOM 7750 O O . LEU E 2 171 ? 66.689 55.513 72.458 1.00 86.15 ? 159 LEU D O 1 ATOM 7751 C CB . LEU E 2 171 ? 66.423 57.688 70.379 1.00 78.80 ? 159 LEU D CB 1 ATOM 7752 C CG . LEU E 2 171 ? 65.219 58.076 69.514 1.00 75.91 ? 159 LEU D CG 1 ATOM 7753 C CD1 . LEU E 2 171 ? 65.551 57.906 68.039 1.00 78.04 ? 159 LEU D CD1 1 ATOM 7754 C CD2 . LEU E 2 171 ? 63.979 57.276 69.879 1.00 70.74 ? 159 LEU D CD2 1 ATOM 7755 N N . THR E 2 172 ? 64.727 56.397 73.111 1.00 95.85 ? 160 THR D N 1 ATOM 7756 C CA . THR E 2 172 ? 64.280 55.177 73.774 1.00 96.82 ? 160 THR D CA 1 ATOM 7757 C C . THR E 2 172 ? 62.816 54.861 73.485 1.00 97.34 ? 160 THR D C 1 ATOM 7758 O O . THR E 2 172 ? 62.409 53.699 73.515 1.00 96.04 ? 160 THR D O 1 ATOM 7759 C CB . THR E 2 172 ? 64.477 55.266 75.301 1.00 101.51 ? 160 THR D CB 1 ATOM 7760 O OG1 . THR E 2 172 ? 63.881 54.123 75.928 1.00 106.03 ? 160 THR D OG1 1 ATOM 7761 C CG2 . THR E 2 172 ? 63.837 56.530 75.854 1.00 103.84 ? 160 THR D CG2 1 ATOM 7762 N N . SER E 2 173 ? 62.029 55.895 73.204 1.00 100.68 ? 161 SER D N 1 ATOM 7763 C CA . SER E 2 173 ? 60.602 55.724 72.962 1.00 99.16 ? 161 SER D CA 1 ATOM 7764 C C . SER E 2 173 ? 60.312 55.442 71.492 1.00 94.67 ? 161 SER D C 1 ATOM 7765 O O . SER E 2 173 ? 60.954 56.002 70.604 1.00 92.68 ? 161 SER D O 1 ATOM 7766 C CB . SER E 2 173 ? 59.831 56.962 73.423 1.00 102.01 ? 161 SER D CB 1 ATOM 7767 O OG . SER E 2 173 ? 59.981 57.162 74.818 1.00 103.06 ? 161 SER D OG 1 ATOM 7768 N N . GLY E 2 174 ? 59.340 54.570 71.244 1.00 94.23 ? 162 GLY D N 1 ATOM 7769 C CA . GLY E 2 174 ? 58.979 54.192 69.891 1.00 92.71 ? 162 GLY D CA 1 ATOM 7770 C C . GLY E 2 174 ? 60.017 53.285 69.260 1.00 87.81 ? 162 GLY D C 1 ATOM 7771 O O . GLY E 2 174 ? 60.100 53.179 68.037 1.00 89.73 ? 162 GLY D O 1 ATOM 7772 N N . VAL E 2 175 ? 60.808 52.628 70.102 1.00 82.81 ? 163 VAL D N 1 ATOM 7773 C CA . VAL E 2 175 ? 61.872 51.749 69.632 1.00 81.47 ? 163 VAL D CA 1 ATOM 7774 C C . VAL E 2 175 ? 61.496 50.277 69.796 1.00 82.79 ? 163 VAL D C 1 ATOM 7775 O O . VAL E 2 175 ? 61.037 49.859 70.858 1.00 87.69 ? 163 VAL D O 1 ATOM 7776 C CB . VAL E 2 175 ? 63.192 52.019 70.382 1.00 76.28 ? 163 VAL D CB 1 ATOM 7777 C CG1 . VAL E 2 175 ? 64.297 51.111 69.864 1.00 74.31 ? 163 VAL D CG1 1 ATOM 7778 C CG2 . VAL E 2 175 ? 63.591 53.479 70.246 1.00 75.76 ? 163 VAL D CG2 1 ATOM 7779 N N . HIS E 2 176 ? 61.692 49.498 68.736 1.00 78.05 ? 164 HIS D N 1 ATOM 7780 C CA . HIS E 2 176 ? 61.412 48.067 68.774 1.00 74.24 ? 164 HIS D CA 1 ATOM 7781 C C . HIS E 2 176 ? 62.611 47.245 68.318 1.00 73.23 ? 164 HIS D C 1 ATOM 7782 O O . HIS E 2 176 ? 62.887 47.141 67.123 1.00 74.81 ? 164 HIS D O 1 ATOM 7783 C CB . HIS E 2 176 ? 60.198 47.731 67.904 1.00 75.97 ? 164 HIS D CB 1 ATOM 7784 C CG . HIS E 2 176 ? 58.895 48.180 68.485 1.00 81.69 ? 164 HIS D CG 1 ATOM 7785 N ND1 . HIS E 2 176 ? 58.274 47.517 69.521 1.00 85.08 ? 164 HIS D ND1 1 ATOM 7786 C CD2 . HIS E 2 176 ? 58.092 49.225 68.172 1.00 84.63 ? 164 HIS D CD2 1 ATOM 7787 C CE1 . HIS E 2 176 ? 57.146 48.135 69.823 1.00 87.47 ? 164 HIS D CE1 1 ATOM 7788 N NE2 . HIS E 2 176 ? 57.012 49.174 69.019 1.00 85.59 ? 164 HIS D NE2 1 ATOM 7789 N N . THR E 2 177 ? 63.324 46.666 69.277 1.00 71.21 ? 165 THR D N 1 ATOM 7790 C CA . THR E 2 177 ? 64.411 45.751 68.966 1.00 66.76 ? 165 THR D CA 1 ATOM 7791 C C . THR E 2 177 ? 63.871 44.325 68.925 1.00 65.85 ? 165 THR D C 1 ATOM 7792 O O . THR E 2 177 ? 63.596 43.723 69.963 1.00 66.89 ? 165 THR D O 1 ATOM 7793 C CB . THR E 2 177 ? 65.557 45.854 69.991 1.00 63.74 ? 165 THR D CB 1 ATOM 7794 O OG1 . THR E 2 177 ? 66.055 47.197 70.018 1.00 62.15 ? 165 THR D OG1 1 ATOM 7795 C CG2 . THR E 2 177 ? 66.690 44.912 69.620 1.00 61.49 ? 165 THR D CG2 1 ATOM 7796 N N . PHE E 2 178 ? 63.708 43.799 67.716 1.00 66.78 ? 166 PHE D N 1 ATOM 7797 C CA . PHE E 2 178 ? 63.118 42.478 67.519 1.00 69.88 ? 166 PHE D CA 1 ATOM 7798 C C . PHE E 2 178 ? 64.062 41.362 67.953 1.00 69.30 ? 166 PHE D C 1 ATOM 7799 O O . PHE E 2 178 ? 65.281 41.516 67.888 1.00 68.77 ? 166 PHE D O 1 ATOM 7800 C CB . PHE E 2 178 ? 62.721 42.288 66.052 1.00 70.55 ? 166 PHE D CB 1 ATOM 7801 C CG . PHE E 2 178 ? 61.566 43.146 65.623 1.00 73.17 ? 166 PHE D CG 1 ATOM 7802 C CD1 . PHE E 2 178 ? 61.774 44.439 65.173 1.00 72.92 ? 166 PHE D CD1 1 ATOM 7803 C CD2 . PHE E 2 178 ? 60.271 42.660 65.674 1.00 76.24 ? 166 PHE D CD2 1 ATOM 7804 C CE1 . PHE E 2 178 ? 60.710 45.230 64.780 1.00 75.46 ? 166 PHE D CE1 1 ATOM 7805 C CE2 . PHE E 2 178 ? 59.205 43.446 65.283 1.00 77.82 ? 166 PHE D CE2 1 ATOM 7806 C CZ . PHE E 2 178 ? 59.425 44.732 64.836 1.00 77.80 ? 166 PHE D CZ 1 ATOM 7807 N N . PRO E 2 179 ? 63.494 40.234 68.413 1.00 69.48 ? 167 PRO D N 1 ATOM 7808 C CA . PRO E 2 179 ? 64.295 39.062 68.777 1.00 65.67 ? 167 PRO D CA 1 ATOM 7809 C C . PRO E 2 179 ? 65.081 38.540 67.585 1.00 65.07 ? 167 PRO D C 1 ATOM 7810 O O . PRO E 2 179 ? 64.514 38.385 66.505 1.00 66.56 ? 167 PRO D O 1 ATOM 7811 C CB . PRO E 2 179 ? 63.244 38.041 69.228 1.00 67.04 ? 167 PRO D CB 1 ATOM 7812 C CG . PRO E 2 179 ? 62.065 38.857 69.622 1.00 70.41 ? 167 PRO D CG 1 ATOM 7813 C CD . PRO E 2 179 ? 62.061 40.026 68.687 1.00 72.64 ? 167 PRO D CD 1 ATOM 7814 N N . ALA E 2 180 ? 66.370 38.285 67.774 1.00 64.48 ? 168 ALA D N 1 ATOM 7815 C CA . ALA E 2 180 ? 67.199 37.765 66.695 1.00 64.29 ? 168 ALA D CA 1 ATOM 7816 C C . ALA E 2 180 ? 66.706 36.391 66.265 1.00 63.05 ? 168 ALA D C 1 ATOM 7817 O O . ALA E 2 180 ? 66.132 35.649 67.065 1.00 63.62 ? 168 ALA D O 1 ATOM 7818 C CB . ALA E 2 180 ? 68.650 37.698 67.123 1.00 66.71 ? 168 ALA D CB 1 ATOM 7819 N N . VAL E 2 181 ? 66.920 36.060 64.998 1.00 58.39 ? 169 VAL D N 1 ATOM 7820 C CA . VAL E 2 181 ? 66.515 34.762 64.483 1.00 59.48 ? 169 VAL D CA 1 ATOM 7821 C C . VAL E 2 181 ? 67.748 34.002 63.996 1.00 62.73 ? 169 VAL D C 1 ATOM 7822 O O . VAL E 2 181 ? 68.764 34.608 63.650 1.00 58.54 ? 169 VAL D O 1 ATOM 7823 C CB . VAL E 2 181 ? 65.475 34.905 63.349 1.00 60.49 ? 169 VAL D CB 1 ATOM 7824 C CG1 . VAL E 2 181 ? 66.155 35.206 62.020 1.00 58.99 ? 169 VAL D CG1 1 ATOM 7825 C CG2 . VAL E 2 181 ? 64.618 33.653 63.250 1.00 66.35 ? 169 VAL D CG2 1 ATOM 7826 N N . LEU E 2 182 ? 67.667 32.675 63.996 1.00 68.65 ? 170 LEU D N 1 ATOM 7827 C CA . LEU E 2 182 ? 68.796 31.845 63.594 1.00 69.26 ? 170 LEU D CA 1 ATOM 7828 C C . LEU E 2 182 ? 68.701 31.473 62.121 1.00 74.01 ? 170 LEU D C 1 ATOM 7829 O O . LEU E 2 182 ? 67.825 30.709 61.715 1.00 78.99 ? 170 LEU D O 1 ATOM 7830 C CB . LEU E 2 182 ? 68.870 30.580 64.456 1.00 70.84 ? 170 LEU D CB 1 ATOM 7831 C CG . LEU E 2 182 ? 70.053 29.642 64.203 1.00 68.42 ? 170 LEU D CG 1 ATOM 7832 C CD1 . LEU E 2 182 ? 71.373 30.365 64.422 1.00 64.37 ? 170 LEU D CD1 1 ATOM 7833 C CD2 . LEU E 2 182 ? 69.963 28.410 65.089 1.00 69.24 ? 170 LEU D CD2 1 ATOM 7834 N N . GLN E 2 183 ? 69.609 32.022 61.323 1.00 74.57 ? 171 GLN D N 1 ATOM 7835 C CA . GLN E 2 183 ? 69.642 31.751 59.892 1.00 79.04 ? 171 GLN D CA 1 ATOM 7836 C C . GLN E 2 183 ? 70.194 30.358 59.607 1.00 82.63 ? 171 GLN D C 1 ATOM 7837 O O . GLN E 2 183 ? 70.685 29.678 60.508 1.00 84.75 ? 171 GLN D O 1 ATOM 7838 C CB . GLN E 2 183 ? 70.473 32.813 59.174 1.00 80.03 ? 171 GLN D CB 1 ATOM 7839 C CG . GLN E 2 183 ? 69.885 34.210 59.277 1.00 79.96 ? 171 GLN D CG 1 ATOM 7840 C CD . GLN E 2 183 ? 70.867 35.292 58.876 1.00 75.75 ? 171 GLN D CD 1 ATOM 7841 O OE1 . GLN E 2 183 ? 70.555 36.155 58.055 1.00 77.14 ? 171 GLN D OE1 1 ATOM 7842 N NE2 . GLN E 2 183 ? 72.058 35.258 59.462 1.00 72.15 ? 171 GLN D NE2 1 ATOM 7843 N N . SER E 2 184 ? 70.111 29.937 58.349 1.00 80.98 ? 172 SER D N 1 ATOM 7844 C CA . SER E 2 184 ? 70.551 28.602 57.960 1.00 80.95 ? 172 SER D CA 1 ATOM 7845 C C . SER E 2 184 ? 72.070 28.472 58.015 1.00 79.11 ? 172 SER D C 1 ATOM 7846 O O . SER E 2 184 ? 72.607 27.364 58.003 1.00 80.07 ? 172 SER D O 1 ATOM 7847 C CB . SER E 2 184 ? 70.048 28.262 56.556 1.00 85.34 ? 172 SER D CB 1 ATOM 7848 O OG . SER E 2 184 ? 70.567 29.166 55.596 1.00 87.41 ? 172 SER D OG 1 ATOM 7849 N N . SER E 2 185 ? 72.756 29.609 58.082 1.00 76.09 ? 173 SER D N 1 ATOM 7850 C CA . SER E 2 185 ? 74.214 29.630 58.130 1.00 74.38 ? 173 SER D CA 1 ATOM 7851 C C . SER E 2 185 ? 74.742 29.345 59.533 1.00 79.65 ? 173 SER D C 1 ATOM 7852 O O . SER E 2 185 ? 75.945 29.168 59.728 1.00 86.42 ? 173 SER D O 1 ATOM 7853 C CB . SER E 2 185 ? 74.741 30.981 57.645 1.00 68.08 ? 173 SER D CB 1 ATOM 7854 O OG . SER E 2 185 ? 74.253 32.037 58.455 1.00 64.08 ? 173 SER D OG 1 ATOM 7855 N N . GLY E 2 186 ? 73.838 29.304 60.506 1.00 78.96 ? 174 GLY D N 1 ATOM 7856 C CA . GLY E 2 186 ? 74.219 29.097 61.891 1.00 81.21 ? 174 GLY D CA 1 ATOM 7857 C C . GLY E 2 186 ? 74.482 30.411 62.600 1.00 82.85 ? 174 GLY D C 1 ATOM 7858 O O . GLY E 2 186 ? 74.861 30.435 63.771 1.00 87.17 ? 174 GLY D O 1 ATOM 7859 N N . LEU E 2 187 ? 74.277 31.510 61.882 1.00 80.75 ? 175 LEU D N 1 ATOM 7860 C CA . LEU E 2 187 ? 74.481 32.843 62.437 1.00 76.27 ? 175 LEU D CA 1 ATOM 7861 C C . LEU E 2 187 ? 73.145 33.506 62.760 1.00 71.57 ? 175 LEU D C 1 ATOM 7862 O O . LEU E 2 187 ? 72.115 33.161 62.181 1.00 74.79 ? 175 LEU D O 1 ATOM 7863 C CB . LEU E 2 187 ? 75.284 33.709 61.464 1.00 73.59 ? 175 LEU D CB 1 ATOM 7864 C CG . LEU E 2 187 ? 76.620 33.123 61.000 1.00 76.87 ? 175 LEU D CG 1 ATOM 7865 C CD1 . LEU E 2 187 ? 77.290 34.034 59.983 1.00 78.59 ? 175 LEU D CD1 1 ATOM 7866 C CD2 . LEU E 2 187 ? 77.539 32.867 62.187 1.00 78.82 ? 175 LEU D CD2 1 ATOM 7867 N N . TYR E 2 188 ? 73.169 34.458 63.686 1.00 66.58 ? 176 TYR D N 1 ATOM 7868 C CA . TYR E 2 188 ? 71.956 35.155 64.097 1.00 68.80 ? 176 TYR D CA 1 ATOM 7869 C C . TYR E 2 188 ? 71.781 36.474 63.349 1.00 75.86 ? 176 TYR D C 1 ATOM 7870 O O . TYR E 2 188 ? 72.755 37.106 62.942 1.00 74.66 ? 176 TYR D O 1 ATOM 7871 C CB . TYR E 2 188 ? 71.969 35.411 65.607 1.00 63.80 ? 176 TYR D CB 1 ATOM 7872 C CG . TYR E 2 188 ? 71.982 34.153 66.448 1.00 64.22 ? 176 TYR D CG 1 ATOM 7873 C CD1 . TYR E 2 188 ? 70.798 33.530 66.821 1.00 60.47 ? 176 TYR D CD1 1 ATOM 7874 C CD2 . TYR E 2 188 ? 73.180 33.592 66.873 1.00 67.33 ? 176 TYR D CD2 1 ATOM 7875 C CE1 . TYR E 2 188 ? 70.807 32.381 67.590 1.00 63.63 ? 176 TYR D CE1 1 ATOM 7876 C CE2 . TYR E 2 188 ? 73.198 32.444 67.644 1.00 70.03 ? 176 TYR D CE2 1 ATOM 7877 C CZ . TYR E 2 188 ? 72.010 31.843 67.999 1.00 67.30 ? 176 TYR D CZ 1 ATOM 7878 O OH . TYR E 2 188 ? 72.026 30.700 68.765 1.00 70.58 ? 176 TYR D OH 1 ATOM 7879 N N . SER E 2 189 ? 70.528 36.881 63.170 1.00 81.69 ? 177 SER D N 1 ATOM 7880 C CA . SER E 2 189 ? 70.216 38.145 62.514 1.00 81.13 ? 177 SER D CA 1 ATOM 7881 C C . SER E 2 189 ? 69.125 38.892 63.273 1.00 79.05 ? 177 SER D C 1 ATOM 7882 O O . SER E 2 189 ? 67.989 38.427 63.370 1.00 79.18 ? 177 SER D O 1 ATOM 7883 C CB . SER E 2 189 ? 69.788 37.910 61.064 1.00 87.05 ? 177 SER D CB 1 ATOM 7884 O OG . SER E 2 189 ? 69.481 39.133 60.419 1.00 88.40 ? 177 SER D OG 1 ATOM 7885 N N . LEU E 2 190 ? 69.479 40.054 63.812 1.00 76.43 ? 178 LEU D N 1 ATOM 7886 C CA . LEU E 2 190 ? 68.552 40.840 64.615 1.00 71.53 ? 178 LEU D CA 1 ATOM 7887 C C . LEU E 2 190 ? 68.120 42.098 63.873 1.00 73.27 ? 178 LEU D C 1 ATOM 7888 O O . LEU E 2 190 ? 68.887 42.667 63.096 1.00 75.48 ? 178 LEU D O 1 ATOM 7889 C CB . LEU E 2 190 ? 69.196 41.201 65.959 1.00 67.35 ? 178 LEU D CB 1 ATOM 7890 C CG . LEU E 2 190 ? 68.401 42.015 66.983 1.00 65.34 ? 178 LEU D CG 1 ATOM 7891 C CD1 . LEU E 2 190 ? 68.698 41.525 68.392 1.00 69.55 ? 178 LEU D CD1 1 ATOM 7892 C CD2 . LEU E 2 190 ? 68.722 43.498 66.863 1.00 59.82 ? 178 LEU D CD2 1 ATOM 7893 N N . SER E 2 191 ? 66.885 42.525 64.111 1.00 75.07 ? 179 SER D N 1 ATOM 7894 C CA . SER E 2 191 ? 66.379 43.765 63.535 1.00 76.87 ? 179 SER D CA 1 ATOM 7895 C C . SER E 2 191 ? 65.917 44.720 64.631 1.00 74.14 ? 179 SER D C 1 ATOM 7896 O O . SER E 2 191 ? 65.252 44.312 65.583 1.00 74.65 ? 179 SER D O 1 ATOM 7897 C CB . SER E 2 191 ? 65.234 43.479 62.561 1.00 82.96 ? 179 SER D CB 1 ATOM 7898 O OG . SER E 2 191 ? 64.233 42.683 63.172 1.00 87.84 ? 179 SER D OG 1 ATOM 7899 N N . SER E 2 192 ? 66.281 45.990 64.494 1.00 69.66 ? 180 SER D N 1 ATOM 7900 C CA . SER E 2 192 ? 65.885 47.012 65.456 1.00 70.86 ? 180 SER D CA 1 ATOM 7901 C C . SER E 2 192 ? 65.423 48.271 64.733 1.00 72.73 ? 180 SER D C 1 ATOM 7902 O O . SER E 2 192 ? 66.177 48.860 63.962 1.00 74.56 ? 180 SER D O 1 ATOM 7903 C CB . SER E 2 192 ? 67.042 47.339 66.404 1.00 72.27 ? 180 SER D CB 1 ATOM 7904 O OG . SER E 2 192 ? 66.655 48.299 67.372 1.00 74.80 ? 180 SER D OG 1 ATOM 7905 N N . VAL E 2 193 ? 64.182 48.678 64.982 1.00 72.44 ? 181 VAL D N 1 ATOM 7906 C CA . VAL E 2 193 ? 63.613 49.842 64.311 1.00 72.85 ? 181 VAL D CA 1 ATOM 7907 C C . VAL E 2 193 ? 63.079 50.876 65.297 1.00 73.95 ? 181 VAL D C 1 ATOM 7908 O O . VAL E 2 193 ? 62.821 50.567 66.461 1.00 72.44 ? 181 VAL D O 1 ATOM 7909 C CB . VAL E 2 193 ? 62.475 49.438 63.357 1.00 71.16 ? 181 VAL D CB 1 ATOM 7910 C CG1 . VAL E 2 193 ? 63.013 48.583 62.220 1.00 70.52 ? 181 VAL D CG1 1 ATOM 7911 C CG2 . VAL E 2 193 ? 61.379 48.705 64.117 1.00 66.48 ? 181 VAL D CG2 1 ATOM 7912 N N . VAL E 2 194 ? 62.916 52.106 64.819 1.00 76.37 ? 182 VAL D N 1 ATOM 7913 C CA . VAL E 2 194 ? 62.400 53.195 65.642 1.00 79.72 ? 182 VAL D CA 1 ATOM 7914 C C . VAL E 2 194 ? 61.617 54.201 64.799 1.00 84.99 ? 182 VAL D C 1 ATOM 7915 O O . VAL E 2 194 ? 62.113 54.706 63.791 1.00 84.51 ? 182 VAL D O 1 ATOM 7916 C CB . VAL E 2 194 ? 63.539 53.924 66.392 1.00 83.02 ? 182 VAL D CB 1 ATOM 7917 C CG1 . VAL E 2 194 ? 64.727 54.165 65.468 1.00 88.53 ? 182 VAL D CG1 1 ATOM 7918 C CG2 . VAL E 2 194 ? 63.039 55.229 66.994 1.00 83.85 ? 182 VAL D CG2 1 ATOM 7919 N N . THR E 2 195 ? 60.384 54.481 65.215 1.00 87.49 ? 183 THR D N 1 ATOM 7920 C CA . THR E 2 195 ? 59.530 55.425 64.502 1.00 86.38 ? 183 THR D CA 1 ATOM 7921 C C . THR E 2 195 ? 59.766 56.854 64.981 1.00 81.44 ? 183 THR D C 1 ATOM 7922 O O . THR E 2 195 ? 59.788 57.123 66.182 1.00 79.86 ? 183 THR D O 1 ATOM 7923 C CB . THR E 2 195 ? 58.040 55.076 64.668 1.00 87.99 ? 183 THR D CB 1 ATOM 7924 O OG1 . THR E 2 195 ? 57.719 54.999 66.062 1.00 88.00 ? 183 THR D OG1 1 ATOM 7925 C CG2 . THR E 2 195 ? 57.732 53.743 64.010 1.00 87.02 ? 183 THR D CG2 1 ATOM 7926 N N . VAL E 2 196 ? 59.948 57.763 64.028 1.00 80.85 ? 184 VAL D N 1 ATOM 7927 C CA . VAL E 2 196 ? 60.235 59.161 64.328 1.00 82.13 ? 184 VAL D CA 1 ATOM 7928 C C . VAL E 2 196 ? 59.417 60.087 63.429 1.00 90.47 ? 184 VAL D C 1 ATOM 7929 O O . VAL E 2 196 ? 59.008 59.688 62.337 1.00 93.38 ? 184 VAL D O 1 ATOM 7930 C CB . VAL E 2 196 ? 61.738 59.478 64.151 1.00 79.18 ? 184 VAL D CB 1 ATOM 7931 C CG1 . VAL E 2 196 ? 62.569 58.766 65.213 1.00 75.39 ? 184 VAL D CG1 1 ATOM 7932 C CG2 . VAL E 2 196 ? 62.200 59.099 62.753 1.00 78.03 ? 184 VAL D CG2 1 ATOM 7933 N N . PRO E 2 197 ? 59.164 61.324 63.889 1.00 93.96 ? 185 PRO D N 1 ATOM 7934 C CA . PRO E 2 197 ? 58.484 62.315 63.046 1.00 101.35 ? 185 PRO D CA 1 ATOM 7935 C C . PRO E 2 197 ? 59.276 62.636 61.779 1.00 105.62 ? 185 PRO D C 1 ATOM 7936 O O . PRO E 2 197 ? 60.505 62.579 61.786 1.00 105.35 ? 185 PRO D O 1 ATOM 7937 C CB . PRO E 2 197 ? 58.380 63.546 63.956 1.00 102.61 ? 185 PRO D CB 1 ATOM 7938 C CG . PRO E 2 197 ? 59.386 63.323 65.038 1.00 96.43 ? 185 PRO D CG 1 ATOM 7939 C CD . PRO E 2 197 ? 59.418 61.845 65.243 1.00 91.86 ? 185 PRO D CD 1 ATOM 7940 N N . SER E 2 198 ? 58.568 62.972 60.705 1.00 110.58 ? 186 SER D N 1 ATOM 7941 C CA . SER E 2 198 ? 59.195 63.202 59.409 1.00 115.97 ? 186 SER D CA 1 ATOM 7942 C C . SER E 2 198 ? 59.931 64.537 59.338 1.00 121.95 ? 186 SER D C 1 ATOM 7943 O O . SER E 2 198 ? 60.691 64.783 58.402 1.00 126.79 ? 186 SER D O 1 ATOM 7944 C CB . SER E 2 198 ? 58.146 63.132 58.298 1.00 121.87 ? 186 SER D CB 1 ATOM 7945 O OG . SER E 2 198 ? 57.493 61.876 58.295 1.00 119.45 ? 186 SER D OG 1 ATOM 7946 N N . SER E 2 199 ? 59.706 65.396 60.327 1.00 122.10 ? 187 SER D N 1 ATOM 7947 C CA . SER E 2 199 ? 60.323 66.717 60.340 1.00 127.40 ? 187 SER D CA 1 ATOM 7948 C C . SER E 2 199 ? 61.707 66.697 60.983 1.00 123.79 ? 187 SER D C 1 ATOM 7949 O O . SER E 2 199 ? 62.413 67.706 60.986 1.00 128.27 ? 187 SER D O 1 ATOM 7950 C CB . SER E 2 199 ? 59.424 67.718 61.069 1.00 131.06 ? 187 SER D CB 1 ATOM 7951 O OG . SER E 2 199 ? 58.189 67.880 60.393 1.00 136.19 ? 187 SER D OG 1 ATOM 7952 N N . SER E 2 200 ? 62.090 65.546 61.526 1.00 116.69 ? 188 SER D N 1 ATOM 7953 C CA . SER E 2 200 ? 63.378 65.411 62.197 1.00 114.40 ? 188 SER D CA 1 ATOM 7954 C C . SER E 2 200 ? 64.342 64.541 61.398 1.00 115.30 ? 188 SER D C 1 ATOM 7955 O O . SER E 2 200 ? 65.337 64.048 61.933 1.00 112.46 ? 188 SER D O 1 ATOM 7956 C CB . SER E 2 200 ? 63.192 64.826 63.598 1.00 105.97 ? 188 SER D CB 1 ATOM 7957 O OG . SER E 2 200 ? 62.705 63.498 63.531 1.00 99.87 ? 188 SER D OG 1 ATOM 7958 N N . LEU E 2 201 ? 64.044 64.351 60.117 1.00 118.31 ? 189 LEU D N 1 ATOM 7959 C CA . LEU E 2 201 ? 64.889 63.534 59.254 1.00 117.03 ? 189 LEU D CA 1 ATOM 7960 C C . LEU E 2 201 ? 65.995 64.370 58.620 1.00 119.89 ? 189 LEU D C 1 ATOM 7961 O O . LEU E 2 201 ? 66.799 63.862 57.838 1.00 118.91 ? 189 LEU D O 1 ATOM 7962 C CB . LEU E 2 201 ? 64.051 62.852 58.171 1.00 120.09 ? 189 LEU D CB 1 ATOM 7963 C CG . LEU E 2 201 ? 63.096 61.755 58.647 1.00 113.81 ? 189 LEU D CG 1 ATOM 7964 C CD1 . LEU E 2 201 ? 62.270 61.219 57.488 1.00 118.49 ? 189 LEU D CD1 1 ATOM 7965 C CD2 . LEU E 2 201 ? 63.865 60.630 59.324 1.00 103.85 ? 189 LEU D CD2 1 ATOM 7966 N N . GLY E 2 202 ? 66.032 65.653 58.964 1.00 106.97 ? 190 GLY D N 1 ATOM 7967 C CA . GLY E 2 202 ? 67.047 66.550 58.445 1.00 112.65 ? 190 GLY D CA 1 ATOM 7968 C C . GLY E 2 202 ? 67.774 67.310 59.539 1.00 119.72 ? 190 GLY D C 1 ATOM 7969 O O . GLY E 2 202 ? 68.691 68.085 59.264 1.00 119.59 ? 190 GLY D O 1 ATOM 7970 N N . THR E 2 203 ? 67.366 67.086 60.784 1.00 127.55 ? 191 THR D N 1 ATOM 7971 C CA . THR E 2 203 ? 67.962 67.780 61.921 1.00 134.34 ? 191 THR D CA 1 ATOM 7972 C C . THR E 2 203 ? 68.622 66.808 62.895 1.00 133.17 ? 191 THR D C 1 ATOM 7973 O O . THR E 2 203 ? 69.791 66.965 63.246 1.00 135.97 ? 191 THR D O 1 ATOM 7974 C CB . THR E 2 203 ? 66.914 68.616 62.681 1.00 141.64 ? 191 THR D CB 1 ATOM 7975 O OG1 . THR E 2 203 ? 66.285 69.535 61.780 1.00 144.75 ? 191 THR D OG1 1 ATOM 7976 C CG2 . THR E 2 203 ? 67.569 69.390 63.816 1.00 149.80 ? 191 THR D CG2 1 ATOM 7977 N N . GLN E 2 204 ? 67.864 65.805 63.329 1.00 130.01 ? 192 GLN D N 1 ATOM 7978 C CA . GLN E 2 204 ? 68.357 64.824 64.291 1.00 125.65 ? 192 GLN D CA 1 ATOM 7979 C C . GLN E 2 204 ? 69.221 63.758 63.625 1.00 116.76 ? 192 GLN D C 1 ATOM 7980 O O . GLN E 2 204 ? 68.888 63.258 62.552 1.00 110.38 ? 192 GLN D O 1 ATOM 7981 C CB . GLN E 2 204 ? 67.188 64.162 65.024 1.00 124.04 ? 192 GLN D CB 1 ATOM 7982 C CG . GLN E 2 204 ? 66.432 65.091 65.960 1.00 130.29 ? 192 GLN D CG 1 ATOM 7983 C CD . GLN E 2 204 ? 67.213 65.413 67.219 1.00 134.91 ? 192 GLN D CD 1 ATOM 7984 O OE1 . GLN E 2 204 ? 68.147 64.698 67.584 1.00 134.09 ? 192 GLN D OE1 1 ATOM 7985 N NE2 . GLN E 2 204 ? 66.834 66.495 67.891 1.00 140.05 ? 192 GLN D NE2 1 ATOM 7986 N N . THR E 2 205 ? 70.331 63.415 64.271 1.00 117.86 ? 193 THR D N 1 ATOM 7987 C CA . THR E 2 205 ? 71.220 62.374 63.769 1.00 114.61 ? 193 THR D CA 1 ATOM 7988 C C . THR E 2 205 ? 70.951 61.051 64.480 1.00 112.50 ? 193 THR D C 1 ATOM 7989 O O . THR E 2 205 ? 71.407 60.834 65.604 1.00 114.83 ? 193 THR D O 1 ATOM 7990 C CB . THR E 2 205 ? 72.703 62.756 63.944 1.00 115.55 ? 193 THR D CB 1 ATOM 7991 O OG1 . THR E 2 205 ? 72.986 62.958 65.334 1.00 119.30 ? 193 THR D OG1 1 ATOM 7992 C CG2 . THR E 2 205 ? 73.020 64.030 63.176 1.00 118.33 ? 193 THR D CG2 1 ATOM 7993 N N . TYR E 2 206 ? 70.204 60.173 63.819 1.00 106.40 ? 194 TYR D N 1 ATOM 7994 C CA . TYR E 2 206 ? 69.841 58.884 64.395 1.00 102.43 ? 194 TYR D CA 1 ATOM 7995 C C . TYR E 2 206 ? 70.959 57.865 64.218 1.00 97.10 ? 194 TYR D C 1 ATOM 7996 O O . TYR E 2 206 ? 71.169 57.343 63.123 1.00 94.95 ? 194 TYR D O 1 ATOM 7997 C CB . TYR E 2 206 ? 68.548 58.368 63.764 1.00 102.15 ? 194 TYR D CB 1 ATOM 7998 C CG . TYR E 2 206 ? 67.362 59.274 64.000 1.00 108.91 ? 194 TYR D CG 1 ATOM 7999 C CD1 . TYR E 2 206 ? 67.082 59.766 65.269 1.00 115.27 ? 194 TYR D CD1 1 ATOM 8000 C CD2 . TYR E 2 206 ? 66.532 59.653 62.954 1.00 107.72 ? 194 TYR D CD2 1 ATOM 8001 C CE1 . TYR E 2 206 ? 66.002 60.598 65.491 1.00 118.62 ? 194 TYR D CE1 1 ATOM 8002 C CE2 . TYR E 2 206 ? 65.451 60.485 63.165 1.00 110.65 ? 194 TYR D CE2 1 ATOM 8003 C CZ . TYR E 2 206 ? 65.191 60.954 64.435 1.00 116.14 ? 194 TYR D CZ 1 ATOM 8004 O OH . TYR E 2 206 ? 64.115 61.784 64.651 1.00 119.87 ? 194 TYR D OH 1 ATOM 8005 N N . ILE E 2 207 ? 71.674 57.588 65.303 1.00 97.37 ? 195 ILE D N 1 ATOM 8006 C CA . ILE E 2 207 ? 72.801 56.663 65.264 1.00 92.40 ? 195 ILE D CA 1 ATOM 8007 C C . ILE E 2 207 ? 72.467 55.338 65.944 1.00 94.45 ? 195 ILE D C 1 ATOM 8008 O O . ILE E 2 207 ? 72.018 55.306 67.089 1.00 91.14 ? 195 ILE D O 1 ATOM 8009 C CB . ILE E 2 207 ? 74.051 57.271 65.928 1.00 87.52 ? 195 ILE D CB 1 ATOM 8010 C CG1 . ILE E 2 207 ? 74.480 58.539 65.187 1.00 87.69 ? 195 ILE D CG1 1 ATOM 8011 C CG2 . ILE E 2 207 ? 75.188 56.259 65.962 1.00 79.93 ? 195 ILE D CG2 1 ATOM 8012 C CD1 . ILE E 2 207 ? 75.720 59.191 65.757 1.00 92.20 ? 195 ILE D CD1 1 ATOM 8013 N N . CYS E 2 208 ? 72.691 54.247 65.220 1.00 98.65 ? 196 CYS D N 1 ATOM 8014 C CA . CYS E 2 208 ? 72.439 52.906 65.728 1.00 97.29 ? 196 CYS D CA 1 ATOM 8015 C C . CYS E 2 208 ? 73.633 52.405 66.539 1.00 95.97 ? 196 CYS D C 1 ATOM 8016 O O . CYS E 2 208 ? 74.748 52.327 66.026 1.00 97.79 ? 196 CYS D O 1 ATOM 8017 C CB . CYS E 2 208 ? 72.140 51.954 64.567 1.00 95.25 ? 196 CYS D CB 1 ATOM 8018 S SG . CYS E 2 208 ? 71.652 50.284 65.042 1.00 138.29 ? 196 CYS D SG 1 ATOM 8019 N N . ASN E 2 209 ? 73.398 52.072 67.804 1.00 90.83 ? 197 ASN D N 1 ATOM 8020 C CA . ASN E 2 209 ? 74.469 51.599 68.677 1.00 85.25 ? 197 ASN D CA 1 ATOM 8021 C C . ASN E 2 209 ? 74.423 50.090 68.895 1.00 79.42 ? 197 ASN D C 1 ATOM 8022 O O . ASN E 2 209 ? 73.668 49.599 69.732 1.00 78.58 ? 197 ASN D O 1 ATOM 8023 C CB . ASN E 2 209 ? 74.410 52.314 70.027 1.00 88.26 ? 197 ASN D CB 1 ATOM 8024 C CG . ASN E 2 209 ? 74.526 53.817 69.895 1.00 92.61 ? 197 ASN D CG 1 ATOM 8025 O OD1 . ASN E 2 209 ? 73.624 54.556 70.289 1.00 98.47 ? 197 ASN D OD1 1 ATOM 8026 N ND2 . ASN E 2 209 ? 75.639 54.280 69.338 1.00 91.65 ? 197 ASN D ND2 1 ATOM 8027 N N . VAL E 2 210 ? 75.241 49.359 68.144 1.00 81.13 ? 198 VAL D N 1 ATOM 8028 C CA . VAL E 2 210 ? 75.277 47.904 68.240 1.00 87.61 ? 198 VAL D CA 1 ATOM 8029 C C . VAL E 2 210 ? 76.525 47.431 68.984 1.00 103.21 ? 198 VAL D C 1 ATOM 8030 O O . VAL E 2 210 ? 77.634 47.884 68.702 1.00 99.45 ? 198 VAL D O 1 ATOM 8031 C CB . VAL E 2 210 ? 75.238 47.248 66.846 1.00 77.98 ? 198 VAL D CB 1 ATOM 8032 C CG1 . VAL E 2 210 ? 75.149 45.734 66.969 1.00 74.01 ? 198 VAL D CG1 1 ATOM 8033 C CG2 . VAL E 2 210 ? 74.068 47.788 66.043 1.00 76.12 ? 198 VAL D CG2 1 ATOM 8034 N N . ASN E 2 211 ? 76.337 46.522 69.937 1.00 118.64 ? 199 ASN D N 1 ATOM 8035 C CA . ASN E 2 211 ? 77.446 45.990 70.721 1.00 121.19 ? 199 ASN D CA 1 ATOM 8036 C C . ASN E 2 211 ? 77.439 44.464 70.784 1.00 117.20 ? 199 ASN D C 1 ATOM 8037 O O . ASN E 2 211 ? 76.447 43.855 71.184 1.00 120.53 ? 199 ASN D O 1 ATOM 8038 C CB . ASN E 2 211 ? 77.417 46.563 72.140 1.00 127.13 ? 199 ASN D CB 1 ATOM 8039 C CG . ASN E 2 211 ? 77.529 48.076 72.161 1.00 134.65 ? 199 ASN D CG 1 ATOM 8040 O OD1 . ASN E 2 211 ? 78.627 48.627 72.250 1.00 138.37 ? 199 ASN D OD1 1 ATOM 8041 N ND2 . ASN E 2 211 ? 76.391 48.755 72.083 1.00 136.25 ? 199 ASN D ND2 1 ATOM 8042 N N . HIS E 2 212 ? 78.550 43.853 70.385 1.00 105.94 ? 200 HIS D N 1 ATOM 8043 C CA . HIS E 2 212 ? 78.704 42.404 70.463 1.00 94.70 ? 200 HIS D CA 1 ATOM 8044 C C . HIS E 2 212 ? 79.928 42.058 71.304 1.00 90.03 ? 200 HIS D C 1 ATOM 8045 O O . HIS E 2 212 ? 81.064 42.201 70.852 1.00 89.48 ? 200 HIS D O 1 ATOM 8046 C CB . HIS E 2 212 ? 78.827 41.792 69.067 1.00 91.61 ? 200 HIS D CB 1 ATOM 8047 C CG . HIS E 2 212 ? 78.670 40.303 69.042 1.00 90.69 ? 200 HIS D CG 1 ATOM 8048 N ND1 . HIS E 2 212 ? 79.245 39.509 68.074 1.00 89.80 ? 200 HIS D ND1 1 ATOM 8049 C CD2 . HIS E 2 212 ? 77.993 39.465 69.864 1.00 91.66 ? 200 HIS D CD2 1 ATOM 8050 C CE1 . HIS E 2 212 ? 78.935 38.244 68.303 1.00 89.88 ? 200 HIS D CE1 1 ATOM 8051 N NE2 . HIS E 2 212 ? 78.177 38.191 69.382 1.00 91.49 ? 200 HIS D NE2 1 ATOM 8052 N N . LYS E 2 213 ? 79.686 41.602 72.529 1.00 86.79 ? 201 LYS D N 1 ATOM 8053 C CA . LYS E 2 213 ? 80.757 41.361 73.495 1.00 86.30 ? 201 LYS D CA 1 ATOM 8054 C C . LYS E 2 213 ? 81.745 40.242 73.124 1.00 87.93 ? 201 LYS D C 1 ATOM 8055 O O . LYS E 2 213 ? 82.957 40.458 73.181 1.00 90.27 ? 201 LYS D O 1 ATOM 8056 C CB . LYS E 2 213 ? 80.155 41.068 74.875 1.00 87.31 ? 201 LYS D CB 1 ATOM 8057 C CG . LYS E 2 213 ? 81.188 40.762 75.948 1.00 89.24 ? 201 LYS D CG 1 ATOM 8058 C CD . LYS E 2 213 ? 80.532 40.474 77.290 1.00 92.62 ? 201 LYS D CD 1 ATOM 8059 C CE . LYS E 2 213 ? 81.571 40.205 78.365 1.00 90.02 ? 201 LYS D CE 1 ATOM 8060 N NZ . LYS E 2 213 ? 80.940 39.932 79.684 1.00 95.23 ? 201 LYS D NZ 1 ATOM 8061 N N . PRO E 2 214 ? 81.251 39.044 72.748 1.00 87.99 ? 202 PRO D N 1 ATOM 8062 C CA . PRO E 2 214 ? 82.235 37.970 72.557 1.00 94.11 ? 202 PRO D CA 1 ATOM 8063 C C . PRO E 2 214 ? 83.066 38.079 71.275 1.00 96.76 ? 202 PRO D C 1 ATOM 8064 O O . PRO E 2 214 ? 83.849 37.171 70.994 1.00 99.53 ? 202 PRO D O 1 ATOM 8065 C CB . PRO E 2 214 ? 81.366 36.711 72.520 1.00 92.34 ? 202 PRO D CB 1 ATOM 8066 C CG . PRO E 2 214 ? 80.066 37.179 71.989 1.00 85.07 ? 202 PRO D CG 1 ATOM 8067 C CD . PRO E 2 214 ? 79.871 38.556 72.554 1.00 84.82 ? 202 PRO D CD 1 ATOM 8068 N N . SER E 2 215 ? 82.911 39.163 70.521 1.00 96.04 ? 203 SER D N 1 ATOM 8069 C CA . SER E 2 215 ? 83.653 39.328 69.275 1.00 97.51 ? 203 SER D CA 1 ATOM 8070 C C . SER E 2 215 ? 84.346 40.685 69.184 1.00 102.67 ? 203 SER D C 1 ATOM 8071 O O . SER E 2 215 ? 84.958 41.004 68.163 1.00 106.13 ? 203 SER D O 1 ATOM 8072 C CB . SER E 2 215 ? 82.723 39.146 68.075 1.00 96.53 ? 203 SER D CB 1 ATOM 8073 O OG . SER E 2 215 ? 81.753 40.178 68.025 1.00 96.18 ? 203 SER D OG 1 ATOM 8074 N N . ASN E 2 216 ? 84.245 41.470 70.254 1.00 104.76 ? 204 ASN D N 1 ATOM 8075 C CA . ASN E 2 216 ? 84.814 42.817 70.303 1.00 108.59 ? 204 ASN D CA 1 ATOM 8076 C C . ASN E 2 216 ? 84.360 43.683 69.134 1.00 105.17 ? 204 ASN D C 1 ATOM 8077 O O . ASN E 2 216 ? 85.172 44.345 68.487 1.00 105.54 ? 204 ASN D O 1 ATOM 8078 C CB . ASN E 2 216 ? 86.343 42.756 70.335 1.00 115.94 ? 204 ASN D CB 1 ATOM 8079 C CG . ASN E 2 216 ? 86.874 42.111 71.597 1.00 120.64 ? 204 ASN D CG 1 ATOM 8080 O OD1 . ASN E 2 216 ? 87.600 41.119 71.541 1.00 122.68 ? 204 ASN D OD1 1 ATOM 8081 N ND2 . ASN E 2 216 ? 86.514 42.673 72.746 1.00 122.41 ? 204 ASN D ND2 1 ATOM 8082 N N . THR E 2 217 ? 83.059 43.672 68.870 1.00 101.84 ? 205 THR D N 1 ATOM 8083 C CA . THR E 2 217 ? 82.504 44.416 67.748 1.00 97.73 ? 205 THR D CA 1 ATOM 8084 C C . THR E 2 217 ? 81.523 45.486 68.216 1.00 95.09 ? 205 THR D C 1 ATOM 8085 O O . THR E 2 217 ? 80.382 45.183 68.562 1.00 97.68 ? 205 THR D O 1 ATOM 8086 C CB . THR E 2 217 ? 81.789 43.479 66.756 1.00 96.32 ? 205 THR D CB 1 ATOM 8087 O OG1 . THR E 2 217 ? 82.669 42.410 66.384 1.00 96.72 ? 205 THR D OG1 1 ATOM 8088 C CG2 . THR E 2 217 ? 81.365 44.243 65.509 1.00 95.66 ? 205 THR D CG2 1 ATOM 8089 N N . LYS E 2 218 ? 81.978 46.734 68.233 1.00 91.04 ? 206 LYS D N 1 ATOM 8090 C CA . LYS E 2 218 ? 81.107 47.859 68.552 1.00 87.72 ? 206 LYS D CA 1 ATOM 8091 C C . LYS E 2 218 ? 81.005 48.802 67.359 1.00 88.05 ? 206 LYS D C 1 ATOM 8092 O O . LYS E 2 218 ? 82.007 49.358 66.910 1.00 91.78 ? 206 LYS D O 1 ATOM 8093 C CB . LYS E 2 218 ? 81.616 48.614 69.780 1.00 89.15 ? 206 LYS D CB 1 ATOM 8094 C CG . LYS E 2 218 ? 80.846 49.892 70.074 1.00 92.43 ? 206 LYS D CG 1 ATOM 8095 C CD . LYS E 2 218 ? 81.387 50.602 71.303 1.00 98.56 ? 206 LYS D CD 1 ATOM 8096 C CE . LYS E 2 218 ? 80.662 51.917 71.539 1.00 101.54 ? 206 LYS D CE 1 ATOM 8097 N NZ . LYS E 2 218 ? 79.193 51.723 71.698 1.00 97.97 ? 206 LYS D NZ 1 ATOM 8098 N N . VAL E 2 219 ? 79.791 48.976 66.848 1.00 85.77 ? 207 VAL D N 1 ATOM 8099 C CA . VAL E 2 219 ? 79.566 49.818 65.679 1.00 85.80 ? 207 VAL D CA 1 ATOM 8100 C C . VAL E 2 219 ? 78.533 50.908 65.959 1.00 90.73 ? 207 VAL D C 1 ATOM 8101 O O . VAL E 2 219 ? 77.435 50.628 66.441 1.00 88.07 ? 207 VAL D O 1 ATOM 8102 C CB . VAL E 2 219 ? 79.101 48.981 64.469 1.00 76.25 ? 207 VAL D CB 1 ATOM 8103 C CG1 . VAL E 2 219 ? 78.860 49.875 63.263 1.00 73.32 ? 207 VAL D CG1 1 ATOM 8104 C CG2 . VAL E 2 219 ? 80.125 47.904 64.144 1.00 74.10 ? 207 VAL D CG2 1 ATOM 8105 N N . ASP E 2 220 ? 78.898 52.152 65.664 1.00 97.50 ? 208 ASP D N 1 ATOM 8106 C CA . ASP E 2 220 ? 77.980 53.279 65.801 1.00 99.56 ? 208 ASP D CA 1 ATOM 8107 C C . ASP E 2 220 ? 77.566 53.797 64.429 1.00 99.00 ? 208 ASP D C 1 ATOM 8108 O O . ASP E 2 220 ? 78.053 54.832 63.975 1.00 104.83 ? 208 ASP D O 1 ATOM 8109 C CB . ASP E 2 220 ? 78.616 54.405 66.618 1.00 106.34 ? 208 ASP D CB 1 ATOM 8110 C CG . ASP E 2 220 ? 78.847 54.018 68.067 1.00 111.66 ? 208 ASP D CG 1 ATOM 8111 O OD1 . ASP E 2 220 ? 78.742 54.903 68.941 1.00 116.28 ? 208 ASP D OD1 1 ATOM 8112 O OD2 . ASP E 2 220 ? 79.134 52.832 68.332 1.00 111.63 ? 208 ASP D OD2 1 ATOM 8113 N N . LYS E 2 221 ? 76.666 53.072 63.772 1.00 94.76 ? 209 LYS D N 1 ATOM 8114 C CA . LYS E 2 221 ? 76.236 53.419 62.422 1.00 91.30 ? 209 LYS D CA 1 ATOM 8115 C C . LYS E 2 221 ? 75.112 54.452 62.418 1.00 86.55 ? 209 LYS D C 1 ATOM 8116 O O . LYS E 2 221 ? 74.049 54.232 62.999 1.00 82.56 ? 209 LYS D O 1 ATOM 8117 C CB . LYS E 2 221 ? 75.789 52.163 61.669 1.00 87.30 ? 209 LYS D CB 1 ATOM 8118 C CG . LYS E 2 221 ? 75.153 52.440 60.316 1.00 87.93 ? 209 LYS D CG 1 ATOM 8119 C CD . LYS E 2 221 ? 76.112 53.166 59.388 1.00 93.34 ? 209 LYS D CD 1 ATOM 8120 C CE . LYS E 2 221 ? 75.443 53.506 58.066 1.00 97.43 ? 209 LYS D CE 1 ATOM 8121 N NZ . LYS E 2 221 ? 76.329 54.307 57.175 1.00 102.44 ? 209 LYS D NZ 1 ATOM 8122 N N . LYS E 2 222 ? 75.356 55.578 61.755 1.00 85.67 ? 210 LYS D N 1 ATOM 8123 C CA . LYS E 2 222 ? 74.337 56.605 61.588 1.00 84.18 ? 210 LYS D CA 1 ATOM 8124 C C . LYS E 2 222 ? 73.414 56.267 60.422 1.00 81.53 ? 210 LYS D C 1 ATOM 8125 O O . LYS E 2 222 ? 73.871 56.058 59.298 1.00 81.83 ? 210 LYS D O 1 ATOM 8126 C CB . LYS E 2 222 ? 74.980 57.977 61.367 1.00 84.80 ? 210 LYS D CB 1 ATOM 8127 C CG . LYS E 2 222 ? 73.980 59.079 61.050 1.00 83.11 ? 210 LYS D CG 1 ATOM 8128 C CD . LYS E 2 222 ? 74.673 60.389 60.718 1.00 87.77 ? 210 LYS D CD 1 ATOM 8129 C CE . LYS E 2 222 ? 73.661 61.466 60.353 1.00 93.04 ? 210 LYS D CE 1 ATOM 8130 N NZ . LYS E 2 222 ? 74.310 62.761 59.996 1.00 99.29 ? 210 LYS D NZ 1 ATOM 8131 N N . VAL E 2 223 ? 72.114 56.212 60.693 1.00 79.05 ? 211 VAL D N 1 ATOM 8132 C CA . VAL E 2 223 ? 71.131 55.939 59.653 1.00 76.87 ? 211 VAL D CA 1 ATOM 8133 C C . VAL E 2 223 ? 70.704 57.230 58.963 1.00 82.64 ? 211 VAL D C 1 ATOM 8134 O O . VAL E 2 223 ? 70.208 58.153 59.609 1.00 85.86 ? 211 VAL D O 1 ATOM 8135 C CB . VAL E 2 223 ? 69.886 55.229 60.221 1.00 72.02 ? 211 VAL D CB 1 ATOM 8136 C CG1 . VAL E 2 223 ? 68.837 55.047 59.135 1.00 69.08 ? 211 VAL D CG1 1 ATOM 8137 C CG2 . VAL E 2 223 ? 70.270 53.889 60.830 1.00 69.43 ? 211 VAL D CG2 1 ATOM 8138 N N . GLU E 2 224 ? 70.906 57.290 57.651 1.00 84.69 ? 212 GLU D N 1 ATOM 8139 C CA . GLU E 2 224 ? 70.517 58.458 56.867 1.00 92.10 ? 212 GLU D CA 1 ATOM 8140 C C . GLU E 2 224 ? 69.519 58.071 55.780 1.00 99.88 ? 212 GLU D C 1 ATOM 8141 O O . GLU E 2 224 ? 69.665 57.026 55.145 1.00 102.74 ? 212 GLU D O 1 ATOM 8142 C CB . GLU E 2 224 ? 71.746 59.121 56.242 1.00 94.28 ? 212 GLU D CB 1 ATOM 8143 C CG . GLU E 2 224 ? 72.826 59.502 57.238 1.00 95.19 ? 212 GLU D CG 1 ATOM 8144 C CD . GLU E 2 224 ? 74.000 60.201 56.581 1.00 96.04 ? 212 GLU D CD 1 ATOM 8145 O OE1 . GLU E 2 224 ? 75.124 60.114 57.118 1.00 95.78 ? 212 GLU D OE1 1 ATOM 8146 O OE2 . GLU E 2 224 ? 73.797 60.840 55.527 1.00 96.35 ? 212 GLU D OE2 1 ATOM 8147 N N . PRO E 2 225 ? 68.499 58.916 55.560 1.00 103.96 ? 213 PRO D N 1 ATOM 8148 C CA . PRO E 2 225 ? 67.467 58.643 54.554 1.00 106.55 ? 213 PRO D CA 1 ATOM 8149 C C . PRO E 2 225 ? 67.981 58.804 53.126 1.00 110.45 ? 213 PRO D C 1 ATOM 8150 O O . PRO E 2 225 ? 68.906 59.580 52.887 1.00 113.24 ? 213 PRO D O 1 ATOM 8151 C CB . PRO E 2 225 ? 66.392 59.688 54.867 1.00 106.46 ? 213 PRO D CB 1 ATOM 8152 C CG . PRO E 2 225 ? 67.146 60.818 55.472 1.00 106.34 ? 213 PRO D CG 1 ATOM 8153 C CD . PRO E 2 225 ? 68.263 60.191 56.263 1.00 104.58 ? 213 PRO D CD 1 ATOM 8154 N N . LYS E 2 226 ? 67.385 58.070 52.191 1.00 110.98 ? 214 LYS D N 1 ATOM 8155 C CA . LYS E 2 226 ? 67.756 58.176 50.785 1.00 114.04 ? 214 LYS D CA 1 ATOM 8156 C C . LYS E 2 226 ? 66.527 58.049 49.892 1.00 115.56 ? 214 LYS D C 1 ATOM 8157 O O . LYS E 2 226 ? 65.410 57.878 50.381 1.00 113.48 ? 214 LYS D O 1 ATOM 8158 C CB . LYS E 2 226 ? 68.790 57.110 50.413 1.00 114.45 ? 214 LYS D CB 1 ATOM 8159 C CG . LYS E 2 226 ? 68.262 55.686 50.458 1.00 113.18 ? 214 LYS D CG 1 ATOM 8160 C CD . LYS E 2 226 ? 69.291 54.698 49.931 1.00 113.50 ? 214 LYS D CD 1 ATOM 8161 C CE . LYS E 2 226 ? 68.734 53.283 49.895 1.00 111.99 ? 214 LYS D CE 1 ATOM 8162 N NZ . LYS E 2 226 ? 69.715 52.312 49.338 1.00 113.58 ? 214 LYS D NZ 1 ATOM 8163 N N . ASP F 3 1 ? 56.325 7.081 82.317 1.00 123.70 ? 1 ASP E N 1 ATOM 8164 C CA . ASP F 3 1 ? 56.289 8.502 82.640 1.00 124.23 ? 1 ASP E CA 1 ATOM 8165 C C . ASP F 3 1 ? 54.900 8.949 83.085 1.00 125.63 ? 1 ASP E C 1 ATOM 8166 O O . ASP F 3 1 ? 53.908 8.253 82.864 1.00 127.45 ? 1 ASP E O 1 ATOM 8167 C CB . ASP F 3 1 ? 56.740 9.336 81.438 1.00 120.84 ? 1 ASP E CB 1 ATOM 8168 C CG . ASP F 3 1 ? 58.230 9.232 81.181 1.00 119.97 ? 1 ASP E CG 1 ATOM 8169 O OD1 . ASP F 3 1 ? 58.812 10.204 80.654 1.00 116.11 ? 1 ASP E OD1 1 ATOM 8170 O OD2 . ASP F 3 1 ? 58.820 8.180 81.508 1.00 123.06 ? 1 ASP E OD2 1 ATOM 8171 N N . ILE F 3 2 ? 54.842 10.116 83.720 1.00 124.61 ? 2 ILE E N 1 ATOM 8172 C CA . ILE F 3 2 ? 53.579 10.712 84.138 1.00 123.12 ? 2 ILE E CA 1 ATOM 8173 C C . ILE F 3 2 ? 53.327 11.974 83.321 1.00 120.66 ? 2 ILE E C 1 ATOM 8174 O O . ILE F 3 2 ? 53.952 13.007 83.558 1.00 122.58 ? 2 ILE E O 1 ATOM 8175 C CB . ILE F 3 2 ? 53.574 11.060 85.643 1.00 125.13 ? 2 ILE E CB 1 ATOM 8176 C CG1 . ILE F 3 2 ? 54.003 9.855 86.485 1.00 128.18 ? 2 ILE E CG1 1 ATOM 8177 C CG2 . ILE F 3 2 ? 52.202 11.558 86.069 1.00 125.49 ? 2 ILE E CG2 1 ATOM 8178 C CD1 . ILE F 3 2 ? 55.480 9.838 86.844 1.00 128.69 ? 2 ILE E CD1 1 ATOM 8179 N N . GLN F 3 3 ? 52.414 11.889 82.358 1.00 115.21 ? 3 GLN E N 1 ATOM 8180 C CA . GLN F 3 3 ? 52.214 12.977 81.405 1.00 106.75 ? 3 GLN E CA 1 ATOM 8181 C C . GLN F 3 3 ? 51.121 13.951 81.837 1.00 102.18 ? 3 GLN E C 1 ATOM 8182 O O . GLN F 3 3 ? 50.123 13.556 82.438 1.00 101.46 ? 3 GLN E O 1 ATOM 8183 C CB . GLN F 3 3 ? 51.890 12.409 80.022 1.00 103.80 ? 3 GLN E CB 1 ATOM 8184 C CG . GLN F 3 3 ? 51.808 13.454 78.925 1.00 102.68 ? 3 GLN E CG 1 ATOM 8185 C CD . GLN F 3 3 ? 51.882 12.848 77.544 1.00 105.82 ? 3 GLN E CD 1 ATOM 8186 O OE1 . GLN F 3 3 ? 52.234 11.679 77.388 1.00 108.55 ? 3 GLN E OE1 1 ATOM 8187 N NE2 . GLN F 3 3 ? 51.552 13.639 76.529 1.00 106.34 ? 3 GLN E NE2 1 ATOM 8188 N N . LEU F 3 4 ? 51.325 15.228 81.523 1.00 98.87 ? 4 LEU E N 1 ATOM 8189 C CA . LEU F 3 4 ? 50.377 16.281 81.873 1.00 94.34 ? 4 LEU E CA 1 ATOM 8190 C C . LEU F 3 4 ? 49.885 17.016 80.628 1.00 89.90 ? 4 LEU E C 1 ATOM 8191 O O . LEU F 3 4 ? 50.684 17.474 79.812 1.00 86.74 ? 4 LEU E O 1 ATOM 8192 C CB . LEU F 3 4 ? 51.010 17.282 82.848 1.00 92.32 ? 4 LEU E CB 1 ATOM 8193 C CG . LEU F 3 4 ? 51.305 16.860 84.292 1.00 93.93 ? 4 LEU E CG 1 ATOM 8194 C CD1 . LEU F 3 4 ? 52.481 15.904 84.375 1.00 94.87 ? 4 LEU E CD1 1 ATOM 8195 C CD2 . LEU F 3 4 ? 51.560 18.082 85.158 1.00 94.00 ? 4 LEU E CD2 1 ATOM 8196 N N . THR F 3 5 ? 48.568 17.123 80.488 1.00 88.32 ? 5 THR E N 1 ATOM 8197 C CA . THR F 3 5 ? 47.972 17.865 79.384 1.00 82.77 ? 5 THR E CA 1 ATOM 8198 C C . THR F 3 5 ? 47.344 19.154 79.902 1.00 83.35 ? 5 THR E C 1 ATOM 8199 O O . THR F 3 5 ? 46.362 19.123 80.643 1.00 85.31 ? 5 THR E O 1 ATOM 8200 C CB . THR F 3 5 ? 46.907 17.033 78.645 1.00 79.78 ? 5 THR E CB 1 ATOM 8201 O OG1 . THR F 3 5 ? 47.487 15.804 78.192 1.00 82.49 ? 5 THR E OG1 1 ATOM 8202 C CG2 . THR F 3 5 ? 46.361 17.802 77.451 1.00 74.00 ? 5 THR E CG2 1 ATOM 8203 N N . GLN F 3 6 ? 47.918 20.285 79.509 1.00 83.39 ? 6 GLN E N 1 ATOM 8204 C CA . GLN F 3 6 ? 47.473 21.582 80.005 1.00 87.05 ? 6 GLN E CA 1 ATOM 8205 C C . GLN F 3 6 ? 46.573 22.281 78.990 1.00 87.60 ? 6 GLN E C 1 ATOM 8206 O O . GLN F 3 6 ? 46.869 22.305 77.797 1.00 87.32 ? 6 GLN E O 1 ATOM 8207 C CB . GLN F 3 6 ? 48.682 22.459 80.345 1.00 89.53 ? 6 GLN E CB 1 ATOM 8208 C CG . GLN F 3 6 ? 48.362 23.675 81.195 1.00 92.97 ? 6 GLN E CG 1 ATOM 8209 C CD . GLN F 3 6 ? 49.607 24.316 81.782 1.00 93.68 ? 6 GLN E CD 1 ATOM 8210 O OE1 . GLN F 3 6 ? 50.718 23.817 81.604 1.00 88.77 ? 6 GLN E OE1 1 ATOM 8211 N NE2 . GLN F 3 6 ? 49.425 25.427 82.488 1.00 99.47 ? 6 GLN E NE2 1 ATOM 8212 N N . SER F 3 7 ? 45.470 22.844 79.472 1.00 89.33 ? 7 SER E N 1 ATOM 8213 C CA . SER F 3 7 ? 44.503 23.501 78.600 1.00 93.76 ? 7 SER E CA 1 ATOM 8214 C C . SER F 3 7 ? 43.933 24.760 79.247 1.00 93.05 ? 7 SER E C 1 ATOM 8215 O O . SER F 3 7 ? 43.668 24.777 80.449 1.00 93.83 ? 7 SER E O 1 ATOM 8216 C CB . SER F 3 7 ? 43.369 22.538 78.240 1.00 100.80 ? 7 SER E CB 1 ATOM 8217 O OG . SER F 3 7 ? 42.632 22.168 79.392 1.00 104.80 ? 7 SER E OG 1 ATOM 8218 N N . PRO F 3 8 ? 43.739 25.822 78.447 1.00 91.07 ? 8 PRO E N 1 ATOM 8219 C CA . PRO F 3 8 ? 44.043 25.865 77.014 1.00 90.14 ? 8 PRO E CA 1 ATOM 8220 C C . PRO F 3 8 ? 45.500 26.220 76.738 1.00 91.26 ? 8 PRO E C 1 ATOM 8221 O O . PRO F 3 8 ? 46.224 26.600 77.658 1.00 93.44 ? 8 PRO E O 1 ATOM 8222 C CB . PRO F 3 8 ? 43.115 26.964 76.502 1.00 90.15 ? 8 PRO E CB 1 ATOM 8223 C CG . PRO F 3 8 ? 43.032 27.911 77.649 1.00 90.88 ? 8 PRO E CG 1 ATOM 8224 C CD . PRO F 3 8 ? 43.097 27.068 78.904 1.00 92.03 ? 8 PRO E CD 1 ATOM 8225 N N . SER F 3 9 ? 45.920 26.095 75.484 1.00 90.42 ? 9 SER E N 1 ATOM 8226 C CA . SER F 3 9 ? 47.274 26.468 75.095 1.00 89.77 ? 9 SER E CA 1 ATOM 8227 C C . SER F 3 9 ? 47.440 27.983 75.147 1.00 92.91 ? 9 SER E C 1 ATOM 8228 O O . SER F 3 9 ? 48.283 28.502 75.880 1.00 91.13 ? 9 SER E O 1 ATOM 8229 C CB . SER F 3 9 ? 47.597 25.946 73.694 1.00 89.03 ? 9 SER E CB 1 ATOM 8230 O OG . SER F 3 9 ? 46.697 26.473 72.735 1.00 92.31 ? 9 SER E OG 1 ATOM 8231 N N . SER F 3 10 ? 46.628 28.686 74.364 1.00 99.68 ? 10 SER E N 1 ATOM 8232 C CA . SER F 3 10 ? 46.633 30.144 74.355 1.00 99.16 ? 10 SER E CA 1 ATOM 8233 C C . SER F 3 10 ? 45.341 30.682 74.965 1.00 99.94 ? 10 SER E C 1 ATOM 8234 O O . SER F 3 10 ? 44.336 29.972 75.026 1.00 106.15 ? 10 SER E O 1 ATOM 8235 C CB . SER F 3 10 ? 46.809 30.673 72.928 1.00 100.57 ? 10 SER E CB 1 ATOM 8236 O OG . SER F 3 10 ? 48.000 30.178 72.338 1.00 100.51 ? 10 SER E OG 1 ATOM 8237 N N . LEU F 3 11 ? 45.369 31.932 75.417 1.00 95.66 ? 11 LEU E N 1 ATOM 8238 C CA . LEU F 3 11 ? 44.194 32.550 76.025 1.00 88.55 ? 11 LEU E CA 1 ATOM 8239 C C . LEU F 3 11 ? 44.275 34.073 76.012 1.00 82.36 ? 11 LEU E C 1 ATOM 8240 O O . LEU F 3 11 ? 45.265 34.653 76.455 1.00 80.57 ? 11 LEU E O 1 ATOM 8241 C CB . LEU F 3 11 ? 44.018 32.058 77.463 1.00 85.32 ? 11 LEU E CB 1 ATOM 8242 C CG . LEU F 3 11 ? 42.772 32.555 78.197 1.00 89.01 ? 11 LEU E CG 1 ATOM 8243 C CD1 . LEU F 3 11 ? 41.510 32.082 77.490 1.00 93.28 ? 11 LEU E CD1 1 ATOM 8244 C CD2 . LEU F 3 11 ? 42.784 32.099 79.646 1.00 88.84 ? 11 LEU E CD2 1 ATOM 8245 N N . SER F 3 12 ? 43.228 34.717 75.505 1.00 81.13 ? 12 SER E N 1 ATOM 8246 C CA . SER F 3 12 ? 43.159 36.176 75.500 1.00 81.50 ? 12 SER E CA 1 ATOM 8247 C C . SER F 3 12 ? 42.133 36.671 76.511 1.00 82.23 ? 12 SER E C 1 ATOM 8248 O O . SER F 3 12 ? 40.950 36.354 76.410 1.00 85.38 ? 12 SER E O 1 ATOM 8249 C CB . SER F 3 12 ? 42.815 36.700 74.105 1.00 83.00 ? 12 SER E CB 1 ATOM 8250 O OG . SER F 3 12 ? 43.880 36.483 73.200 1.00 76.19 ? 12 SER E OG 1 ATOM 8251 N N . ALA F 3 13 ? 42.588 37.449 77.484 1.00 82.08 ? 13 ALA E N 1 ATOM 8252 C CA . ALA F 3 13 ? 41.708 37.934 78.535 1.00 87.97 ? 13 ALA E CA 1 ATOM 8253 C C . ALA F 3 13 ? 42.010 39.377 78.871 1.00 91.06 ? 13 ALA E C 1 ATOM 8254 O O . ALA F 3 13 ? 43.133 39.843 78.687 1.00 91.22 ? 13 ALA E O 1 ATOM 8255 C CB . ALA F 3 13 ? 41.837 37.068 79.777 1.00 90.41 ? 13 ALA E CB 1 ATOM 8256 N N . SER F 3 14 ? 41.000 40.084 79.360 1.00 95.37 ? 14 SER E N 1 ATOM 8257 C CA . SER F 3 14 ? 41.184 41.462 79.777 1.00 98.91 ? 14 SER E CA 1 ATOM 8258 C C . SER F 3 14 ? 41.253 41.513 81.292 1.00 101.12 ? 14 SER E C 1 ATOM 8259 O O . SER F 3 14 ? 41.077 40.497 81.962 1.00 100.98 ? 14 SER E O 1 ATOM 8260 C CB . SER F 3 14 ? 40.054 42.344 79.255 1.00 105.80 ? 14 SER E CB 1 ATOM 8261 O OG . SER F 3 14 ? 40.363 43.717 79.427 1.00 109.16 ? 14 SER E OG 1 ATOM 8262 N N . VAL F 3 15 ? 41.516 42.696 81.832 1.00 103.23 ? 15 VAL E N 1 ATOM 8263 C CA . VAL F 3 15 ? 41.563 42.865 83.274 1.00 107.37 ? 15 VAL E CA 1 ATOM 8264 C C . VAL F 3 15 ? 40.194 42.570 83.878 1.00 113.74 ? 15 VAL E C 1 ATOM 8265 O O . VAL F 3 15 ? 39.165 42.974 83.335 1.00 115.74 ? 15 VAL E O 1 ATOM 8266 C CB . VAL F 3 15 ? 42.004 44.285 83.662 1.00 109.14 ? 15 VAL E CB 1 ATOM 8267 C CG1 . VAL F 3 15 ? 42.045 44.440 85.175 1.00 113.22 ? 15 VAL E CG1 1 ATOM 8268 C CG2 . VAL F 3 15 ? 43.363 44.596 83.053 1.00 97.94 ? 15 VAL E CG2 1 ATOM 8269 N N . GLY F 3 16 ? 40.186 41.846 84.992 1.00 116.22 ? 16 GLY E N 1 ATOM 8270 C CA . GLY F 3 16 ? 38.953 41.543 85.693 1.00 122.59 ? 16 GLY E CA 1 ATOM 8271 C C . GLY F 3 16 ? 38.299 40.271 85.199 1.00 123.24 ? 16 GLY E C 1 ATOM 8272 O O . GLY F 3 16 ? 37.252 39.865 85.703 1.00 128.15 ? 16 GLY E O 1 ATOM 8273 N N . ASP F 3 17 ? 38.915 39.642 84.205 1.00 121.47 ? 17 ASP E N 1 ATOM 8274 C CA . ASP F 3 17 ? 38.408 38.386 83.668 1.00 122.73 ? 17 ASP E CA 1 ATOM 8275 C C . ASP F 3 17 ? 38.546 37.258 84.685 1.00 121.23 ? 17 ASP E C 1 ATOM 8276 O O . ASP F 3 17 ? 39.409 37.299 85.565 1.00 120.94 ? 17 ASP E O 1 ATOM 8277 C CB . ASP F 3 17 ? 39.147 38.011 82.383 1.00 124.64 ? 17 ASP E CB 1 ATOM 8278 C CG . ASP F 3 17 ? 38.329 38.276 81.132 1.00 128.52 ? 17 ASP E CG 1 ATOM 8279 O OD1 . ASP F 3 17 ? 38.132 39.459 80.779 1.00 132.07 ? 17 ASP E OD1 1 ATOM 8280 O OD2 . ASP F 3 17 ? 37.897 37.293 80.492 1.00 126.71 ? 17 ASP E OD2 1 ATOM 8281 N N . ARG F 3 18 ? 37.685 36.256 84.553 1.00 121.69 ? 18 ARG E N 1 ATOM 8282 C CA . ARG F 3 18 ? 37.745 35.052 85.372 1.00 117.10 ? 18 ARG E CA 1 ATOM 8283 C C . ARG F 3 18 ? 38.453 33.950 84.594 1.00 111.26 ? 18 ARG E C 1 ATOM 8284 O O . ARG F 3 18 ? 37.973 33.523 83.547 1.00 108.67 ? 18 ARG E O 1 ATOM 8285 C CB . ARG F 3 18 ? 36.340 34.607 85.771 1.00 117.56 ? 18 ARG E CB 1 ATOM 8286 C CG . ARG F 3 18 ? 36.251 33.183 86.288 1.00 113.90 ? 18 ARG E CG 1 ATOM 8287 C CD . ARG F 3 18 ? 34.811 32.695 86.286 1.00 118.51 ? 18 ARG E CD 1 ATOM 8288 N NE . ARG F 3 18 ? 33.924 33.588 87.029 1.00 126.26 ? 18 ARG E NE 1 ATOM 8289 C CZ . ARG F 3 18 ? 32.994 34.360 86.475 1.00 129.41 ? 18 ARG E CZ 1 ATOM 8290 N NH1 . ARG F 3 18 ? 32.814 34.349 85.161 1.00 129.33 ? 18 ARG E NH1 1 ATOM 8291 N NH2 . ARG F 3 18 ? 32.240 35.140 87.239 1.00 132.15 ? 18 ARG E NH2 1 ATOM 8292 N N . VAL F 3 19 ? 39.590 33.489 85.101 1.00 102.25 ? 19 VAL E N 1 ATOM 8293 C CA . VAL F 3 19 ? 40.434 32.567 84.346 1.00 100.53 ? 19 VAL E CA 1 ATOM 8294 C C . VAL F 3 19 ? 40.572 31.199 85.008 1.00 100.86 ? 19 VAL E C 1 ATOM 8295 O O . VAL F 3 19 ? 40.827 31.101 86.208 1.00 98.83 ? 19 VAL E O 1 ATOM 8296 C CB . VAL F 3 19 ? 41.840 33.157 84.145 1.00 93.95 ? 19 VAL E CB 1 ATOM 8297 C CG1 . VAL F 3 19 ? 42.658 32.284 83.212 1.00 91.26 ? 19 VAL E CG1 1 ATOM 8298 C CG2 . VAL F 3 19 ? 41.742 34.578 83.615 1.00 95.28 ? 19 VAL E CG2 1 ATOM 8299 N N . THR F 3 20 ? 40.403 30.144 84.215 1.00 103.05 ? 20 THR E N 1 ATOM 8300 C CA . THR F 3 20 ? 40.565 28.778 84.699 1.00 104.86 ? 20 THR E CA 1 ATOM 8301 C C . THR F 3 20 ? 41.503 27.975 83.799 1.00 104.43 ? 20 THR E C 1 ATOM 8302 O O . THR F 3 20 ? 41.160 27.652 82.661 1.00 106.19 ? 20 THR E O 1 ATOM 8303 C CB . THR F 3 20 ? 39.214 28.044 84.789 1.00 113.04 ? 20 THR E CB 1 ATOM 8304 O OG1 . THR F 3 20 ? 38.585 28.036 83.502 1.00 119.44 ? 20 THR E OG1 1 ATOM 8305 C CG2 . THR F 3 20 ? 38.297 28.727 85.793 1.00 116.71 ? 20 THR E CG2 1 ATOM 8306 N N . ILE F 3 21 ? 42.686 27.654 84.315 1.00 99.45 ? 21 ILE E N 1 ATOM 8307 C CA . ILE F 3 21 ? 43.650 26.850 83.571 1.00 94.42 ? 21 ILE E CA 1 ATOM 8308 C C . ILE F 3 21 ? 43.653 25.410 84.076 1.00 90.39 ? 21 ILE E C 1 ATOM 8309 O O . ILE F 3 21 ? 44.006 25.145 85.224 1.00 87.34 ? 21 ILE E O 1 ATOM 8310 C CB . ILE F 3 21 ? 45.073 27.429 83.670 1.00 88.43 ? 21 ILE E CB 1 ATOM 8311 C CG1 . ILE F 3 21 ? 45.072 28.911 83.286 1.00 87.40 ? 21 ILE E CG1 1 ATOM 8312 C CG2 . ILE F 3 21 ? 46.032 26.637 82.793 1.00 84.69 ? 21 ILE E CG2 1 ATOM 8313 C CD1 . ILE F 3 21 ? 44.409 29.198 81.956 1.00 90.77 ? 21 ILE E CD1 1 ATOM 8314 N N . THR F 3 22 ? 43.262 24.484 83.207 1.00 92.55 ? 22 THR E N 1 ATOM 8315 C CA . THR F 3 22 ? 43.099 23.090 83.598 1.00 96.58 ? 22 THR E CA 1 ATOM 8316 C C . THR F 3 22 ? 44.356 22.261 83.344 1.00 98.29 ? 22 THR E C 1 ATOM 8317 O O . THR F 3 22 ? 44.988 22.373 82.293 1.00 98.79 ? 22 THR E O 1 ATOM 8318 C CB . THR F 3 22 ? 41.917 22.442 82.854 1.00 102.06 ? 22 THR E CB 1 ATOM 8319 O OG1 . THR F 3 22 ? 40.789 23.325 82.884 1.00 104.82 ? 22 THR E OG1 1 ATOM 8320 C CG2 . THR F 3 22 ? 41.537 21.119 83.498 1.00 104.06 ? 22 THR E CG2 1 ATOM 8321 N N . CYS F 3 23 ? 44.711 21.430 84.320 1.00 98.98 ? 23 CYS E N 1 ATOM 8322 C CA . CYS F 3 23 ? 45.843 20.521 84.192 1.00 95.59 ? 23 CYS E CA 1 ATOM 8323 C C . CYS F 3 23 ? 45.434 19.115 84.614 1.00 93.74 ? 23 CYS E C 1 ATOM 8324 O O . CYS F 3 23 ? 45.235 18.846 85.799 1.00 91.66 ? 23 CYS E O 1 ATOM 8325 C CB . CYS F 3 23 ? 47.025 21.006 85.033 1.00 91.29 ? 23 CYS E CB 1 ATOM 8326 S SG . CYS F 3 23 ? 48.580 20.133 84.738 1.00 80.61 ? 23 CYS E SG 1 ATOM 8327 N N . ARG F 3 24 ? 45.306 18.221 83.639 1.00 96.74 ? 24 ARG E N 1 ATOM 8328 C CA . ARG F 3 24 ? 44.856 16.860 83.903 1.00 101.39 ? 24 ARG E CA 1 ATOM 8329 C C . ARG F 3 24 ? 45.919 15.844 83.497 1.00 104.17 ? 24 ARG E C 1 ATOM 8330 O O . ARG F 3 24 ? 46.329 15.789 82.338 1.00 106.05 ? 24 ARG E O 1 ATOM 8331 C CB . ARG F 3 24 ? 43.541 16.589 83.168 1.00 106.63 ? 24 ARG E CB 1 ATOM 8332 C CG . ARG F 3 24 ? 42.456 17.609 83.485 1.00 106.26 ? 24 ARG E CG 1 ATOM 8333 C CD . ARG F 3 24 ? 41.284 17.529 82.520 1.00 112.66 ? 24 ARG E CD 1 ATOM 8334 N NE . ARG F 3 24 ? 40.385 16.419 82.821 1.00 118.29 ? 24 ARG E NE 1 ATOM 8335 C CZ . ARG F 3 24 ? 39.203 16.241 82.240 1.00 122.98 ? 24 ARG E CZ 1 ATOM 8336 N NH1 . ARG F 3 24 ? 38.776 17.103 81.328 1.00 124.88 ? 24 ARG E NH1 1 ATOM 8337 N NH2 . ARG F 3 24 ? 38.446 15.205 82.573 1.00 125.66 ? 24 ARG E NH2 1 ATOM 8338 N N . ALA F 3 25 ? 46.364 15.044 84.462 1.00 103.95 ? 25 ALA E N 1 ATOM 8339 C CA . ALA F 3 25 ? 47.433 14.079 84.230 1.00 103.18 ? 25 ALA E CA 1 ATOM 8340 C C . ALA F 3 25 ? 46.888 12.710 83.836 1.00 107.78 ? 25 ALA E C 1 ATOM 8341 O O . ALA F 3 25 ? 45.725 12.395 84.092 1.00 108.36 ? 25 ALA E O 1 ATOM 8342 C CB . ALA F 3 25 ? 48.312 13.958 85.466 1.00 97.55 ? 25 ALA E CB 1 ATOM 8343 N N . SER F 3 26 ? 47.740 11.901 83.212 1.00 110.00 ? 26 SER E N 1 ATOM 8344 C CA . SER F 3 26 ? 47.361 10.559 82.786 1.00 113.86 ? 26 SER E CA 1 ATOM 8345 C C . SER F 3 26 ? 47.115 9.648 83.986 1.00 114.24 ? 26 SER E C 1 ATOM 8346 O O . SER F 3 26 ? 45.979 9.263 84.261 1.00 114.08 ? 26 SER E O 1 ATOM 8347 C CB . SER F 3 26 ? 48.439 9.960 81.880 1.00 112.25 ? 26 SER E CB 1 ATOM 8348 O OG . SER F 3 26 ? 49.692 9.905 82.539 1.00 106.69 ? 26 SER E OG 1 ATOM 8349 N N . GLN F 3 27 ? 48.186 9.305 84.695 1.00 114.95 ? 27 GLN E N 1 ATOM 8350 C CA . GLN F 3 27 ? 48.078 8.476 85.891 1.00 115.26 ? 27 GLN E CA 1 ATOM 8351 C C . GLN F 3 27 ? 47.746 9.331 87.111 1.00 111.74 ? 27 GLN E C 1 ATOM 8352 O O . GLN F 3 27 ? 48.034 10.527 87.137 1.00 108.41 ? 27 GLN E O 1 ATOM 8353 C CB . GLN F 3 27 ? 49.375 7.695 86.126 1.00 118.32 ? 27 GLN E CB 1 ATOM 8354 C CG . GLN F 3 27 ? 49.708 6.695 85.028 1.00 124.92 ? 27 GLN E CG 1 ATOM 8355 C CD . GLN F 3 27 ? 50.979 5.914 85.311 1.00 125.17 ? 27 GLN E CD 1 ATOM 8356 O OE1 . GLN F 3 27 ? 51.781 6.296 86.164 1.00 120.53 ? 27 GLN E OE1 1 ATOM 8357 N NE2 . GLN F 3 27 ? 51.167 4.810 84.595 1.00 130.00 ? 27 GLN E NE2 1 ATOM 8358 N N . GLY F 3 28 ? 47.135 8.714 88.117 1.00 114.19 ? 28 GLY E N 1 ATOM 8359 C CA . GLY F 3 28 ? 46.758 9.422 89.327 1.00 111.25 ? 28 GLY E CA 1 ATOM 8360 C C . GLY F 3 28 ? 47.953 9.824 90.170 1.00 105.18 ? 28 GLY E C 1 ATOM 8361 O O . GLY F 3 28 ? 48.781 8.987 90.528 1.00 104.28 ? 28 GLY E O 1 ATOM 8362 N N . ILE F 3 29 ? 48.042 11.112 90.488 1.00 102.90 ? 29 ILE E N 1 ATOM 8363 C CA . ILE F 3 29 ? 49.142 11.631 91.295 1.00 102.88 ? 29 ILE E CA 1 ATOM 8364 C C . ILE F 3 29 ? 48.645 12.183 92.626 1.00 105.36 ? 29 ILE E C 1 ATOM 8365 O O . ILE F 3 29 ? 49.386 12.861 93.341 1.00 103.32 ? 29 ILE E O 1 ATOM 8366 C CB . ILE F 3 29 ? 49.914 12.736 90.551 1.00 99.34 ? 29 ILE E CB 1 ATOM 8367 C CG1 . ILE F 3 29 ? 48.984 13.906 90.224 1.00 96.10 ? 29 ILE E CG1 1 ATOM 8368 C CG2 . ILE F 3 29 ? 50.547 12.181 89.286 1.00 101.88 ? 29 ILE E CG2 1 ATOM 8369 C CD1 . ILE F 3 29 ? 49.666 15.041 89.492 1.00 91.62 ? 29 ILE E CD1 1 ATOM 8370 N N . ARG F 3 30 ? 47.387 11.885 92.943 1.00 109.86 ? 30 ARG E N 1 ATOM 8371 C CA . ARG F 3 30 ? 46.745 12.343 94.173 1.00 109.79 ? 30 ARG E CA 1 ATOM 8372 C C . ARG F 3 30 ? 46.785 13.865 94.302 1.00 108.10 ? 30 ARG E C 1 ATOM 8373 O O . ARG F 3 30 ? 46.229 14.581 93.469 1.00 110.45 ? 30 ARG E O 1 ATOM 8374 C CB . ARG F 3 30 ? 47.393 11.687 95.397 1.00 110.70 ? 30 ARG E CB 1 ATOM 8375 C CG . ARG F 3 30 ? 47.284 10.168 95.410 1.00 115.76 ? 30 ARG E CG 1 ATOM 8376 C CD . ARG F 3 30 ? 47.786 9.576 96.719 1.00 116.46 ? 30 ARG E CD 1 ATOM 8377 N NE . ARG F 3 30 ? 49.198 9.864 96.953 1.00 113.02 ? 30 ARG E NE 1 ATOM 8378 C CZ . ARG F 3 30 ? 49.899 9.379 97.973 1.00 111.50 ? 30 ARG E CZ 1 ATOM 8379 N NH1 . ARG F 3 30 ? 49.322 8.576 98.857 1.00 116.10 ? 30 ARG E NH1 1 ATOM 8380 N NH2 . ARG F 3 30 ? 51.179 9.694 98.109 1.00 106.80 ? 30 ARG E NH2 1 ATOM 8381 N N . ASN F 3 31 ? 47.448 14.354 95.345 1.00 105.12 ? 31 ASN E N 1 ATOM 8382 C CA . ASN F 3 31 ? 47.492 15.785 95.622 1.00 101.60 ? 31 ASN E CA 1 ATOM 8383 C C . ASN F 3 31 ? 48.875 16.378 95.370 1.00 98.56 ? 31 ASN E C 1 ATOM 8384 O O . ASN F 3 31 ? 49.355 17.204 96.146 1.00 99.84 ? 31 ASN E O 1 ATOM 8385 C CB . ASN F 3 31 ? 47.065 16.051 97.069 1.00 102.95 ? 31 ASN E CB 1 ATOM 8386 C CG . ASN F 3 31 ? 46.601 17.477 97.291 1.00 104.50 ? 31 ASN E CG 1 ATOM 8387 O OD1 . ASN F 3 31 ? 46.009 18.095 96.407 1.00 106.19 ? 31 ASN E OD1 1 ATOM 8388 N ND2 . ASN F 3 31 ? 46.870 18.009 98.479 1.00 104.87 ? 31 ASN E ND2 1 ATOM 8389 N N . ASP F 3 32 ? 49.512 15.961 94.280 1.00 95.57 ? 32 ASP E N 1 ATOM 8390 C CA . ASP F 3 32 ? 50.882 16.381 93.998 1.00 93.28 ? 32 ASP E CA 1 ATOM 8391 C C . ASP F 3 32 ? 51.024 17.137 92.678 1.00 89.52 ? 32 ASP E C 1 ATOM 8392 O O . ASP F 3 32 ? 51.599 16.623 91.717 1.00 87.73 ? 32 ASP E O 1 ATOM 8393 C CB . ASP F 3 32 ? 51.812 15.165 93.993 1.00 96.73 ? 32 ASP E CB 1 ATOM 8394 C CG . ASP F 3 32 ? 51.842 14.450 95.328 1.00 100.21 ? 32 ASP E CG 1 ATOM 8395 O OD1 . ASP F 3 32 ? 51.858 13.201 95.334 1.00 104.31 ? 32 ASP E OD1 1 ATOM 8396 O OD2 . ASP F 3 32 ? 51.851 15.135 96.372 1.00 99.24 ? 32 ASP E OD2 1 ATOM 8397 N N . LEU F 3 33 ? 50.508 18.361 92.637 1.00 87.15 ? 33 LEU E N 1 ATOM 8398 C CA . LEU F 3 33 ? 50.661 19.207 91.461 1.00 78.70 ? 33 LEU E CA 1 ATOM 8399 C C . LEU F 3 33 ? 51.149 20.598 91.846 1.00 72.70 ? 33 LEU E C 1 ATOM 8400 O O . LEU F 3 33 ? 50.760 21.138 92.881 1.00 70.73 ? 33 LEU E O 1 ATOM 8401 C CB . LEU F 3 33 ? 49.346 19.318 90.690 1.00 76.98 ? 33 LEU E CB 1 ATOM 8402 C CG . LEU F 3 33 ? 49.488 19.952 89.305 1.00 74.85 ? 33 LEU E CG 1 ATOM 8403 C CD1 . LEU F 3 33 ? 49.705 18.885 88.243 1.00 71.43 ? 33 LEU E CD1 1 ATOM 8404 C CD2 . LEU F 3 33 ? 48.298 20.832 88.967 1.00 72.60 ? 33 LEU E CD2 1 ATOM 8405 N N . GLY F 3 34 ? 52.003 21.172 91.006 1.00 71.31 ? 34 GLY E N 1 ATOM 8406 C CA . GLY F 3 34 ? 52.504 22.513 91.233 1.00 68.95 ? 34 GLY E CA 1 ATOM 8407 C C . GLY F 3 34 ? 52.129 23.457 90.108 1.00 65.98 ? 34 GLY E C 1 ATOM 8408 O O . GLY F 3 34 ? 52.013 23.046 88.954 1.00 64.91 ? 34 GLY E O 1 ATOM 8409 N N . TRP F 3 35 ? 51.933 24.727 90.447 1.00 64.51 ? 35 TRP E N 1 ATOM 8410 C CA . TRP F 3 35 ? 51.625 25.749 89.453 1.00 67.23 ? 35 TRP E CA 1 ATOM 8411 C C . TRP F 3 35 ? 52.698 26.833 89.430 1.00 61.93 ? 35 TRP E C 1 ATOM 8412 O O . TRP F 3 35 ? 53.109 27.335 90.475 1.00 60.46 ? 35 TRP E O 1 ATOM 8413 C CB . TRP F 3 35 ? 50.254 26.370 89.725 1.00 69.28 ? 35 TRP E CB 1 ATOM 8414 C CG . TRP F 3 35 ? 49.102 25.478 89.368 1.00 72.95 ? 35 TRP E CG 1 ATOM 8415 C CD1 . TRP F 3 35 ? 48.331 24.748 90.225 1.00 76.46 ? 35 TRP E CD1 1 ATOM 8416 C CD2 . TRP F 3 35 ? 48.589 25.226 88.054 1.00 78.33 ? 35 TRP E CD2 1 ATOM 8417 N NE1 . TRP F 3 35 ? 47.370 24.058 89.528 1.00 80.61 ? 35 TRP E NE1 1 ATOM 8418 C CE2 . TRP F 3 35 ? 47.507 24.333 88.193 1.00 82.27 ? 35 TRP E CE2 1 ATOM 8419 C CE3 . TRP F 3 35 ? 48.940 25.667 86.774 1.00 78.64 ? 35 TRP E CE3 1 ATOM 8420 C CZ2 . TRP F 3 35 ? 46.773 23.875 87.101 1.00 85.35 ? 35 TRP E CZ2 1 ATOM 8421 C CZ3 . TRP F 3 35 ? 48.211 25.211 85.691 1.00 82.07 ? 35 TRP E CZ3 1 ATOM 8422 C CH2 . TRP F 3 35 ? 47.139 24.325 85.861 1.00 85.49 ? 35 TRP E CH2 1 ATOM 8423 N N . TYR F 3 36 ? 53.141 27.196 88.231 1.00 60.08 ? 36 TYR E N 1 ATOM 8424 C CA . TYR F 3 36 ? 54.218 28.167 88.080 1.00 65.08 ? 36 TYR E CA 1 ATOM 8425 C C . TYR F 3 36 ? 53.840 29.321 87.156 1.00 73.58 ? 36 TYR E C 1 ATOM 8426 O O . TYR F 3 36 ? 52.937 29.202 86.329 1.00 73.45 ? 36 TYR E O 1 ATOM 8427 C CB . TYR F 3 36 ? 55.480 27.480 87.552 1.00 66.01 ? 36 TYR E CB 1 ATOM 8428 C CG . TYR F 3 36 ? 56.022 26.406 88.465 1.00 66.05 ? 36 TYR E CG 1 ATOM 8429 C CD1 . TYR F 3 36 ? 55.564 25.098 88.380 1.00 67.17 ? 36 TYR E CD1 1 ATOM 8430 C CD2 . TYR F 3 36 ? 56.997 26.699 89.408 1.00 61.08 ? 36 TYR E CD2 1 ATOM 8431 C CE1 . TYR F 3 36 ? 56.057 24.115 89.212 1.00 66.03 ? 36 TYR E CE1 1 ATOM 8432 C CE2 . TYR F 3 36 ? 57.497 25.722 90.244 1.00 61.00 ? 36 TYR E CE2 1 ATOM 8433 C CZ . TYR F 3 36 ? 57.025 24.431 90.142 1.00 64.66 ? 36 TYR E CZ 1 ATOM 8434 O OH . TYR F 3 36 ? 57.520 23.453 90.973 1.00 69.29 ? 36 TYR E OH 1 ATOM 8435 N N . GLN F 3 37 ? 54.549 30.435 87.307 1.00 79.45 ? 37 GLN E N 1 ATOM 8436 C CA . GLN F 3 37 ? 54.381 31.595 86.441 1.00 80.07 ? 37 GLN E CA 1 ATOM 8437 C C . GLN F 3 37 ? 55.724 31.965 85.829 1.00 78.35 ? 37 GLN E C 1 ATOM 8438 O O . GLN F 3 37 ? 56.731 32.030 86.532 1.00 78.28 ? 37 GLN E O 1 ATOM 8439 C CB . GLN F 3 37 ? 53.806 32.780 87.221 1.00 84.34 ? 37 GLN E CB 1 ATOM 8440 C CG . GLN F 3 37 ? 53.629 34.051 86.401 1.00 89.60 ? 37 GLN E CG 1 ATOM 8441 C CD . GLN F 3 37 ? 53.288 35.258 87.259 1.00 89.15 ? 37 GLN E CD 1 ATOM 8442 O OE1 . GLN F 3 37 ? 53.932 35.513 88.276 1.00 88.43 ? 37 GLN E OE1 1 ATOM 8443 N NE2 . GLN F 3 37 ? 52.268 36.004 86.851 1.00 90.74 ? 37 GLN E NE2 1 ATOM 8444 N N . GLN F 3 38 ? 55.746 32.200 84.521 1.00 76.07 ? 38 GLN E N 1 ATOM 8445 C CA . GLN F 3 38 ? 56.984 32.591 83.858 1.00 71.92 ? 38 GLN E CA 1 ATOM 8446 C C . GLN F 3 38 ? 56.766 33.742 82.885 1.00 70.92 ? 38 GLN E C 1 ATOM 8447 O O . GLN F 3 38 ? 55.976 33.642 81.947 1.00 72.24 ? 38 GLN E O 1 ATOM 8448 C CB . GLN F 3 38 ? 57.607 31.401 83.123 1.00 69.57 ? 38 GLN E CB 1 ATOM 8449 C CG . GLN F 3 38 ? 59.004 31.681 82.580 1.00 64.18 ? 38 GLN E CG 1 ATOM 8450 C CD . GLN F 3 38 ? 59.619 30.480 81.888 1.00 64.05 ? 38 GLN E CD 1 ATOM 8451 O OE1 . GLN F 3 38 ? 58.914 29.652 81.311 1.00 66.01 ? 38 GLN E OE1 1 ATOM 8452 N NE2 . GLN F 3 38 ? 60.941 30.378 81.945 1.00 61.69 ? 38 GLN E NE2 1 ATOM 8453 N N . LYS F 3 39 ? 57.477 34.838 83.126 1.00 66.86 ? 39 LYS E N 1 ATOM 8454 C CA . LYS F 3 39 ? 57.450 35.991 82.239 1.00 67.22 ? 39 LYS E CA 1 ATOM 8455 C C . LYS F 3 39 ? 58.667 35.948 81.321 1.00 69.93 ? 39 LYS E C 1 ATOM 8456 O O . LYS F 3 39 ? 59.701 35.395 81.694 1.00 68.50 ? 39 LYS E O 1 ATOM 8457 C CB . LYS F 3 39 ? 57.420 37.291 83.046 1.00 67.35 ? 39 LYS E CB 1 ATOM 8458 C CG . LYS F 3 39 ? 56.188 37.445 83.923 1.00 68.75 ? 39 LYS E CG 1 ATOM 8459 C CD . LYS F 3 39 ? 56.137 38.817 84.571 1.00 77.98 ? 39 LYS E CD 1 ATOM 8460 C CE . LYS F 3 39 ? 54.862 38.996 85.377 1.00 81.88 ? 39 LYS E CE 1 ATOM 8461 N NZ . LYS F 3 39 ? 54.757 40.367 85.946 1.00 85.12 ? 39 LYS E NZ 1 ATOM 8462 N N . PRO F 3 40 ? 58.541 36.514 80.110 1.00 75.41 ? 40 PRO E N 1 ATOM 8463 C CA . PRO F 3 40 ? 59.638 36.523 79.136 1.00 76.48 ? 40 PRO E CA 1 ATOM 8464 C C . PRO F 3 40 ? 60.930 37.126 79.686 1.00 80.02 ? 40 PRO E C 1 ATOM 8465 O O . PRO F 3 40 ? 61.010 38.339 79.882 1.00 88.39 ? 40 PRO E O 1 ATOM 8466 C CB . PRO F 3 40 ? 59.086 37.383 77.997 1.00 79.39 ? 40 PRO E CB 1 ATOM 8467 C CG . PRO F 3 40 ? 57.614 37.217 78.089 1.00 79.55 ? 40 PRO E CG 1 ATOM 8468 C CD . PRO F 3 40 ? 57.310 37.104 79.555 1.00 78.56 ? 40 PRO E CD 1 ATOM 8469 N N . GLY F 3 41 ? 61.924 36.280 79.934 1.00 74.58 ? 41 GLY E N 1 ATOM 8470 C CA . GLY F 3 41 ? 63.230 36.744 80.364 1.00 73.25 ? 41 GLY E CA 1 ATOM 8471 C C . GLY F 3 41 ? 63.560 36.431 81.810 1.00 72.78 ? 41 GLY E C 1 ATOM 8472 O O . GLY F 3 41 ? 64.566 36.907 82.337 1.00 76.52 ? 41 GLY E O 1 ATOM 8473 N N . LYS F 3 42 ? 62.718 35.631 82.457 1.00 67.98 ? 42 LYS E N 1 ATOM 8474 C CA . LYS F 3 42 ? 62.945 35.273 83.852 1.00 66.73 ? 42 LYS E CA 1 ATOM 8475 C C . LYS F 3 42 ? 62.702 33.791 84.122 1.00 65.69 ? 42 LYS E C 1 ATOM 8476 O O . LYS F 3 42 ? 62.148 33.073 83.288 1.00 63.45 ? 42 LYS E O 1 ATOM 8477 C CB . LYS F 3 42 ? 62.057 36.116 84.772 1.00 67.53 ? 42 LYS E CB 1 ATOM 8478 C CG . LYS F 3 42 ? 62.550 37.537 84.992 1.00 74.82 ? 42 LYS E CG 1 ATOM 8479 C CD . LYS F 3 42 ? 61.777 38.219 86.109 1.00 78.98 ? 42 LYS E CD 1 ATOM 8480 C CE . LYS F 3 42 ? 62.386 39.565 86.463 1.00 83.64 ? 42 LYS E CE 1 ATOM 8481 N NZ . LYS F 3 42 ? 61.680 40.202 87.608 1.00 86.17 ? 42 LYS E NZ 1 ATOM 8482 N N . ALA F 3 43 ? 63.129 33.344 85.299 1.00 66.75 ? 43 ALA E N 1 ATOM 8483 C CA . ALA F 3 43 ? 62.900 31.976 85.740 1.00 64.32 ? 43 ALA E CA 1 ATOM 8484 C C . ALA F 3 43 ? 61.474 31.827 86.264 1.00 69.16 ? 43 ALA E C 1 ATOM 8485 O O . ALA F 3 43 ? 60.893 32.794 86.759 1.00 71.61 ? 43 ALA E O 1 ATOM 8486 C CB . ALA F 3 43 ? 63.911 31.589 86.812 1.00 60.06 ? 43 ALA E CB 1 ATOM 8487 N N . PRO F 3 44 ? 60.901 30.618 86.143 1.00 70.75 ? 44 PRO E N 1 ATOM 8488 C CA . PRO F 3 44 ? 59.549 30.341 86.646 1.00 69.27 ? 44 PRO E CA 1 ATOM 8489 C C . PRO F 3 44 ? 59.380 30.659 88.131 1.00 67.58 ? 44 PRO E C 1 ATOM 8490 O O . PRO F 3 44 ? 60.268 30.360 88.928 1.00 67.69 ? 44 PRO E O 1 ATOM 8491 C CB . PRO F 3 44 ? 59.386 28.839 86.395 1.00 67.44 ? 44 PRO E CB 1 ATOM 8492 C CG . PRO F 3 44 ? 60.286 28.553 85.250 1.00 68.10 ? 44 PRO E CG 1 ATOM 8493 C CD . PRO F 3 44 ? 61.468 29.460 85.427 1.00 69.87 ? 44 PRO E CD 1 ATOM 8494 N N . LYS F 3 45 ? 58.250 31.263 88.488 1.00 67.66 ? 45 LYS E N 1 ATOM 8495 C CA . LYS F 3 45 ? 57.938 31.564 89.882 1.00 64.46 ? 45 LYS E CA 1 ATOM 8496 C C . LYS F 3 45 ? 56.838 30.646 90.404 1.00 63.79 ? 45 LYS E C 1 ATOM 8497 O O . LYS F 3 45 ? 55.788 30.506 89.778 1.00 63.88 ? 45 LYS E O 1 ATOM 8498 C CB . LYS F 3 45 ? 57.515 33.028 90.042 1.00 63.86 ? 45 LYS E CB 1 ATOM 8499 C CG . LYS F 3 45 ? 57.040 33.380 91.446 1.00 70.13 ? 45 LYS E CG 1 ATOM 8500 C CD . LYS F 3 45 ? 56.378 34.752 91.501 1.00 79.11 ? 45 LYS E CD 1 ATOM 8501 C CE . LYS F 3 45 ? 57.373 35.873 91.246 1.00 82.88 ? 45 LYS E CE 1 ATOM 8502 N NZ . LYS F 3 45 ? 56.728 37.214 91.336 1.00 85.10 ? 45 LYS E NZ 1 ATOM 8503 N N . LEU F 3 46 ? 57.084 30.024 91.553 1.00 64.44 ? 46 LEU E N 1 ATOM 8504 C CA . LEU F 3 46 ? 56.111 29.124 92.164 1.00 65.67 ? 46 LEU E CA 1 ATOM 8505 C C . LEU F 3 46 ? 54.876 29.876 92.655 1.00 70.44 ? 46 LEU E C 1 ATOM 8506 O O . LEU F 3 46 ? 54.986 30.890 93.344 1.00 74.35 ? 46 LEU E O 1 ATOM 8507 C CB . LEU F 3 46 ? 56.749 28.358 93.325 1.00 64.03 ? 46 LEU E CB 1 ATOM 8508 C CG . LEU F 3 46 ? 55.828 27.394 94.076 1.00 63.62 ? 46 LEU E CG 1 ATOM 8509 C CD1 . LEU F 3 46 ? 55.244 26.360 93.123 1.00 56.16 ? 46 LEU E CD1 1 ATOM 8510 C CD2 . LEU F 3 46 ? 56.569 26.718 95.221 1.00 66.92 ? 46 LEU E CD2 1 ATOM 8511 N N . LEU F 3 47 ? 53.700 29.369 92.295 1.00 72.19 ? 47 LEU E N 1 ATOM 8512 C CA . LEU F 3 47 ? 52.438 29.976 92.710 1.00 75.60 ? 47 LEU E CA 1 ATOM 8513 C C . LEU F 3 47 ? 51.663 29.066 93.653 1.00 80.09 ? 47 LEU E C 1 ATOM 8514 O O . LEU F 3 47 ? 51.315 29.459 94.765 1.00 86.42 ? 47 LEU E O 1 ATOM 8515 C CB . LEU F 3 47 ? 51.573 30.308 91.493 1.00 74.75 ? 47 LEU E CB 1 ATOM 8516 C CG . LEU F 3 47 ? 52.154 31.269 90.457 1.00 74.91 ? 47 LEU E CG 1 ATOM 8517 C CD1 . LEU F 3 47 ? 51.098 31.613 89.420 1.00 77.11 ? 47 LEU E CD1 1 ATOM 8518 C CD2 . LEU F 3 47 ? 52.690 32.526 91.122 1.00 76.54 ? 47 LEU E CD2 1 ATOM 8519 N N . ILE F 3 48 ? 51.391 27.849 93.196 1.00 81.32 ? 48 ILE E N 1 ATOM 8520 C CA . ILE F 3 48 ? 50.613 26.894 93.975 1.00 85.81 ? 48 ILE E CA 1 ATOM 8521 C C . ILE F 3 48 ? 51.337 25.561 94.130 1.00 84.43 ? 48 ILE E C 1 ATOM 8522 O O . ILE F 3 48 ? 51.691 24.918 93.143 1.00 81.19 ? 48 ILE E O 1 ATOM 8523 C CB . ILE F 3 48 ? 49.235 26.633 93.332 1.00 86.16 ? 48 ILE E CB 1 ATOM 8524 C CG1 . ILE F 3 48 ? 48.421 27.926 93.261 1.00 89.00 ? 48 ILE E CG1 1 ATOM 8525 C CG2 . ILE F 3 48 ? 48.478 25.564 94.105 1.00 91.00 ? 48 ILE E CG2 1 ATOM 8526 C CD1 . ILE F 3 48 ? 48.074 28.501 94.615 1.00 94.83 ? 48 ILE E CD1 1 ATOM 8527 N N . TYR F 3 49 ? 51.560 25.152 95.374 1.00 87.21 ? 49 TYR E N 1 ATOM 8528 C CA . TYR F 3 49 ? 52.089 23.822 95.655 1.00 85.70 ? 49 TYR E CA 1 ATOM 8529 C C . TYR F 3 49 ? 51.028 23.002 96.383 1.00 91.11 ? 49 TYR E C 1 ATOM 8530 O O . TYR F 3 49 ? 50.024 23.550 96.839 1.00 97.23 ? 49 TYR E O 1 ATOM 8531 C CB . TYR F 3 49 ? 53.377 23.901 96.478 1.00 79.80 ? 49 TYR E CB 1 ATOM 8532 C CG . TYR F 3 49 ? 53.191 24.384 97.899 1.00 81.38 ? 49 TYR E CG 1 ATOM 8533 C CD1 . TYR F 3 49 ? 53.152 25.740 98.193 1.00 83.37 ? 49 TYR E CD1 1 ATOM 8534 C CD2 . TYR F 3 49 ? 53.072 23.484 98.948 1.00 83.35 ? 49 TYR E CD2 1 ATOM 8535 C CE1 . TYR F 3 49 ? 52.988 26.185 99.491 1.00 88.02 ? 49 TYR E CE1 1 ATOM 8536 C CE2 . TYR F 3 49 ? 52.909 23.918 100.248 1.00 87.74 ? 49 TYR E CE2 1 ATOM 8537 C CZ . TYR F 3 49 ? 52.869 25.269 100.513 1.00 90.38 ? 49 TYR E CZ 1 ATOM 8538 O OH . TYR F 3 49 ? 52.706 25.708 101.806 1.00 96.99 ? 49 TYR E OH 1 ATOM 8539 N N . ALA F 3 50 ? 51.250 21.692 96.470 1.00 89.52 ? 50 ALA E N 1 ATOM 8540 C CA . ALA F 3 50 ? 50.291 20.761 97.071 1.00 90.77 ? 50 ALA E CA 1 ATOM 8541 C C . ALA F 3 50 ? 48.921 20.847 96.398 1.00 94.73 ? 50 ALA E C 1 ATOM 8542 O O . ALA F 3 50 ? 47.901 20.514 97.003 1.00 101.18 ? 50 ALA E O 1 ATOM 8543 C CB . ALA F 3 50 ? 50.166 21.016 98.568 1.00 92.32 ? 50 ALA E CB 1 ATOM 8544 N N . ALA F 3 51 ? 48.918 21.312 95.149 1.00 90.22 ? 51 ALA E N 1 ATOM 8545 C CA . ALA F 3 51 ? 47.717 21.434 94.319 1.00 88.33 ? 51 ALA E CA 1 ATOM 8546 C C . ALA F 3 51 ? 46.644 22.361 94.895 1.00 91.51 ? 51 ALA E C 1 ATOM 8547 O O . ALA F 3 51 ? 45.573 22.502 94.307 1.00 96.47 ? 51 ALA E O 1 ATOM 8548 C CB . ALA F 3 51 ? 47.122 20.054 94.054 1.00 89.30 ? 51 ALA E CB 1 ATOM 8549 N N . SER F 3 52 ? 46.924 22.999 96.029 1.00 92.11 ? 52 SER E N 1 ATOM 8550 C CA . SER F 3 52 ? 45.939 23.875 96.660 1.00 95.96 ? 52 SER E CA 1 ATOM 8551 C C . SER F 3 52 ? 46.572 24.934 97.558 1.00 95.21 ? 52 SER E C 1 ATOM 8552 O O . SER F 3 52 ? 45.992 25.998 97.775 1.00 97.66 ? 52 SER E O 1 ATOM 8553 C CB . SER F 3 52 ? 44.938 23.049 97.476 1.00 97.65 ? 52 SER E CB 1 ATOM 8554 O OG . SER F 3 52 ? 44.158 22.211 96.641 1.00 96.27 ? 52 SER E OG 1 ATOM 8555 N N . SER F 3 53 ? 47.758 24.640 98.080 1.00 91.89 ? 53 SER E N 1 ATOM 8556 C CA . SER F 3 53 ? 48.412 25.531 99.032 1.00 95.05 ? 53 SER E CA 1 ATOM 8557 C C . SER F 3 53 ? 48.907 26.818 98.378 1.00 95.77 ? 53 SER E C 1 ATOM 8558 O O . SER F 3 53 ? 49.614 26.786 97.371 1.00 94.55 ? 53 SER E O 1 ATOM 8559 C CB . SER F 3 53 ? 49.578 24.816 99.717 1.00 93.06 ? 53 SER E CB 1 ATOM 8560 O OG . SER F 3 53 ? 49.132 23.670 100.421 1.00 95.71 ? 53 SER E OG 1 ATOM 8561 N N . LEU F 3 54 ? 48.529 27.948 98.965 1.00 100.60 ? 54 LEU E N 1 ATOM 8562 C CA . LEU F 3 54 ? 48.955 29.255 98.480 1.00 100.66 ? 54 LEU E CA 1 ATOM 8563 C C . LEU F 3 54 ? 50.384 29.538 98.937 1.00 100.73 ? 54 LEU E C 1 ATOM 8564 O O . LEU F 3 54 ? 50.687 29.465 100.128 1.00 107.36 ? 54 LEU E O 1 ATOM 8565 C CB . LEU F 3 54 ? 47.994 30.340 98.976 1.00 107.51 ? 54 LEU E CB 1 ATOM 8566 C CG . LEU F 3 54 ? 47.947 31.689 98.252 1.00 109.06 ? 54 LEU E CG 1 ATOM 8567 C CD1 . LEU F 3 54 ? 49.006 32.643 98.778 1.00 111.80 ? 54 LEU E CD1 1 ATOM 8568 C CD2 . LEU F 3 54 ? 48.093 31.492 96.752 1.00 102.08 ? 54 LEU E CD2 1 ATOM 8569 N N . GLN F 3 55 ? 51.261 29.854 97.989 1.00 96.11 ? 55 GLN E N 1 ATOM 8570 C CA . GLN F 3 55 ? 52.675 30.059 98.293 1.00 96.93 ? 55 GLN E CA 1 ATOM 8571 C C . GLN F 3 55 ? 52.898 31.385 99.016 1.00 103.06 ? 55 GLN E C 1 ATOM 8572 O O . GLN F 3 55 ? 52.175 32.353 98.791 1.00 107.50 ? 55 GLN E O 1 ATOM 8573 C CB . GLN F 3 55 ? 53.509 30.004 97.011 1.00 93.94 ? 55 GLN E CB 1 ATOM 8574 C CG . GLN F 3 55 ? 54.873 29.344 97.174 1.00 94.04 ? 55 GLN E CG 1 ATOM 8575 C CD . GLN F 3 55 ? 55.915 30.274 97.759 1.00 98.81 ? 55 GLN E CD 1 ATOM 8576 O OE1 . GLN F 3 55 ? 55.834 31.491 97.601 1.00 108.02 ? 55 GLN E OE1 1 ATOM 8577 N NE2 . GLN F 3 55 ? 56.904 29.704 98.440 1.00 94.64 ? 55 GLN E NE2 1 ATOM 8578 N N . SER F 3 56 ? 53.903 31.419 99.884 1.00 103.93 ? 56 SER E N 1 ATOM 8579 C CA . SER F 3 56 ? 54.179 32.602 100.694 1.00 109.22 ? 56 SER E CA 1 ATOM 8580 C C . SER F 3 56 ? 54.631 33.784 99.842 1.00 106.05 ? 56 SER E C 1 ATOM 8581 O O . SER F 3 56 ? 55.742 33.789 99.312 1.00 99.79 ? 56 SER E O 1 ATOM 8582 C CB . SER F 3 56 ? 55.240 32.286 101.750 1.00 113.25 ? 56 SER E CB 1 ATOM 8583 O OG . SER F 3 56 ? 54.841 31.194 102.560 1.00 115.61 ? 56 SER E OG 1 ATOM 8584 N N . GLY F 3 57 ? 53.762 34.782 99.713 1.00 109.41 ? 57 GLY E N 1 ATOM 8585 C CA . GLY F 3 57 ? 54.099 35.990 98.981 1.00 109.65 ? 57 GLY E CA 1 ATOM 8586 C C . GLY F 3 57 ? 53.154 36.325 97.841 1.00 106.77 ? 57 GLY E C 1 ATOM 8587 O O . GLY F 3 57 ? 52.795 37.486 97.649 1.00 112.94 ? 57 GLY E O 1 ATOM 8588 N N . VAL F 3 58 ? 52.754 35.311 97.080 1.00 99.99 ? 58 VAL E N 1 ATOM 8589 C CA . VAL F 3 58 ? 51.900 35.521 95.915 1.00 96.78 ? 58 VAL E CA 1 ATOM 8590 C C . VAL F 3 58 ? 50.492 35.950 96.329 1.00 104.17 ? 58 VAL E C 1 ATOM 8591 O O . VAL F 3 58 ? 50.012 35.562 97.395 1.00 108.56 ? 58 VAL E O 1 ATOM 8592 C CB . VAL F 3 58 ? 51.822 34.249 95.040 1.00 92.54 ? 58 VAL E CB 1 ATOM 8593 C CG1 . VAL F 3 58 ? 53.202 33.884 94.518 1.00 89.27 ? 58 VAL E CG1 1 ATOM 8594 C CG2 . VAL F 3 58 ? 51.223 33.094 95.821 1.00 94.91 ? 58 VAL E CG2 1 ATOM 8595 N N . PRO F 3 59 ? 49.836 36.776 95.492 1.00 105.05 ? 59 PRO E N 1 ATOM 8596 C CA . PRO F 3 59 ? 48.477 37.274 95.745 1.00 100.70 ? 59 PRO E CA 1 ATOM 8597 C C . PRO F 3 59 ? 47.460 36.167 96.017 1.00 109.60 ? 59 PRO E C 1 ATOM 8598 O O . PRO F 3 59 ? 47.628 35.041 95.553 1.00 102.58 ? 59 PRO E O 1 ATOM 8599 C CB . PRO F 3 59 ? 48.136 38.014 94.450 1.00 102.06 ? 59 PRO E CB 1 ATOM 8600 C CG . PRO F 3 59 ? 49.450 38.482 93.944 1.00 100.34 ? 59 PRO E CG 1 ATOM 8601 C CD . PRO F 3 59 ? 50.424 37.390 94.287 1.00 98.12 ? 59 PRO E CD 1 ATOM 8602 N N . SER F 3 60 ? 46.409 36.498 96.761 1.00 119.61 ? 60 SER E N 1 ATOM 8603 C CA . SER F 3 60 ? 45.406 35.514 97.155 1.00 121.13 ? 60 SER E CA 1 ATOM 8604 C C . SER F 3 60 ? 44.371 35.270 96.061 1.00 119.48 ? 60 SER E C 1 ATOM 8605 O O . SER F 3 60 ? 43.519 34.391 96.192 1.00 119.57 ? 60 SER E O 1 ATOM 8606 C CB . SER F 3 60 ? 44.702 35.956 98.440 1.00 130.14 ? 60 SER E CB 1 ATOM 8607 O OG . SER F 3 60 ? 45.632 36.182 99.485 1.00 132.75 ? 60 SER E OG 1 ATOM 8608 N N . ARG F 3 61 ? 44.440 36.048 94.985 1.00 117.14 ? 61 ARG E N 1 ATOM 8609 C CA . ARG F 3 61 ? 43.520 35.865 93.870 1.00 113.68 ? 61 ARG E CA 1 ATOM 8610 C C . ARG F 3 61 ? 43.819 34.557 93.143 1.00 106.26 ? 61 ARG E C 1 ATOM 8611 O O . ARG F 3 61 ? 42.925 33.943 92.563 1.00 105.42 ? 61 ARG E O 1 ATOM 8612 C CB . ARG F 3 61 ? 43.588 37.051 92.903 1.00 111.99 ? 61 ARG E CB 1 ATOM 8613 C CG . ARG F 3 61 ? 44.980 37.385 92.396 1.00 102.20 ? 61 ARG E CG 1 ATOM 8614 C CD . ARG F 3 61 ? 44.936 38.556 91.424 1.00 104.47 ? 61 ARG E CD 1 ATOM 8615 N NE . ARG F 3 61 ? 46.265 38.926 90.946 1.00 104.96 ? 61 ARG E NE 1 ATOM 8616 C CZ . ARG F 3 61 ? 47.029 39.858 91.507 1.00 107.97 ? 61 ARG E CZ 1 ATOM 8617 N NH1 . ARG F 3 61 ? 46.595 40.521 92.570 1.00 114.71 ? 61 ARG E NH1 1 ATOM 8618 N NH2 . ARG F 3 61 ? 48.226 40.129 91.004 1.00 99.90 ? 61 ARG E NH2 1 ATOM 8619 N N . PHE F 3 62 ? 45.078 34.131 93.189 1.00 99.29 ? 62 PHE E N 1 ATOM 8620 C CA . PHE F 3 62 ? 45.476 32.843 92.629 1.00 93.61 ? 62 PHE E CA 1 ATOM 8621 C C . PHE F 3 62 ? 45.078 31.702 93.558 1.00 95.71 ? 62 PHE E C 1 ATOM 8622 O O . PHE F 3 62 ? 45.303 31.770 94.766 1.00 100.04 ? 62 PHE E O 1 ATOM 8623 C CB . PHE F 3 62 ? 46.986 32.802 92.380 1.00 89.38 ? 62 PHE E CB 1 ATOM 8624 C CG . PHE F 3 62 ? 47.444 33.697 91.267 1.00 89.29 ? 62 PHE E CG 1 ATOM 8625 C CD1 . PHE F 3 62 ? 47.524 33.223 89.968 1.00 83.46 ? 62 PHE E CD1 1 ATOM 8626 C CD2 . PHE F 3 62 ? 47.803 35.011 91.519 1.00 94.30 ? 62 PHE E CD2 1 ATOM 8627 C CE1 . PHE F 3 62 ? 47.948 34.042 88.941 1.00 82.44 ? 62 PHE E CE1 1 ATOM 8628 C CE2 . PHE F 3 62 ? 48.229 35.835 90.497 1.00 93.74 ? 62 PHE E CE2 1 ATOM 8629 C CZ . PHE F 3 62 ? 48.302 35.350 89.206 1.00 87.85 ? 62 PHE E CZ 1 ATOM 8630 N N . SER F 3 63 ? 44.492 30.652 92.990 1.00 94.34 ? 63 SER E N 1 ATOM 8631 C CA . SER F 3 63 ? 44.108 29.482 93.772 1.00 96.20 ? 63 SER E CA 1 ATOM 8632 C C . SER F 3 63 ? 43.902 28.256 92.891 1.00 93.15 ? 63 SER E C 1 ATOM 8633 O O . SER F 3 63 ? 43.082 28.269 91.973 1.00 91.81 ? 63 SER E O 1 ATOM 8634 C CB . SER F 3 63 ? 42.836 29.764 94.573 1.00 103.93 ? 63 SER E CB 1 ATOM 8635 O OG . SER F 3 63 ? 42.504 28.659 95.396 1.00 107.12 ? 63 SER E OG 1 ATOM 8636 N N . GLY F 3 64 ? 44.653 27.198 93.179 1.00 93.00 ? 64 GLY E N 1 ATOM 8637 C CA . GLY F 3 64 ? 44.518 25.943 92.464 1.00 94.54 ? 64 GLY E CA 1 ATOM 8638 C C . GLY F 3 64 ? 43.517 25.032 93.146 1.00 100.98 ? 64 GLY E C 1 ATOM 8639 O O . GLY F 3 64 ? 43.489 24.936 94.372 1.00 103.14 ? 64 GLY E O 1 ATOM 8640 N N . SER F 3 65 ? 42.690 24.362 92.351 1.00 105.64 ? 65 SER E N 1 ATOM 8641 C CA . SER F 3 65 ? 41.654 23.491 92.893 1.00 113.49 ? 65 SER E CA 1 ATOM 8642 C C . SER F 3 65 ? 41.688 22.109 92.250 1.00 115.74 ? 65 SER E C 1 ATOM 8643 O O . SER F 3 65 ? 42.336 21.905 91.224 1.00 112.95 ? 65 SER E O 1 ATOM 8644 C CB . SER F 3 65 ? 40.272 24.123 92.701 1.00 117.09 ? 65 SER E CB 1 ATOM 8645 O OG . SER F 3 65 ? 39.251 23.291 93.224 1.00 120.05 ? 65 SER E OG 1 ATOM 8646 N N . GLY F 3 66 ? 40.986 21.163 92.863 1.00 122.86 ? 66 GLY E N 1 ATOM 8647 C CA . GLY F 3 66 ? 40.905 19.813 92.338 1.00 125.12 ? 66 GLY E CA 1 ATOM 8648 C C . GLY F 3 66 ? 41.997 18.904 92.866 1.00 124.47 ? 66 GLY E C 1 ATOM 8649 O O . GLY F 3 66 ? 43.075 19.363 93.244 1.00 122.40 ? 66 GLY E O 1 ATOM 8650 N N . SER F 3 67 ? 41.712 17.607 92.891 1.00 127.32 ? 67 SER E N 1 ATOM 8651 C CA . SER F 3 67 ? 42.679 16.615 93.343 1.00 120.61 ? 67 SER E CA 1 ATOM 8652 C C . SER F 3 67 ? 42.519 15.320 92.554 1.00 123.61 ? 67 SER E C 1 ATOM 8653 O O . SER F 3 67 ? 41.635 15.205 91.705 1.00 127.88 ? 67 SER E O 1 ATOM 8654 C CB . SER F 3 67 ? 42.520 16.351 94.841 1.00 117.44 ? 67 SER E CB 1 ATOM 8655 O OG . SER F 3 67 ? 43.492 15.430 95.303 1.00 112.68 ? 67 SER E OG 1 ATOM 8656 N N . GLY F 3 68 ? 43.379 14.347 92.837 1.00 122.09 ? 68 GLY E N 1 ATOM 8657 C CA . GLY F 3 68 ? 43.330 13.068 92.152 1.00 124.63 ? 68 GLY E CA 1 ATOM 8658 C C . GLY F 3 68 ? 44.118 13.071 90.857 1.00 120.77 ? 68 GLY E C 1 ATOM 8659 O O . GLY F 3 68 ? 45.304 12.745 90.841 1.00 116.94 ? 68 GLY E O 1 ATOM 8660 N N . THR F 3 69 ? 43.455 13.442 89.766 1.00 122.39 ? 69 THR E N 1 ATOM 8661 C CA . THR F 3 69 ? 44.095 13.472 88.456 1.00 119.34 ? 69 THR E CA 1 ATOM 8662 C C . THR F 3 69 ? 43.643 14.679 87.635 1.00 114.71 ? 69 THR E C 1 ATOM 8663 O O . THR F 3 69 ? 44.192 14.955 86.567 1.00 109.13 ? 69 THR E O 1 ATOM 8664 C CB . THR F 3 69 ? 43.809 12.181 87.662 1.00 124.66 ? 69 THR E CB 1 ATOM 8665 O OG1 . THR F 3 69 ? 44.466 12.240 86.390 1.00 125.44 ? 69 THR E OG1 1 ATOM 8666 C CG2 . THR F 3 69 ? 42.313 12.002 87.449 1.00 127.84 ? 69 THR E CG2 1 ATOM 8667 N N . ASP F 3 70 ? 42.644 15.397 88.139 1.00 116.40 ? 70 ASP E N 1 ATOM 8668 C CA . ASP F 3 70 ? 42.141 16.590 87.464 1.00 116.74 ? 70 ASP E CA 1 ATOM 8669 C C . ASP F 3 70 ? 42.361 17.833 88.318 1.00 111.28 ? 70 ASP E C 1 ATOM 8670 O O . ASP F 3 70 ? 41.898 17.903 89.456 1.00 112.07 ? 70 ASP E O 1 ATOM 8671 C CB . ASP F 3 70 ? 40.655 16.437 87.133 1.00 127.10 ? 70 ASP E CB 1 ATOM 8672 C CG . ASP F 3 70 ? 40.373 15.230 86.259 1.00 134.15 ? 70 ASP E CG 1 ATOM 8673 O OD1 . ASP F 3 70 ? 40.538 15.335 85.025 1.00 132.27 ? 70 ASP E OD1 1 ATOM 8674 O OD2 . ASP F 3 70 ? 39.981 14.178 86.807 1.00 140.68 ? 70 ASP E OD2 1 ATOM 8675 N N . PHE F 3 71 ? 43.065 18.814 87.763 1.00 107.69 ? 71 PHE E N 1 ATOM 8676 C CA . PHE F 3 71 ? 43.392 20.027 88.504 1.00 104.21 ? 71 PHE E CA 1 ATOM 8677 C C . PHE F 3 71 ? 43.073 21.281 87.697 1.00 105.09 ? 71 PHE E C 1 ATOM 8678 O O . PHE F 3 71 ? 42.996 21.237 86.468 1.00 104.77 ? 71 PHE E O 1 ATOM 8679 C CB . PHE F 3 71 ? 44.868 20.028 88.901 1.00 95.93 ? 71 PHE E CB 1 ATOM 8680 C CG . PHE F 3 71 ? 45.326 18.748 89.540 1.00 94.25 ? 71 PHE E CG 1 ATOM 8681 C CD1 . PHE F 3 71 ? 45.897 17.743 88.776 1.00 92.75 ? 71 PHE E CD1 1 ATOM 8682 C CD2 . PHE F 3 71 ? 45.188 18.550 90.903 1.00 95.15 ? 71 PHE E CD2 1 ATOM 8683 C CE1 . PHE F 3 71 ? 46.319 16.564 89.358 1.00 93.46 ? 71 PHE E CE1 1 ATOM 8684 C CE2 . PHE F 3 71 ? 45.611 17.373 91.492 1.00 97.00 ? 71 PHE E CE2 1 ATOM 8685 C CZ . PHE F 3 71 ? 46.176 16.379 90.718 1.00 96.09 ? 71 PHE E CZ 1 ATOM 8686 N N . THR F 3 72 ? 42.895 22.398 88.395 1.00 106.37 ? 72 THR E N 1 ATOM 8687 C CA . THR F 3 72 ? 42.549 23.657 87.745 1.00 107.90 ? 72 THR E CA 1 ATOM 8688 C C . THR F 3 72 ? 43.099 24.858 88.508 1.00 106.14 ? 72 THR E C 1 ATOM 8689 O O . THR F 3 72 ? 42.842 25.018 89.701 1.00 108.19 ? 72 THR E O 1 ATOM 8690 C CB . THR F 3 72 ? 41.022 23.815 87.603 1.00 115.23 ? 72 THR E CB 1 ATOM 8691 O OG1 . THR F 3 72 ? 40.498 22.732 86.824 1.00 120.78 ? 72 THR E OG1 1 ATOM 8692 C CG2 . THR F 3 72 ? 40.681 25.132 86.925 1.00 115.04 ? 72 THR E CG2 1 ATOM 8693 N N . LEU F 3 73 ? 43.860 25.698 87.813 1.00 103.10 ? 73 LEU E N 1 ATOM 8694 C CA . LEU F 3 73 ? 44.366 26.937 88.395 1.00 100.81 ? 73 LEU E CA 1 ATOM 8695 C C . LEU F 3 73 ? 43.387 28.076 88.147 1.00 103.97 ? 73 LEU E C 1 ATOM 8696 O O . LEU F 3 73 ? 43.150 28.468 87.005 1.00 104.72 ? 73 LEU E O 1 ATOM 8697 C CB . LEU F 3 73 ? 45.739 27.290 87.821 1.00 93.05 ? 73 LEU E CB 1 ATOM 8698 C CG . LEU F 3 73 ? 46.344 28.615 88.293 1.00 88.10 ? 73 LEU E CG 1 ATOM 8699 C CD1 . LEU F 3 73 ? 46.492 28.637 89.807 1.00 86.56 ? 73 LEU E CD1 1 ATOM 8700 C CD2 . LEU F 3 73 ? 47.685 28.872 87.618 1.00 83.99 ? 73 LEU E CD2 1 ATOM 8701 N N . THR F 3 74 ? 42.824 28.607 89.226 1.00 106.34 ? 74 THR E N 1 ATOM 8702 C CA . THR F 3 74 ? 41.828 29.664 89.127 1.00 112.03 ? 74 THR E CA 1 ATOM 8703 C C . THR F 3 74 ? 42.338 30.972 89.719 1.00 113.44 ? 74 THR E C 1 ATOM 8704 O O . THR F 3 74 ? 42.888 30.993 90.819 1.00 112.61 ? 74 THR E O 1 ATOM 8705 C CB . THR F 3 74 ? 40.521 29.256 89.836 1.00 118.99 ? 74 THR E CB 1 ATOM 8706 O OG1 . THR F 3 74 ? 39.903 28.183 89.115 1.00 121.67 ? 74 THR E OG1 1 ATOM 8707 C CG2 . THR F 3 74 ? 39.553 30.430 89.920 1.00 122.94 ? 74 THR E CG2 1 ATOM 8708 N N . ILE F 3 75 ? 42.164 32.059 88.974 1.00 117.49 ? 75 ILE E N 1 ATOM 8709 C CA . ILE F 3 75 ? 42.465 33.392 89.479 1.00 121.37 ? 75 ILE E CA 1 ATOM 8710 C C . ILE F 3 75 ? 41.216 34.272 89.389 1.00 125.60 ? 75 ILE E C 1 ATOM 8711 O O . ILE F 3 75 ? 40.559 34.330 88.349 1.00 125.02 ? 75 ILE E O 1 ATOM 8712 C CB . ILE F 3 75 ? 43.641 34.038 88.713 1.00 118.97 ? 75 ILE E CB 1 ATOM 8713 C CG1 . ILE F 3 75 ? 43.723 35.536 89.012 1.00 124.26 ? 75 ILE E CG1 1 ATOM 8714 C CG2 . ILE F 3 75 ? 43.508 33.796 87.220 1.00 115.79 ? 75 ILE E CG2 1 ATOM 8715 C CD1 . ILE F 3 75 ? 44.911 36.221 88.373 1.00 121.11 ? 75 ILE E CD1 1 ATOM 8716 N N . SER F 3 76 ? 40.894 34.940 90.494 1.00 133.88 ? 76 SER E N 1 ATOM 8717 C CA . SER F 3 76 ? 39.662 35.719 90.622 1.00 140.05 ? 76 SER E CA 1 ATOM 8718 C C . SER F 3 76 ? 39.497 36.781 89.533 1.00 141.67 ? 76 SER E C 1 ATOM 8719 O O . SER F 3 76 ? 38.543 36.743 88.752 1.00 147.16 ? 76 SER E O 1 ATOM 8720 C CB . SER F 3 76 ? 39.612 36.384 92.000 1.00 145.51 ? 76 SER E CB 1 ATOM 8721 O OG . SER F 3 76 ? 38.447 37.178 92.144 1.00 155.24 ? 76 SER E OG 1 ATOM 8722 N N . SER F 3 77 ? 40.421 37.735 89.498 1.00 136.23 ? 77 SER E N 1 ATOM 8723 C CA . SER F 3 77 ? 40.412 38.782 88.480 1.00 131.51 ? 77 SER E CA 1 ATOM 8724 C C . SER F 3 77 ? 41.838 39.203 88.161 1.00 123.68 ? 77 SER E C 1 ATOM 8725 O O . SER F 3 77 ? 42.663 39.358 89.059 1.00 122.61 ? 77 SER E O 1 ATOM 8726 C CB . SER F 3 77 ? 39.586 39.986 88.936 1.00 135.09 ? 77 SER E CB 1 ATOM 8727 O OG . SER F 3 77 ? 38.201 39.723 88.812 1.00 138.49 ? 77 SER E OG 1 ATOM 8728 N N . LEU F 3 78 ? 42.120 39.389 86.878 1.00 119.42 ? 78 LEU E N 1 ATOM 8729 C CA . LEU F 3 78 ? 43.486 39.619 86.425 1.00 113.14 ? 78 LEU E CA 1 ATOM 8730 C C . LEU F 3 78 ? 44.048 40.991 86.767 1.00 113.98 ? 78 LEU E C 1 ATOM 8731 O O . LEU F 3 78 ? 43.344 41.996 86.729 1.00 119.43 ? 78 LEU E O 1 ATOM 8732 C CB . LEU F 3 78 ? 43.571 39.413 84.913 1.00 106.75 ? 78 LEU E CB 1 ATOM 8733 C CG . LEU F 3 78 ? 43.767 37.969 84.465 1.00 104.46 ? 78 LEU E CG 1 ATOM 8734 C CD1 . LEU F 3 78 ? 43.667 37.877 82.955 1.00 105.85 ? 78 LEU E CD1 1 ATOM 8735 C CD2 . LEU F 3 78 ? 45.112 37.459 84.953 1.00 96.24 ? 78 LEU E CD2 1 ATOM 8736 N N . GLN F 3 79 ? 45.330 41.009 87.109 1.00 112.85 ? 79 GLN E N 1 ATOM 8737 C CA . GLN F 3 79 ? 46.102 42.239 87.139 1.00 117.10 ? 79 GLN E CA 1 ATOM 8738 C C . GLN F 3 79 ? 47.237 42.096 86.136 1.00 116.01 ? 79 GLN E C 1 ATOM 8739 O O . GLN F 3 79 ? 47.830 41.024 86.021 1.00 113.39 ? 79 GLN E O 1 ATOM 8740 C CB . GLN F 3 79 ? 46.641 42.535 88.540 1.00 120.66 ? 79 GLN E CB 1 ATOM 8741 C CG . GLN F 3 79 ? 45.560 42.857 89.560 1.00 126.72 ? 79 GLN E CG 1 ATOM 8742 C CD . GLN F 3 79 ? 46.117 43.489 90.821 1.00 129.92 ? 79 GLN E CD 1 ATOM 8743 O OE1 . GLN F 3 79 ? 47.330 43.648 90.966 1.00 130.83 ? 79 GLN E OE1 1 ATOM 8744 N NE2 . GLN F 3 79 ? 45.232 43.857 91.738 1.00 132.75 ? 79 GLN E NE2 1 ATOM 8745 N N . PRO F 3 80 ? 47.548 43.175 85.405 1.00 119.66 ? 80 PRO E N 1 ATOM 8746 C CA . PRO F 3 80 ? 48.584 43.152 84.363 1.00 122.15 ? 80 PRO E CA 1 ATOM 8747 C C . PRO F 3 80 ? 49.913 42.536 84.805 1.00 123.45 ? 80 PRO E C 1 ATOM 8748 O O . PRO F 3 80 ? 50.767 42.255 83.967 1.00 121.42 ? 80 PRO E O 1 ATOM 8749 C CB . PRO F 3 80 ? 48.763 44.632 84.029 1.00 124.91 ? 80 PRO E CB 1 ATOM 8750 C CG . PRO F 3 80 ? 47.423 45.213 84.288 1.00 124.96 ? 80 PRO E CG 1 ATOM 8751 C CD . PRO F 3 80 ? 46.889 44.490 85.487 1.00 122.41 ? 80 PRO E CD 1 ATOM 8752 N N . GLU F 3 81 ? 50.070 42.324 86.106 1.00 128.53 ? 81 GLU E N 1 ATOM 8753 C CA . GLU F 3 81 ? 51.252 41.682 86.661 1.00 126.98 ? 81 GLU E CA 1 ATOM 8754 C C . GLU F 3 81 ? 51.141 40.164 86.518 1.00 119.21 ? 81 GLU E C 1 ATOM 8755 O O . GLU F 3 81 ? 52.059 39.426 86.876 1.00 117.37 ? 81 GLU E O 1 ATOM 8756 C CB . GLU F 3 81 ? 51.417 42.079 88.131 1.00 135.05 ? 81 GLU E CB 1 ATOM 8757 C CG . GLU F 3 81 ? 52.781 41.812 88.739 1.00 137.92 ? 81 GLU E CG 1 ATOM 8758 C CD . GLU F 3 81 ? 52.829 42.174 90.211 1.00 143.64 ? 81 GLU E CD 1 ATOM 8759 O OE1 . GLU F 3 81 ? 53.940 42.379 90.743 1.00 147.76 ? 81 GLU E OE1 1 ATOM 8760 O OE2 . GLU F 3 81 ? 51.749 42.254 90.836 1.00 144.23 ? 81 GLU E OE2 1 ATOM 8761 N N . ASP F 3 82 ? 50.014 39.705 85.980 1.00 114.18 ? 82 ASP E N 1 ATOM 8762 C CA . ASP F 3 82 ? 49.730 38.276 85.895 1.00 105.17 ? 82 ASP E CA 1 ATOM 8763 C C . ASP F 3 82 ? 49.769 37.732 84.467 1.00 97.39 ? 82 ASP E C 1 ATOM 8764 O O . ASP F 3 82 ? 49.727 36.520 84.263 1.00 91.03 ? 82 ASP E O 1 ATOM 8765 C CB . ASP F 3 82 ? 48.362 37.975 86.514 1.00 106.45 ? 82 ASP E CB 1 ATOM 8766 C CG . ASP F 3 82 ? 48.222 38.532 87.917 1.00 109.75 ? 82 ASP E CG 1 ATOM 8767 O OD1 . ASP F 3 82 ? 49.250 38.649 88.616 1.00 111.06 ? 82 ASP E OD1 1 ATOM 8768 O OD2 . ASP F 3 82 ? 47.083 38.852 88.320 1.00 112.24 ? 82 ASP E OD2 1 ATOM 8769 N N . PHE F 3 83 ? 49.842 38.620 83.481 1.00 96.39 ? 83 PHE E N 1 ATOM 8770 C CA . PHE F 3 83 ? 49.871 38.186 82.087 1.00 94.23 ? 83 PHE E CA 1 ATOM 8771 C C . PHE F 3 83 ? 51.214 37.561 81.726 1.00 90.60 ? 83 PHE E C 1 ATOM 8772 O O . PHE F 3 83 ? 52.185 38.265 81.447 1.00 94.73 ? 83 PHE E O 1 ATOM 8773 C CB . PHE F 3 83 ? 49.566 39.354 81.146 1.00 95.23 ? 83 PHE E CB 1 ATOM 8774 C CG . PHE F 3 83 ? 48.129 39.784 81.164 1.00 100.94 ? 83 PHE E CG 1 ATOM 8775 C CD1 . PHE F 3 83 ? 47.153 39.011 80.559 1.00 100.04 ? 83 PHE E CD1 1 ATOM 8776 C CD2 . PHE F 3 83 ? 47.753 40.962 81.783 1.00 104.05 ? 83 PHE E CD2 1 ATOM 8777 C CE1 . PHE F 3 83 ? 45.829 39.405 80.574 1.00 102.75 ? 83 PHE E CE1 1 ATOM 8778 C CE2 . PHE F 3 83 ? 46.431 41.361 81.801 1.00 110.32 ? 83 PHE E CE2 1 ATOM 8779 C CZ . PHE F 3 83 ? 45.467 40.581 81.196 1.00 107.45 ? 83 PHE E CZ 1 ATOM 8780 N N . ALA F 3 84 ? 51.257 36.232 81.730 1.00 83.96 ? 84 ALA E N 1 ATOM 8781 C CA . ALA F 3 84 ? 52.476 35.494 81.422 1.00 82.25 ? 84 ALA E CA 1 ATOM 8782 C C . ALA F 3 84 ? 52.163 34.061 81.005 1.00 76.97 ? 84 ALA E C 1 ATOM 8783 O O . ALA F 3 84 ? 51.012 33.716 80.743 1.00 76.68 ? 84 ALA E O 1 ATOM 8784 C CB . ALA F 3 84 ? 53.414 35.502 82.618 1.00 83.00 ? 84 ALA E CB 1 ATOM 8785 N N . THR F 3 85 ? 53.196 33.228 80.943 1.00 73.60 ? 85 THR E N 1 ATOM 8786 C CA . THR F 3 85 ? 53.024 31.824 80.600 1.00 72.23 ? 85 THR E CA 1 ATOM 8787 C C . THR F 3 85 ? 52.984 30.985 81.872 1.00 71.18 ? 85 THR E C 1 ATOM 8788 O O . THR F 3 85 ? 53.784 31.190 82.783 1.00 69.06 ? 85 THR E O 1 ATOM 8789 C CB . THR F 3 85 ? 54.149 31.325 79.672 1.00 72.30 ? 85 THR E CB 1 ATOM 8790 O OG1 . THR F 3 85 ? 54.131 32.077 78.452 1.00 72.88 ? 85 THR E OG1 1 ATOM 8791 C CG2 . THR F 3 85 ? 53.970 29.851 79.348 1.00 72.09 ? 85 THR E CG2 1 ATOM 8792 N N . TYR F 3 86 ? 52.043 30.050 81.937 1.00 74.66 ? 86 TYR E N 1 ATOM 8793 C CA . TYR F 3 86 ? 51.862 29.239 83.135 1.00 78.12 ? 86 TYR E CA 1 ATOM 8794 C C . TYR F 3 86 ? 52.063 27.750 82.861 1.00 77.19 ? 86 TYR E C 1 ATOM 8795 O O . TYR F 3 86 ? 51.604 27.226 81.846 1.00 76.38 ? 86 TYR E O 1 ATOM 8796 C CB . TYR F 3 86 ? 50.474 29.490 83.732 1.00 79.51 ? 86 TYR E CB 1 ATOM 8797 C CG . TYR F 3 86 ? 50.294 30.901 84.251 1.00 82.84 ? 86 TYR E CG 1 ATOM 8798 C CD1 . TYR F 3 86 ? 49.884 31.927 83.409 1.00 85.66 ? 86 TYR E CD1 1 ATOM 8799 C CD2 . TYR F 3 86 ? 50.544 31.207 85.582 1.00 81.95 ? 86 TYR E CD2 1 ATOM 8800 C CE1 . TYR F 3 86 ? 49.725 33.218 83.881 1.00 87.91 ? 86 TYR E CE1 1 ATOM 8801 C CE2 . TYR F 3 86 ? 50.386 32.494 86.062 1.00 84.39 ? 86 TYR E CE2 1 ATOM 8802 C CZ . TYR F 3 86 ? 49.977 33.495 85.208 1.00 87.14 ? 86 TYR E CZ 1 ATOM 8803 O OH . TYR F 3 86 ? 49.821 34.777 85.686 1.00 90.56 ? 86 TYR E OH 1 ATOM 8804 N N . TYR F 3 87 ? 52.763 27.079 83.771 1.00 74.17 ? 87 TYR E N 1 ATOM 8805 C CA . TYR F 3 87 ? 53.011 25.647 83.654 1.00 69.34 ? 87 TYR E CA 1 ATOM 8806 C C . TYR F 3 87 ? 52.470 24.886 84.861 1.00 69.95 ? 87 TYR E C 1 ATOM 8807 O O . TYR F 3 87 ? 52.310 25.450 85.942 1.00 69.49 ? 87 TYR E O 1 ATOM 8808 C CB . TYR F 3 87 ? 54.509 25.367 83.506 1.00 61.27 ? 87 TYR E CB 1 ATOM 8809 C CG . TYR F 3 87 ? 55.138 25.938 82.258 1.00 60.77 ? 87 TYR E CG 1 ATOM 8810 C CD1 . TYR F 3 87 ? 55.106 25.241 81.058 1.00 60.88 ? 87 TYR E CD1 1 ATOM 8811 C CD2 . TYR F 3 87 ? 55.775 27.171 82.282 1.00 66.62 ? 87 TYR E CD2 1 ATOM 8812 C CE1 . TYR F 3 87 ? 55.684 25.760 79.914 1.00 66.12 ? 87 TYR E CE1 1 ATOM 8813 C CE2 . TYR F 3 87 ? 56.355 27.698 81.144 1.00 70.45 ? 87 TYR E CE2 1 ATOM 8814 C CZ . TYR F 3 87 ? 56.308 26.989 79.963 1.00 70.88 ? 87 TYR E CZ 1 ATOM 8815 O OH . TYR F 3 87 ? 56.887 27.515 78.830 1.00 74.83 ? 87 TYR E OH 1 ATOM 8816 N N . CYS F 3 88 ? 52.193 23.602 84.666 1.00 73.45 ? 88 CYS E N 1 ATOM 8817 C CA . CYS F 3 88 ? 51.814 22.722 85.764 1.00 76.48 ? 88 CYS E CA 1 ATOM 8818 C C . CYS F 3 88 ? 52.817 21.578 85.872 1.00 77.72 ? 88 CYS E C 1 ATOM 8819 O O . CYS F 3 88 ? 53.229 21.011 84.862 1.00 79.72 ? 88 CYS E O 1 ATOM 8820 C CB . CYS F 3 88 ? 50.398 22.180 85.568 1.00 80.40 ? 88 CYS E CB 1 ATOM 8821 S SG . CYS F 3 88 ? 50.164 21.212 84.061 1.00 92.64 ? 88 CYS E SG 1 ATOM 8822 N N . GLN F 3 89 ? 53.214 21.245 87.096 1.00 77.78 ? 89 GLN E N 1 ATOM 8823 C CA . GLN F 3 89 ? 54.225 20.215 87.311 1.00 75.17 ? 89 GLN E CA 1 ATOM 8824 C C . GLN F 3 89 ? 53.702 19.046 88.141 1.00 76.32 ? 89 GLN E C 1 ATOM 8825 O O . GLN F 3 89 ? 52.959 19.237 89.102 1.00 78.84 ? 89 GLN E O 1 ATOM 8826 C CB . GLN F 3 89 ? 55.459 20.816 87.993 1.00 75.04 ? 89 GLN E CB 1 ATOM 8827 C CG . GLN F 3 89 ? 56.578 19.814 88.242 1.00 74.37 ? 89 GLN E CG 1 ATOM 8828 C CD . GLN F 3 89 ? 57.693 20.372 89.103 1.00 78.02 ? 89 GLN E CD 1 ATOM 8829 O OE1 . GLN F 3 89 ? 57.866 21.584 89.208 1.00 80.88 ? 89 GLN E OE1 1 ATOM 8830 N NE2 . GLN F 3 89 ? 58.456 19.484 89.730 1.00 80.67 ? 89 GLN E NE2 1 ATOM 8831 N N . GLN F 3 90 ? 54.096 17.835 87.757 1.00 77.12 ? 90 GLN E N 1 ATOM 8832 C CA . GLN F 3 90 ? 53.820 16.643 88.549 1.00 80.07 ? 90 GLN E CA 1 ATOM 8833 C C . GLN F 3 90 ? 54.892 16.488 89.623 1.00 80.04 ? 90 GLN E C 1 ATOM 8834 O O . GLN F 3 90 ? 56.080 16.657 89.349 1.00 78.24 ? 90 GLN E O 1 ATOM 8835 C CB . GLN F 3 90 ? 53.760 15.402 87.655 1.00 80.22 ? 90 GLN E CB 1 ATOM 8836 C CG . GLN F 3 90 ? 53.561 14.093 88.397 1.00 84.46 ? 90 GLN E CG 1 ATOM 8837 C CD . GLN F 3 90 ? 54.866 13.373 88.671 1.00 82.93 ? 90 GLN E CD 1 ATOM 8838 O OE1 . GLN F 3 90 ? 54.971 12.595 89.618 1.00 86.36 ? 90 GLN E OE1 1 ATOM 8839 N NE2 . GLN F 3 90 ? 55.868 13.624 87.836 1.00 78.57 ? 90 GLN E NE2 1 ATOM 8840 N N . LEU F 3 91 ? 54.472 16.166 90.843 1.00 97.67 ? 91 LEU E N 1 ATOM 8841 C CA . LEU F 3 91 ? 55.388 16.129 91.980 1.00 97.20 ? 91 LEU E CA 1 ATOM 8842 C C . LEU F 3 91 ? 55.461 14.754 92.640 1.00 101.66 ? 91 LEU E C 1 ATOM 8843 O O . LEU F 3 91 ? 56.264 14.538 93.549 1.00 102.44 ? 91 LEU E O 1 ATOM 8844 C CB . LEU F 3 91 ? 54.972 17.169 93.022 1.00 95.94 ? 91 LEU E CB 1 ATOM 8845 C CG . LEU F 3 91 ? 54.601 18.561 92.508 1.00 94.96 ? 91 LEU E CG 1 ATOM 8846 C CD1 . LEU F 3 91 ? 54.129 19.441 93.655 1.00 98.22 ? 91 LEU E CD1 1 ATOM 8847 C CD2 . LEU F 3 91 ? 55.775 19.200 91.787 1.00 92.55 ? 91 LEU E CD2 1 ATOM 8848 N N . ASN F 3 92 ? 54.625 13.828 92.182 1.00 106.48 ? 92 ASN E N 1 ATOM 8849 C CA . ASN F 3 92 ? 54.493 12.527 92.832 1.00 111.65 ? 92 ASN E CA 1 ATOM 8850 C C . ASN F 3 92 ? 55.679 11.593 92.587 1.00 110.51 ? 92 ASN E C 1 ATOM 8851 O O . ASN F 3 92 ? 56.482 11.351 93.489 1.00 110.89 ? 92 ASN E O 1 ATOM 8852 C CB . ASN F 3 92 ? 53.199 11.846 92.378 1.00 118.76 ? 92 ASN E CB 1 ATOM 8853 C CG . ASN F 3 92 ? 52.873 10.609 93.194 1.00 126.42 ? 92 ASN E CG 1 ATOM 8854 O OD1 . ASN F 3 92 ? 53.394 10.419 94.293 1.00 130.06 ? 92 ASN E OD1 1 ATOM 8855 N ND2 . ASN F 3 92 ? 52.002 9.761 92.659 1.00 128.85 ? 92 ASN E ND2 1 ATOM 8856 N N . SER F 3 93 ? 55.784 11.068 91.369 1.00 108.55 ? 93 SER E N 1 ATOM 8857 C CA . SER F 3 93 ? 56.798 10.062 91.060 1.00 107.83 ? 93 SER E CA 1 ATOM 8858 C C . SER F 3 93 ? 57.784 10.514 89.984 1.00 104.53 ? 93 SER E C 1 ATOM 8859 O O . SER F 3 93 ? 57.627 11.577 89.385 1.00 105.19 ? 93 SER E O 1 ATOM 8860 C CB . SER F 3 93 ? 56.125 8.757 90.625 1.00 110.99 ? 93 SER E CB 1 ATOM 8861 O OG . SER F 3 93 ? 55.269 8.258 91.639 1.00 113.10 ? 93 SER E OG 1 ATOM 8862 N N . TYR F 3 94 ? 58.804 9.692 89.749 1.00 102.56 ? 94 TYR E N 1 ATOM 8863 C CA . TYR F 3 94 ? 59.803 9.960 88.719 1.00 97.73 ? 94 TYR E CA 1 ATOM 8864 C C . TYR F 3 94 ? 59.330 9.476 87.349 1.00 96.75 ? 94 TYR E C 1 ATOM 8865 O O . TYR F 3 94 ? 58.651 8.454 87.250 1.00 101.14 ? 94 TYR E O 1 ATOM 8866 C CB . TYR F 3 94 ? 61.137 9.293 89.077 1.00 98.82 ? 94 TYR E CB 1 ATOM 8867 C CG . TYR F 3 94 ? 62.011 10.107 90.005 1.00 99.14 ? 94 TYR E CG 1 ATOM 8868 C CD1 . TYR F 3 94 ? 61.979 11.496 89.983 1.00 96.09 ? 94 TYR E CD1 1 ATOM 8869 C CD2 . TYR F 3 94 ? 62.872 9.487 90.902 1.00 103.38 ? 94 TYR E CD2 1 ATOM 8870 C CE1 . TYR F 3 94 ? 62.779 12.244 90.829 1.00 96.11 ? 94 TYR E CE1 1 ATOM 8871 C CE2 . TYR F 3 94 ? 63.675 10.226 91.754 1.00 101.95 ? 94 TYR E CE2 1 ATOM 8872 C CZ . TYR F 3 94 ? 63.624 11.603 91.713 1.00 98.79 ? 94 TYR E CZ 1 ATOM 8873 O OH . TYR F 3 94 ? 64.422 12.342 92.559 1.00 98.02 ? 94 TYR E OH 1 ATOM 8874 N N . PRO F 3 95 ? 59.685 10.215 86.284 1.00 90.30 ? 95 PRO E N 1 ATOM 8875 C CA . PRO F 3 95 ? 60.439 11.469 86.348 1.00 86.10 ? 95 PRO E CA 1 ATOM 8876 C C . PRO F 3 95 ? 59.525 12.680 86.482 1.00 83.72 ? 95 PRO E C 1 ATOM 8877 O O . PRO F 3 95 ? 58.363 12.622 86.078 1.00 86.10 ? 95 PRO E O 1 ATOM 8878 C CB . PRO F 3 95 ? 61.192 11.499 85.009 1.00 84.81 ? 95 PRO E CB 1 ATOM 8879 C CG . PRO F 3 95 ? 60.654 10.324 84.192 1.00 85.89 ? 95 PRO E CG 1 ATOM 8880 C CD . PRO F 3 95 ? 59.433 9.818 84.892 1.00 88.90 ? 95 PRO E CD 1 ATOM 8881 N N . LEU F 3 96 ? 60.045 13.762 87.052 1.00 79.36 ? 96 LEU E N 1 ATOM 8882 C CA . LEU F 3 96 ? 59.283 14.996 87.168 1.00 78.10 ? 96 LEU E CA 1 ATOM 8883 C C . LEU F 3 96 ? 58.986 15.562 85.785 1.00 79.82 ? 96 LEU E C 1 ATOM 8884 O O . LEU F 3 96 ? 59.896 15.786 84.986 1.00 82.85 ? 96 LEU E O 1 ATOM 8885 C CB . LEU F 3 96 ? 60.039 16.019 88.015 1.00 77.50 ? 96 LEU E CB 1 ATOM 8886 C CG . LEU F 3 96 ? 60.316 15.619 89.465 1.00 77.78 ? 96 LEU E CG 1 ATOM 8887 C CD1 . LEU F 3 96 ? 61.042 16.736 90.199 1.00 73.78 ? 96 LEU E CD1 1 ATOM 8888 C CD2 . LEU F 3 96 ? 59.022 15.258 90.179 1.00 81.41 ? 96 LEU E CD2 1 ATOM 8889 N N . THR F 3 97 ? 57.707 15.783 85.502 1.00 78.02 ? 97 THR E N 1 ATOM 8890 C CA . THR F 3 97 ? 57.293 16.285 84.198 1.00 78.87 ? 97 THR E CA 1 ATOM 8891 C C . THR F 3 97 ? 56.412 17.524 84.325 1.00 78.85 ? 97 THR E C 1 ATOM 8892 O O . THR F 3 97 ? 55.755 17.733 85.346 1.00 78.26 ? 97 THR E O 1 ATOM 8893 C CB . THR F 3 97 ? 56.537 15.210 83.400 1.00 79.97 ? 97 THR E CB 1 ATOM 8894 O OG1 . THR F 3 97 ? 55.481 14.675 84.206 1.00 83.08 ? 97 THR E OG1 1 ATOM 8895 C CG2 . THR F 3 97 ? 57.479 14.084 83.003 1.00 78.79 ? 97 THR E CG2 1 ATOM 8896 N N . PHE F 3 98 ? 56.407 18.343 83.278 1.00 77.09 ? 98 PHE E N 1 ATOM 8897 C CA . PHE F 3 98 ? 55.621 19.570 83.262 1.00 71.23 ? 98 PHE E CA 1 ATOM 8898 C C . PHE F 3 98 ? 54.509 19.502 82.223 1.00 69.00 ? 98 PHE E C 1 ATOM 8899 O O . PHE F 3 98 ? 54.437 18.560 81.436 1.00 71.83 ? 98 PHE E O 1 ATOM 8900 C CB . PHE F 3 98 ? 56.515 20.781 82.982 1.00 69.14 ? 98 PHE E CB 1 ATOM 8901 C CG . PHE F 3 98 ? 57.500 21.080 84.076 1.00 68.99 ? 98 PHE E CG 1 ATOM 8902 C CD1 . PHE F 3 98 ? 57.218 22.035 85.037 1.00 69.82 ? 98 PHE E CD1 1 ATOM 8903 C CD2 . PHE F 3 98 ? 58.712 20.412 84.139 1.00 67.86 ? 98 PHE E CD2 1 ATOM 8904 C CE1 . PHE F 3 98 ? 58.123 22.317 86.043 1.00 67.85 ? 98 PHE E CE1 1 ATOM 8905 C CE2 . PHE F 3 98 ? 59.620 20.687 85.143 1.00 66.38 ? 98 PHE E CE2 1 ATOM 8906 C CZ . PHE F 3 98 ? 59.325 21.642 86.097 1.00 65.91 ? 98 PHE E CZ 1 ATOM 8907 N N . GLY F 3 99 ? 53.644 20.509 82.226 1.00 70.11 ? 99 GLY E N 1 ATOM 8908 C CA . GLY F 3 99 ? 52.606 20.624 81.220 1.00 73.12 ? 99 GLY E CA 1 ATOM 8909 C C . GLY F 3 99 ? 53.123 21.369 80.006 1.00 78.38 ? 99 GLY E C 1 ATOM 8910 O O . GLY F 3 99 ? 54.238 21.891 80.022 1.00 78.77 ? 99 GLY E O 1 ATOM 8911 N N . GLY F 3 100 ? 52.317 21.419 78.950 1.00 82.18 ? 100 GLY E N 1 ATOM 8912 C CA . GLY F 3 100 ? 52.706 22.103 77.731 1.00 69.76 ? 100 GLY E CA 1 ATOM 8913 C C . GLY F 3 100 ? 52.942 23.584 77.953 1.00 76.76 ? 100 GLY E C 1 ATOM 8914 O O . GLY F 3 100 ? 53.888 24.161 77.418 1.00 75.59 ? 100 GLY E O 1 ATOM 8915 N N . GLY F 3 101 ? 52.079 24.197 78.756 1.00 79.31 ? 101 GLY E N 1 ATOM 8916 C CA . GLY F 3 101 ? 52.174 25.615 79.048 1.00 79.03 ? 101 GLY E CA 1 ATOM 8917 C C . GLY F 3 101 ? 50.942 26.374 78.595 1.00 79.74 ? 101 GLY E C 1 ATOM 8918 O O . GLY F 3 101 ? 50.323 26.026 77.591 1.00 79.30 ? 101 GLY E O 1 ATOM 8919 N N . THR F 3 102 ? 50.583 27.413 79.342 1.00 80.96 ? 102 THR E N 1 ATOM 8920 C CA . THR F 3 102 ? 49.438 28.245 78.991 1.00 83.00 ? 102 THR E CA 1 ATOM 8921 C C . THR F 3 102 ? 49.798 29.726 79.006 1.00 83.64 ? 102 THR E C 1 ATOM 8922 O O . THR F 3 102 ? 50.204 30.267 80.033 1.00 84.59 ? 102 THR E O 1 ATOM 8923 C CB . THR F 3 102 ? 48.251 28.011 79.943 1.00 83.60 ? 102 THR E CB 1 ATOM 8924 O OG1 . THR F 3 102 ? 47.744 26.683 79.763 1.00 81.26 ? 102 THR E OG1 1 ATOM 8925 C CG2 . THR F 3 102 ? 47.143 29.009 79.656 1.00 88.85 ? 102 THR E CG2 1 ATOM 8926 N N . LYS F 3 103 ? 49.641 30.375 77.858 1.00 77.38 ? 103 LYS E N 1 ATOM 8927 C CA . LYS F 3 103 ? 49.940 31.795 77.727 1.00 77.82 ? 103 LYS E CA 1 ATOM 8928 C C . LYS F 3 103 ? 48.677 32.641 77.840 1.00 78.61 ? 103 LYS E C 1 ATOM 8929 O O . LYS F 3 103 ? 47.660 32.336 77.219 1.00 80.28 ? 103 LYS E O 1 ATOM 8930 C CB . LYS F 3 103 ? 50.633 32.072 76.391 1.00 81.25 ? 103 LYS E CB 1 ATOM 8931 C CG . LYS F 3 103 ? 51.917 31.286 76.180 1.00 86.62 ? 103 LYS E CG 1 ATOM 8932 C CD . LYS F 3 103 ? 52.419 31.422 74.749 1.00 89.24 ? 103 LYS E CD 1 ATOM 8933 C CE . LYS F 3 103 ? 52.658 32.876 74.374 1.00 88.92 ? 103 LYS E CE 1 ATOM 8934 N NZ . LYS F 3 103 ? 53.171 33.004 72.981 1.00 90.48 ? 103 LYS E NZ 1 ATOM 8935 N N . VAL F 3 104 ? 48.745 33.701 78.640 1.00 78.60 ? 104 VAL E N 1 ATOM 8936 C CA . VAL F 3 104 ? 47.654 34.665 78.719 1.00 83.50 ? 104 VAL E CA 1 ATOM 8937 C C . VAL F 3 104 ? 48.150 36.050 78.308 1.00 87.03 ? 104 VAL E C 1 ATOM 8938 O O . VAL F 3 104 ? 49.208 36.500 78.747 1.00 89.05 ? 104 VAL E O 1 ATOM 8939 C CB . VAL F 3 104 ? 47.032 34.721 80.134 1.00 85.77 ? 104 VAL E CB 1 ATOM 8940 C CG1 . VAL F 3 104 ? 46.277 33.435 80.429 1.00 87.46 ? 104 VAL E CG1 1 ATOM 8941 C CG2 . VAL F 3 104 ? 48.096 34.970 81.189 1.00 80.76 ? 104 VAL E CG2 1 ATOM 8942 N N . GLU F 3 105 ? 47.388 36.719 77.448 1.00 90.38 ? 105 GLU E N 1 ATOM 8943 C CA . GLU F 3 105 ? 47.810 38.007 76.907 1.00 95.09 ? 105 GLU E CA 1 ATOM 8944 C C . GLU F 3 105 ? 46.822 39.121 77.230 1.00 100.69 ? 105 GLU E C 1 ATOM 8945 O O . GLU F 3 105 ? 45.648 38.867 77.498 1.00 99.39 ? 105 GLU E O 1 ATOM 8946 C CB . GLU F 3 105 ? 47.994 37.914 75.392 1.00 96.44 ? 105 GLU E CB 1 ATOM 8947 C CG . GLU F 3 105 ? 46.717 37.572 74.644 1.00 101.01 ? 105 GLU E CG 1 ATOM 8948 C CD . GLU F 3 105 ? 46.747 38.028 73.200 1.00 105.34 ? 105 GLU E CD 1 ATOM 8949 O OE1 . GLU F 3 105 ? 45.907 37.552 72.407 1.00 107.05 ? 105 GLU E OE1 1 ATOM 8950 O OE2 . GLU F 3 105 ? 47.605 38.870 72.858 1.00 106.68 ? 105 GLU E OE2 1 ATOM 8951 N N . ILE F 3 106 ? 47.311 40.357 77.201 1.00 104.85 ? 106 ILE E N 1 ATOM 8952 C CA . ILE F 3 106 ? 46.466 41.525 77.408 1.00 107.69 ? 106 ILE E CA 1 ATOM 8953 C C . ILE F 3 106 ? 45.511 41.678 76.229 1.00 106.06 ? 106 ILE E C 1 ATOM 8954 O O . ILE F 3 106 ? 45.903 41.499 75.076 1.00 104.01 ? 106 ILE E O 1 ATOM 8955 C CB . ILE F 3 106 ? 47.303 42.808 77.576 1.00 111.73 ? 106 ILE E CB 1 ATOM 8956 C CG1 . ILE F 3 106 ? 48.436 42.580 78.580 1.00 107.54 ? 106 ILE E CG1 1 ATOM 8957 C CG2 . ILE F 3 106 ? 46.422 43.974 78.007 1.00 120.01 ? 106 ILE E CG2 1 ATOM 8958 C CD1 . ILE F 3 106 ? 49.341 43.779 78.766 1.00 106.94 ? 106 ILE E CD1 1 ATOM 8959 N N . LYS F 3 107 ? 44.257 42.003 76.522 1.00 106.05 ? 107 LYS E N 1 ATOM 8960 C CA . LYS F 3 107 ? 43.226 42.064 75.493 1.00 103.97 ? 107 LYS E CA 1 ATOM 8961 C C . LYS F 3 107 ? 42.790 43.498 75.203 1.00 106.59 ? 107 LYS E C 1 ATOM 8962 O O . LYS F 3 107 ? 42.108 44.127 76.012 1.00 110.78 ? 107 LYS E O 1 ATOM 8963 C CB . LYS F 3 107 ? 42.022 41.220 75.916 1.00 102.76 ? 107 LYS E CB 1 ATOM 8964 C CG . LYS F 3 107 ? 40.996 40.972 74.824 1.00 100.38 ? 107 LYS E CG 1 ATOM 8965 C CD . LYS F 3 107 ? 39.883 40.076 75.343 1.00 99.19 ? 107 LYS E CD 1 ATOM 8966 C CE . LYS F 3 107 ? 38.877 39.738 74.258 1.00 100.03 ? 107 LYS E CE 1 ATOM 8967 N NZ . LYS F 3 107 ? 37.776 38.883 74.779 1.00 100.19 ? 107 LYS E NZ 1 ATOM 8968 N N . ARG F 3 108 ? 43.193 44.007 74.043 1.00 106.85 ? 108 ARG E N 1 ATOM 8969 C CA . ARG F 3 108 ? 42.795 45.341 73.603 1.00 103.46 ? 108 ARG E CA 1 ATOM 8970 C C . ARG F 3 108 ? 41.873 45.251 72.392 1.00 105.09 ? 108 ARG E C 1 ATOM 8971 O O . ARG F 3 108 ? 41.472 44.159 71.988 1.00 103.45 ? 108 ARG E O 1 ATOM 8972 C CB . ARG F 3 108 ? 44.023 46.192 73.266 1.00 104.72 ? 108 ARG E CB 1 ATOM 8973 C CG . ARG F 3 108 ? 44.852 45.655 72.106 1.00 102.83 ? 108 ARG E CG 1 ATOM 8974 C CD . ARG F 3 108 ? 45.935 46.635 71.675 1.00 101.59 ? 108 ARG E CD 1 ATOM 8975 N NE . ARG F 3 108 ? 45.386 47.844 71.064 1.00 105.50 ? 108 ARG E NE 1 ATOM 8976 C CZ . ARG F 3 108 ? 45.238 49.004 71.698 1.00 111.68 ? 108 ARG E CZ 1 ATOM 8977 N NH1 . ARG F 3 108 ? 45.600 49.117 72.968 1.00 112.21 ? 108 ARG E NH1 1 ATOM 8978 N NH2 . ARG F 3 108 ? 44.729 50.050 71.062 1.00 111.98 ? 108 ARG E NH2 1 ATOM 8979 N N . THR F 3 109 ? 41.539 46.401 71.816 1.00 108.69 ? 109 THR E N 1 ATOM 8980 C CA . THR F 3 109 ? 40.730 46.436 70.604 1.00 112.29 ? 109 THR E CA 1 ATOM 8981 C C . THR F 3 109 ? 41.596 46.149 69.383 1.00 112.21 ? 109 THR E C 1 ATOM 8982 O O . THR F 3 109 ? 42.821 46.253 69.445 1.00 110.46 ? 109 THR E O 1 ATOM 8983 C CB . THR F 3 109 ? 40.030 47.796 70.424 1.00 121.00 ? 109 THR E CB 1 ATOM 8984 O OG1 . THR F 3 109 ? 41.013 48.835 70.343 1.00 125.81 ? 109 THR E OG1 1 ATOM 8985 C CG2 . THR F 3 109 ? 39.096 48.076 71.593 1.00 122.18 ? 109 THR E CG2 1 ATOM 8986 N N . VAL F 3 110 ? 40.955 45.789 68.275 1.00 115.38 ? 110 VAL E N 1 ATOM 8987 C CA . VAL F 3 110 ? 41.665 45.442 67.047 1.00 115.31 ? 110 VAL E CA 1 ATOM 8988 C C . VAL F 3 110 ? 42.451 46.627 66.493 1.00 119.69 ? 110 VAL E C 1 ATOM 8989 O O . VAL F 3 110 ? 41.910 47.721 66.333 1.00 113.87 ? 110 VAL E O 1 ATOM 8990 C CB . VAL F 3 110 ? 40.692 44.930 65.966 1.00 113.46 ? 110 VAL E CB 1 ATOM 8991 C CG1 . VAL F 3 110 ? 41.441 44.594 64.685 1.00 108.47 ? 110 VAL E CG1 1 ATOM 8992 C CG2 . VAL F 3 110 ? 39.928 43.717 66.476 1.00 112.13 ? 110 VAL E CG2 1 ATOM 8993 N N . ALA F 3 111 ? 43.731 46.403 66.207 1.00 119.28 ? 111 ALA E N 1 ATOM 8994 C CA . ALA F 3 111 ? 44.594 47.449 65.666 1.00 121.98 ? 111 ALA E CA 1 ATOM 8995 C C . ALA F 3 111 ? 45.257 47.006 64.363 1.00 120.82 ? 111 ALA E C 1 ATOM 8996 O O . ALA F 3 111 ? 45.785 45.897 64.270 1.00 116.45 ? 111 ALA E O 1 ATOM 8997 C CB . ALA F 3 111 ? 45.648 47.846 66.687 1.00 121.81 ? 111 ALA E CB 1 ATOM 8998 N N . ALA F 3 112 ? 45.228 47.880 63.362 1.00 123.16 ? 112 ALA E N 1 ATOM 8999 C CA . ALA F 3 112 ? 45.813 47.578 62.061 1.00 120.36 ? 112 ALA E CA 1 ATOM 9000 C C . ALA F 3 112 ? 47.316 47.851 62.051 1.00 118.22 ? 112 ALA E C 1 ATOM 9001 O O . ALA F 3 112 ? 47.771 48.860 62.589 1.00 118.57 ? 112 ALA E O 1 ATOM 9002 C CB . ALA F 3 112 ? 45.120 48.383 60.971 1.00 122.66 ? 112 ALA E CB 1 ATOM 9003 N N . PRO F 3 113 ? 48.092 46.944 61.435 1.00 115.25 ? 113 PRO E N 1 ATOM 9004 C CA . PRO F 3 113 ? 49.551 47.072 61.350 1.00 111.84 ? 113 PRO E CA 1 ATOM 9005 C C . PRO F 3 113 ? 50.012 48.082 60.306 1.00 115.30 ? 113 PRO E C 1 ATOM 9006 O O . PRO F 3 113 ? 49.529 48.071 59.175 1.00 116.72 ? 113 PRO E O 1 ATOM 9007 C CB . PRO F 3 113 ? 49.998 45.661 60.961 1.00 108.92 ? 113 PRO E CB 1 ATOM 9008 C CG . PRO F 3 113 ? 48.850 45.113 60.194 1.00 110.47 ? 113 PRO E CG 1 ATOM 9009 C CD . PRO F 3 113 ? 47.614 45.681 60.843 1.00 113.49 ? 113 PRO E CD 1 ATOM 9010 N N . SER F 3 114 ? 50.941 48.950 60.692 1.00 91.02 ? 114 SER E N 1 ATOM 9011 C CA . SER F 3 114 ? 51.583 49.853 59.746 1.00 93.27 ? 114 SER E CA 1 ATOM 9012 C C . SER F 3 114 ? 52.666 49.097 58.987 1.00 87.51 ? 114 SER E C 1 ATOM 9013 O O . SER F 3 114 ? 53.654 48.664 59.577 1.00 82.23 ? 114 SER E O 1 ATOM 9014 C CB . SER F 3 114 ? 52.178 51.065 60.468 1.00 96.21 ? 114 SER E CB 1 ATOM 9015 O OG . SER F 3 114 ? 51.182 51.762 61.197 1.00 104.21 ? 114 SER E OG 1 ATOM 9016 N N . VAL F 3 115 ? 52.474 48.930 57.682 1.00 89.73 ? 115 VAL E N 1 ATOM 9017 C CA . VAL F 3 115 ? 53.390 48.124 56.882 1.00 86.59 ? 115 VAL E CA 1 ATOM 9018 C C . VAL F 3 115 ? 54.476 48.964 56.218 1.00 86.64 ? 115 VAL E C 1 ATOM 9019 O O . VAL F 3 115 ? 54.199 49.762 55.322 1.00 90.75 ? 115 VAL E O 1 ATOM 9020 C CB . VAL F 3 115 ? 52.641 47.335 55.795 1.00 88.73 ? 115 VAL E CB 1 ATOM 9021 C CG1 . VAL F 3 115 ? 53.590 46.375 55.095 1.00 86.74 ? 115 VAL E CG1 1 ATOM 9022 C CG2 . VAL F 3 115 ? 51.473 46.578 56.403 1.00 91.70 ? 115 VAL E CG2 1 ATOM 9023 N N . PHE F 3 116 ? 55.714 48.774 56.665 1.00 84.65 ? 116 PHE E N 1 ATOM 9024 C CA . PHE F 3 116 ? 56.860 49.470 56.092 1.00 86.84 ? 116 PHE E CA 1 ATOM 9025 C C . PHE F 3 116 ? 57.753 48.506 55.319 1.00 87.07 ? 116 PHE E C 1 ATOM 9026 O O . PHE F 3 116 ? 57.954 47.365 55.731 1.00 86.71 ? 116 PHE E O 1 ATOM 9027 C CB . PHE F 3 116 ? 57.674 50.165 57.186 1.00 88.54 ? 116 PHE E CB 1 ATOM 9028 C CG . PHE F 3 116 ? 56.903 51.198 57.955 1.00 93.69 ? 116 PHE E CG 1 ATOM 9029 C CD1 . PHE F 3 116 ? 56.729 52.474 57.445 1.00 99.07 ? 116 PHE E CD1 1 ATOM 9030 C CD2 . PHE F 3 116 ? 56.360 50.896 59.194 1.00 93.06 ? 116 PHE E CD2 1 ATOM 9031 C CE1 . PHE F 3 116 ? 56.021 53.429 58.152 1.00 104.63 ? 116 PHE E CE1 1 ATOM 9032 C CE2 . PHE F 3 116 ? 55.652 51.845 59.906 1.00 98.44 ? 116 PHE E CE2 1 ATOM 9033 C CZ . PHE F 3 116 ? 55.482 53.113 59.384 1.00 104.93 ? 116 PHE E CZ 1 ATOM 9034 N N . ILE F 3 117 ? 58.288 48.974 54.197 1.00 87.42 ? 117 ILE E N 1 ATOM 9035 C CA . ILE F 3 117 ? 59.196 48.169 53.389 1.00 83.87 ? 117 ILE E CA 1 ATOM 9036 C C . ILE F 3 117 ? 60.588 48.803 53.381 1.00 83.62 ? 117 ILE E C 1 ATOM 9037 O O . ILE F 3 117 ? 60.722 50.026 53.321 1.00 85.70 ? 117 ILE E O 1 ATOM 9038 C CB . ILE F 3 117 ? 58.666 48.004 51.942 1.00 83.77 ? 117 ILE E CB 1 ATOM 9039 C CG1 . ILE F 3 117 ? 59.589 47.101 51.123 1.00 81.14 ? 117 ILE E CG1 1 ATOM 9040 C CG2 . ILE F 3 117 ? 58.486 49.357 51.267 1.00 86.89 ? 117 ILE E CG2 1 ATOM 9041 C CD1 . ILE F 3 117 ? 59.714 45.701 51.672 1.00 78.88 ? 117 ILE E CD1 1 ATOM 9042 N N . PHE F 3 118 ? 61.622 47.970 53.466 1.00 82.99 ? 118 PHE E N 1 ATOM 9043 C CA . PHE F 3 118 ? 62.998 48.459 53.493 1.00 80.86 ? 118 PHE E CA 1 ATOM 9044 C C . PHE F 3 118 ? 63.883 47.752 52.471 1.00 81.67 ? 118 PHE E C 1 ATOM 9045 O O . PHE F 3 118 ? 64.226 46.583 52.645 1.00 81.47 ? 118 PHE E O 1 ATOM 9046 C CB . PHE F 3 118 ? 63.599 48.295 54.890 1.00 76.11 ? 118 PHE E CB 1 ATOM 9047 C CG . PHE F 3 118 ? 63.007 49.214 55.918 1.00 75.06 ? 118 PHE E CG 1 ATOM 9048 C CD1 . PHE F 3 118 ? 63.476 50.510 56.058 1.00 75.19 ? 118 PHE E CD1 1 ATOM 9049 C CD2 . PHE F 3 118 ? 61.987 48.782 56.748 1.00 73.95 ? 118 PHE E CD2 1 ATOM 9050 C CE1 . PHE F 3 118 ? 62.935 51.359 57.005 1.00 77.97 ? 118 PHE E CE1 1 ATOM 9051 C CE2 . PHE F 3 118 ? 61.442 49.626 57.697 1.00 75.78 ? 118 PHE E CE2 1 ATOM 9052 C CZ . PHE F 3 118 ? 61.916 50.916 57.825 1.00 77.57 ? 118 PHE E CZ 1 ATOM 9053 N N . PRO F 3 119 ? 64.256 48.467 51.399 1.00 83.50 ? 119 PRO E N 1 ATOM 9054 C CA . PRO F 3 119 ? 65.168 47.944 50.375 1.00 84.65 ? 119 PRO E CA 1 ATOM 9055 C C . PRO F 3 119 ? 66.551 47.642 50.948 1.00 83.89 ? 119 PRO E C 1 ATOM 9056 O O . PRO F 3 119 ? 66.929 48.234 51.960 1.00 82.43 ? 119 PRO E O 1 ATOM 9057 C CB . PRO F 3 119 ? 65.236 49.082 49.348 1.00 85.36 ? 119 PRO E CB 1 ATOM 9058 C CG . PRO F 3 119 ? 64.006 49.894 49.588 1.00 86.17 ? 119 PRO E CG 1 ATOM 9059 C CD . PRO F 3 119 ? 63.764 49.812 51.061 1.00 84.07 ? 119 PRO E CD 1 ATOM 9060 N N . PRO F 3 120 ? 67.295 46.722 50.314 1.00 84.20 ? 120 PRO E N 1 ATOM 9061 C CA . PRO F 3 120 ? 68.655 46.385 50.753 1.00 83.49 ? 120 PRO E CA 1 ATOM 9062 C C . PRO F 3 120 ? 69.598 47.586 50.700 1.00 80.83 ? 120 PRO E C 1 ATOM 9063 O O . PRO F 3 120 ? 69.604 48.322 49.714 1.00 79.02 ? 120 PRO E O 1 ATOM 9064 C CB . PRO F 3 120 ? 69.092 45.308 49.753 1.00 84.77 ? 120 PRO E CB 1 ATOM 9065 C CG . PRO F 3 120 ? 67.819 44.735 49.228 1.00 84.57 ? 120 PRO E CG 1 ATOM 9066 C CD . PRO F 3 120 ? 66.854 45.879 49.190 1.00 84.75 ? 120 PRO E CD 1 ATOM 9067 N N . SER F 3 121 ? 70.382 47.777 51.757 1.00 80.67 ? 121 SER E N 1 ATOM 9068 C CA . SER F 3 121 ? 71.339 48.875 51.810 1.00 85.64 ? 121 SER E CA 1 ATOM 9069 C C . SER F 3 121 ? 72.469 48.659 50.809 1.00 88.35 ? 121 SER E C 1 ATOM 9070 O O . SER F 3 121 ? 72.751 47.528 50.415 1.00 89.18 ? 121 SER E O 1 ATOM 9071 C CB . SER F 3 121 ? 71.908 49.024 53.222 1.00 90.54 ? 121 SER E CB 1 ATOM 9072 O OG . SER F 3 121 ? 72.598 47.853 53.620 1.00 93.05 ? 121 SER E OG 1 ATOM 9073 N N . ASP F 3 122 ? 73.116 49.746 50.404 1.00 91.45 ? 122 ASP E N 1 ATOM 9074 C CA . ASP F 3 122 ? 74.196 49.667 49.427 1.00 95.93 ? 122 ASP E CA 1 ATOM 9075 C C . ASP F 3 122 ? 75.443 49.014 50.020 1.00 95.44 ? 122 ASP E C 1 ATOM 9076 O O . ASP F 3 122 ? 76.312 48.539 49.288 1.00 93.73 ? 122 ASP E O 1 ATOM 9077 C CB . ASP F 3 122 ? 74.533 51.060 48.889 1.00 100.64 ? 122 ASP E CB 1 ATOM 9078 C CG . ASP F 3 122 ? 73.378 51.685 48.129 1.00 101.05 ? 122 ASP E CG 1 ATOM 9079 O OD1 . ASP F 3 122 ? 72.534 52.347 48.767 1.00 103.96 ? 122 ASP E OD1 1 ATOM 9080 O OD2 . ASP F 3 122 ? 73.313 51.513 46.893 1.00 97.80 ? 122 ASP E OD2 1 ATOM 9081 N N . GLU F 3 123 ? 75.523 48.990 51.347 1.00 97.35 ? 123 GLU E N 1 ATOM 9082 C CA . GLU F 3 123 ? 76.635 48.343 52.034 1.00 97.75 ? 123 GLU E CA 1 ATOM 9083 C C . GLU F 3 123 ? 76.569 46.829 51.871 1.00 96.38 ? 123 GLU E C 1 ATOM 9084 O O . GLU F 3 123 ? 77.579 46.179 51.600 1.00 98.03 ? 123 GLU E O 1 ATOM 9085 C CB . GLU F 3 123 ? 76.642 48.707 53.521 1.00 95.13 ? 123 GLU E CB 1 ATOM 9086 C CG . GLU F 3 123 ? 76.844 50.185 53.807 1.00 96.86 ? 123 GLU E CG 1 ATOM 9087 C CD . GLU F 3 123 ? 77.026 50.472 55.286 1.00 99.44 ? 123 GLU E CD 1 ATOM 9088 O OE1 . GLU F 3 123 ? 76.957 51.657 55.675 1.00 102.94 ? 123 GLU E OE1 1 ATOM 9089 O OE2 . GLU F 3 123 ? 77.241 49.514 56.058 1.00 98.76 ? 123 GLU E OE2 1 ATOM 9090 N N . GLN F 3 124 ? 75.372 46.275 52.037 1.00 93.34 ? 124 GLN E N 1 ATOM 9091 C CA . GLN F 3 124 ? 75.177 44.833 51.945 1.00 92.95 ? 124 GLN E CA 1 ATOM 9092 C C . GLN F 3 124 ? 75.321 44.340 50.509 1.00 95.66 ? 124 GLN E C 1 ATOM 9093 O O . GLN F 3 124 ? 75.787 43.226 50.270 1.00 100.29 ? 124 GLN E O 1 ATOM 9094 C CB . GLN F 3 124 ? 73.805 44.442 52.499 1.00 89.18 ? 124 GLN E CB 1 ATOM 9095 C CG . GLN F 3 124 ? 73.581 42.942 52.592 1.00 89.50 ? 124 GLN E CG 1 ATOM 9096 C CD . GLN F 3 124 ? 72.191 42.589 53.077 1.00 89.93 ? 124 GLN E CD 1 ATOM 9097 O OE1 . GLN F 3 124 ? 71.344 43.463 53.259 1.00 89.21 ? 124 GLN E OE1 1 ATOM 9098 N NE2 . GLN F 3 124 ? 71.950 41.301 53.289 1.00 92.41 ? 124 GLN E NE2 1 ATOM 9099 N N . LEU F 3 125 ? 74.920 45.174 49.556 1.00 91.90 ? 125 LEU E N 1 ATOM 9100 C CA . LEU F 3 125 ? 74.995 44.812 48.146 1.00 89.69 ? 125 LEU E CA 1 ATOM 9101 C C . LEU F 3 125 ? 76.442 44.632 47.695 1.00 90.69 ? 125 LEU E C 1 ATOM 9102 O O . LEU F 3 125 ? 76.721 43.862 46.776 1.00 93.62 ? 125 LEU E O 1 ATOM 9103 C CB . LEU F 3 125 ? 74.299 45.866 47.284 1.00 87.76 ? 125 LEU E CB 1 ATOM 9104 C CG . LEU F 3 125 ? 72.799 46.045 47.530 1.00 83.44 ? 125 LEU E CG 1 ATOM 9105 C CD1 . LEU F 3 125 ? 72.214 47.082 46.582 1.00 82.07 ? 125 LEU E CD1 1 ATOM 9106 C CD2 . LEU F 3 125 ? 72.070 44.717 47.397 1.00 83.30 ? 125 LEU E CD2 1 ATOM 9107 N N . LYS F 3 126 ? 77.360 45.338 48.346 1.00 90.22 ? 126 LYS E N 1 ATOM 9108 C CA . LYS F 3 126 ? 78.781 45.194 48.047 1.00 96.14 ? 126 LYS E CA 1 ATOM 9109 C C . LYS F 3 126 ? 79.379 43.992 48.770 1.00 99.36 ? 126 LYS E C 1 ATOM 9110 O O . LYS F 3 126 ? 80.532 43.628 48.536 1.00 102.81 ? 126 LYS E O 1 ATOM 9111 C CB . LYS F 3 126 ? 79.547 46.464 48.423 1.00 97.50 ? 126 LYS E CB 1 ATOM 9112 C CG . LYS F 3 126 ? 79.352 47.621 47.458 1.00 98.62 ? 126 LYS E CG 1 ATOM 9113 C CD . LYS F 3 126 ? 80.302 48.763 47.776 1.00 99.57 ? 126 LYS E CD 1 ATOM 9114 C CE . LYS F 3 126 ? 80.207 49.869 46.740 1.00 99.01 ? 126 LYS E CE 1 ATOM 9115 N NZ . LYS F 3 126 ? 81.174 50.965 47.019 1.00 100.88 ? 126 LYS E NZ 1 ATOM 9116 N N . SER F 3 127 ? 78.590 43.380 49.648 1.00 97.44 ? 127 SER E N 1 ATOM 9117 C CA . SER F 3 127 ? 79.051 42.232 50.422 1.00 96.92 ? 127 SER E CA 1 ATOM 9118 C C . SER F 3 127 ? 78.701 40.916 49.737 1.00 96.02 ? 127 SER E C 1 ATOM 9119 O O . SER F 3 127 ? 79.257 39.870 50.071 1.00 98.80 ? 127 SER E O 1 ATOM 9120 C CB . SER F 3 127 ? 78.455 42.263 51.830 1.00 98.45 ? 127 SER E CB 1 ATOM 9121 O OG . SER F 3 127 ? 78.848 43.434 52.522 1.00 102.41 ? 127 SER E OG 1 ATOM 9122 N N . GLY F 3 128 ? 77.775 40.969 48.786 1.00 88.58 ? 128 GLY E N 1 ATOM 9123 C CA . GLY F 3 128 ? 77.407 39.792 48.020 1.00 87.24 ? 128 GLY E CA 1 ATOM 9124 C C . GLY F 3 128 ? 76.017 39.263 48.314 1.00 83.65 ? 128 GLY E C 1 ATOM 9125 O O . GLY F 3 128 ? 75.530 38.371 47.621 1.00 87.95 ? 128 GLY E O 1 ATOM 9126 N N . THR F 3 129 ? 75.375 39.808 49.342 1.00 79.63 ? 129 THR E N 1 ATOM 9127 C CA . THR F 3 129 ? 74.029 39.377 49.708 1.00 79.88 ? 129 THR E CA 1 ATOM 9128 C C . THR F 3 129 ? 73.037 40.535 49.672 1.00 79.23 ? 129 THR E C 1 ATOM 9129 O O . THR F 3 129 ? 73.421 41.691 49.506 1.00 77.52 ? 129 THR E O 1 ATOM 9130 C CB . THR F 3 129 ? 73.999 38.738 51.111 1.00 75.09 ? 129 THR E CB 1 ATOM 9131 O OG1 . THR F 3 129 ? 74.490 39.675 52.078 1.00 72.67 ? 129 THR E OG1 1 ATOM 9132 C CG2 . THR F 3 129 ? 74.854 37.481 51.143 1.00 76.36 ? 129 THR E CG2 1 ATOM 9133 N N . ALA F 3 130 ? 71.757 40.212 49.825 1.00 81.95 ? 130 ALA E N 1 ATOM 9134 C CA . ALA F 3 130 ? 70.705 41.221 49.818 1.00 80.12 ? 130 ALA E CA 1 ATOM 9135 C C . ALA F 3 130 ? 69.572 40.844 50.766 1.00 79.34 ? 130 ALA E C 1 ATOM 9136 O O . ALA F 3 130 ? 68.959 39.786 50.626 1.00 83.29 ? 130 ALA E O 1 ATOM 9137 C CB . ALA F 3 130 ? 70.171 41.419 48.408 1.00 81.45 ? 130 ALA E CB 1 ATOM 9138 N N . SER F 3 131 ? 69.298 41.717 51.731 1.00 73.27 ? 131 SER E N 1 ATOM 9139 C CA . SER F 3 131 ? 68.210 41.492 52.674 1.00 68.87 ? 131 SER E CA 1 ATOM 9140 C C . SER F 3 131 ? 67.120 42.547 52.533 1.00 68.39 ? 131 SER E C 1 ATOM 9141 O O . SER F 3 131 ? 67.372 43.742 52.694 1.00 67.83 ? 131 SER E O 1 ATOM 9142 C CB . SER F 3 131 ? 68.736 41.472 54.111 1.00 66.57 ? 131 SER E CB 1 ATOM 9143 O OG . SER F 3 131 ? 69.572 40.350 54.334 1.00 70.69 ? 131 SER E OG 1 ATOM 9144 N N . VAL F 3 132 ? 65.909 42.095 52.225 1.00 71.05 ? 132 VAL E N 1 ATOM 9145 C CA . VAL F 3 132 ? 64.751 42.976 52.168 1.00 68.75 ? 132 VAL E CA 1 ATOM 9146 C C . VAL F 3 132 ? 63.934 42.817 53.446 1.00 66.75 ? 132 VAL E C 1 ATOM 9147 O O . VAL F 3 132 ? 63.538 41.708 53.804 1.00 63.56 ? 132 VAL E O 1 ATOM 9148 C CB . VAL F 3 132 ? 63.864 42.681 50.943 1.00 71.15 ? 132 VAL E CB 1 ATOM 9149 C CG1 . VAL F 3 132 ? 62.799 43.757 50.788 1.00 68.89 ? 132 VAL E CG1 1 ATOM 9150 C CG2 . VAL F 3 132 ? 64.714 42.592 49.687 1.00 74.68 ? 132 VAL E CG2 1 ATOM 9151 N N . VAL F 3 133 ? 63.692 43.929 54.133 1.00 69.26 ? 133 VAL E N 1 ATOM 9152 C CA . VAL F 3 133 ? 62.984 43.906 55.410 1.00 70.42 ? 133 VAL E CA 1 ATOM 9153 C C . VAL F 3 133 ? 61.595 44.535 55.322 1.00 71.30 ? 133 VAL E C 1 ATOM 9154 O O . VAL F 3 133 ? 61.443 45.680 54.901 1.00 65.39 ? 133 VAL E O 1 ATOM 9155 C CB . VAL F 3 133 ? 63.781 44.635 56.505 1.00 65.80 ? 133 VAL E CB 1 ATOM 9156 C CG1 . VAL F 3 133 ? 62.996 44.653 57.807 1.00 60.23 ? 133 VAL E CG1 1 ATOM 9157 C CG2 . VAL F 3 133 ? 65.141 43.980 56.702 1.00 67.61 ? 133 VAL E CG2 1 ATOM 9158 N N . CYS F 3 134 ? 60.587 43.771 55.732 1.00 72.88 ? 134 CYS E N 1 ATOM 9159 C CA . CYS F 3 134 ? 59.220 44.265 55.815 1.00 75.01 ? 134 CYS E CA 1 ATOM 9160 C C . CYS F 3 134 ? 58.829 44.456 57.275 1.00 74.05 ? 134 CYS E C 1 ATOM 9161 O O . CYS F 3 134 ? 59.064 43.576 58.099 1.00 73.89 ? 134 CYS E O 1 ATOM 9162 C CB . CYS F 3 134 ? 58.256 43.299 55.122 1.00 81.07 ? 134 CYS E CB 1 ATOM 9163 S SG . CYS F 3 134 ? 56.590 43.950 54.905 1.00 139.88 ? 134 CYS E SG 1 ATOM 9164 N N . LEU F 3 135 ? 58.232 45.600 57.595 1.00 72.59 ? 135 LEU E N 1 ATOM 9165 C CA . LEU F 3 135 ? 57.920 45.918 58.985 1.00 70.79 ? 135 LEU E CA 1 ATOM 9166 C C . LEU F 3 135 ? 56.421 45.986 59.254 1.00 73.34 ? 135 LEU E C 1 ATOM 9167 O O . LEU F 3 135 ? 55.685 46.649 58.529 1.00 74.51 ? 135 LEU E O 1 ATOM 9168 C CB . LEU F 3 135 ? 58.567 47.244 59.385 1.00 71.20 ? 135 LEU E CB 1 ATOM 9169 C CG . LEU F 3 135 ? 58.295 47.710 60.817 1.00 74.96 ? 135 LEU E CG 1 ATOM 9170 C CD1 . LEU F 3 135 ? 58.822 46.692 61.814 1.00 76.45 ? 135 LEU E CD1 1 ATOM 9171 C CD2 . LEU F 3 135 ? 58.919 49.074 61.058 1.00 76.20 ? 135 LEU E CD2 1 ATOM 9172 N N . LEU F 3 136 ? 55.977 45.294 60.300 1.00 72.81 ? 136 LEU E N 1 ATOM 9173 C CA . LEU F 3 136 ? 54.594 45.384 60.767 1.00 78.93 ? 136 LEU E CA 1 ATOM 9174 C C . LEU F 3 136 ? 54.603 45.961 62.173 1.00 82.19 ? 136 LEU E C 1 ATOM 9175 O O . LEU F 3 136 ? 55.135 45.343 63.093 1.00 85.66 ? 136 LEU E O 1 ATOM 9176 C CB . LEU F 3 136 ? 53.900 44.017 60.759 1.00 79.97 ? 136 LEU E CB 1 ATOM 9177 C CG . LEU F 3 136 ? 53.511 43.346 59.436 1.00 79.23 ? 136 LEU E CG 1 ATOM 9178 C CD1 . LEU F 3 136 ? 54.719 43.050 58.555 1.00 75.39 ? 136 LEU E CD1 1 ATOM 9179 C CD2 . LEU F 3 136 ? 52.745 42.066 59.709 1.00 76.70 ? 136 LEU E CD2 1 ATOM 9180 N N . ASN F 3 137 ? 54.008 47.136 62.346 1.00 81.76 ? 137 ASN E N 1 ATOM 9181 C CA . ASN F 3 137 ? 54.195 47.878 63.586 1.00 85.16 ? 137 ASN E CA 1 ATOM 9182 C C . ASN F 3 137 ? 52.930 48.079 64.416 1.00 89.46 ? 137 ASN E C 1 ATOM 9183 O O . ASN F 3 137 ? 51.887 48.464 63.890 1.00 95.89 ? 137 ASN E O 1 ATOM 9184 C CB . ASN F 3 137 ? 54.809 49.243 63.276 1.00 89.52 ? 137 ASN E CB 1 ATOM 9185 C CG . ASN F 3 137 ? 55.541 49.830 64.461 1.00 95.08 ? 137 ASN E CG 1 ATOM 9186 O OD1 . ASN F 3 137 ? 56.346 49.154 65.104 1.00 96.08 ? 137 ASN E OD1 1 ATOM 9187 N ND2 . ASN F 3 137 ? 55.261 51.091 64.763 1.00 98.77 ? 137 ASN E ND2 1 ATOM 9188 N N . ASN F 3 138 ? 53.052 47.822 65.718 1.00 88.93 ? 138 ASN E N 1 ATOM 9189 C CA . ASN F 3 138 ? 52.003 48.090 66.704 1.00 94.95 ? 138 ASN E CA 1 ATOM 9190 C C . ASN F 3 138 ? 50.609 47.635 66.290 1.00 97.59 ? 138 ASN E C 1 ATOM 9191 O O . ASN F 3 138 ? 49.730 48.459 66.022 1.00 100.21 ? 138 ASN E O 1 ATOM 9192 C CB . ASN F 3 138 ? 51.955 49.584 67.026 1.00 98.69 ? 138 ASN E CB 1 ATOM 9193 C CG . ASN F 3 138 ? 53.207 50.077 67.732 1.00 95.45 ? 138 ASN E CG 1 ATOM 9194 O OD1 . ASN F 3 138 ? 53.943 49.297 68.335 1.00 90.60 ? 138 ASN E OD1 1 ATOM 9195 N ND2 . ASN F 3 138 ? 53.443 51.384 67.671 1.00 98.31 ? 138 ASN E ND2 1 ATOM 9196 N N . PHE F 3 139 ? 50.400 46.325 66.251 1.00 95.59 ? 139 PHE E N 1 ATOM 9197 C CA . PHE F 3 139 ? 49.116 45.793 65.815 1.00 98.45 ? 139 PHE E CA 1 ATOM 9198 C C . PHE F 3 139 ? 48.554 44.754 66.779 1.00 101.36 ? 139 PHE E C 1 ATOM 9199 O O . PHE F 3 139 ? 49.246 44.304 67.703 1.00 103.58 ? 139 PHE E O 1 ATOM 9200 C CB . PHE F 3 139 ? 49.242 45.187 64.416 1.00 96.45 ? 139 PHE E CB 1 ATOM 9201 C CG . PHE F 3 139 ? 50.159 43.997 64.346 1.00 93.92 ? 139 PHE E CG 1 ATOM 9202 C CD1 . PHE F 3 139 ? 51.526 44.164 64.199 1.00 89.38 ? 139 PHE E CD1 1 ATOM 9203 C CD2 . PHE F 3 139 ? 49.652 42.711 64.421 1.00 94.97 ? 139 PHE E CD2 1 ATOM 9204 C CE1 . PHE F 3 139 ? 52.369 43.076 64.136 1.00 84.66 ? 139 PHE E CE1 1 ATOM 9205 C CE2 . PHE F 3 139 ? 50.487 41.616 64.358 1.00 90.25 ? 139 PHE E CE2 1 ATOM 9206 C CZ . PHE F 3 139 ? 51.848 41.798 64.215 1.00 85.71 ? 139 PHE E CZ 1 ATOM 9207 N N . TYR F 3 140 ? 47.298 44.380 66.548 1.00 102.43 ? 140 TYR E N 1 ATOM 9208 C CA . TYR F 3 140 ? 46.615 43.376 67.352 1.00 104.87 ? 140 TYR E CA 1 ATOM 9209 C C . TYR F 3 140 ? 45.432 42.822 66.554 1.00 114.91 ? 140 TYR E C 1 ATOM 9210 O O . TYR F 3 140 ? 44.761 43.563 65.826 1.00 120.43 ? 140 TYR E O 1 ATOM 9211 C CB . TYR F 3 140 ? 46.138 43.961 68.679 1.00 102.77 ? 140 TYR E CB 1 ATOM 9212 C CG . TYR F 3 140 ? 45.502 42.955 69.607 1.00 101.79 ? 140 TYR E CG 1 ATOM 9213 C CD1 . TYR F 3 140 ? 46.271 42.232 70.512 1.00 96.33 ? 140 TYR E CD1 1 ATOM 9214 C CD2 . TYR F 3 140 ? 44.139 42.709 69.555 1.00 107.70 ? 140 TYR E CD2 1 ATOM 9215 C CE1 . TYR F 3 140 ? 45.700 41.312 71.349 1.00 99.41 ? 140 TYR E CE1 1 ATOM 9216 C CE2 . TYR F 3 140 ? 43.549 41.795 70.399 1.00 110.73 ? 140 TYR E CE2 1 ATOM 9217 C CZ . TYR F 3 140 ? 44.338 41.101 71.292 1.00 104.47 ? 140 TYR E CZ 1 ATOM 9218 O OH . TYR F 3 140 ? 43.762 40.184 72.126 1.00 106.74 ? 140 TYR E OH 1 ATOM 9219 N N . PRO F 3 141 ? 45.173 41.506 66.671 1.00 116.35 ? 141 PRO E N 1 ATOM 9220 C CA . PRO F 3 141 ? 45.900 40.516 67.479 1.00 114.34 ? 141 PRO E CA 1 ATOM 9221 C C . PRO F 3 141 ? 47.259 40.075 66.928 1.00 113.34 ? 141 PRO E C 1 ATOM 9222 O O . PRO F 3 141 ? 47.739 40.591 65.916 1.00 112.87 ? 141 PRO E O 1 ATOM 9223 C CB . PRO F 3 141 ? 44.934 39.322 67.497 1.00 117.68 ? 141 PRO E CB 1 ATOM 9224 C CG . PRO F 3 141 ? 44.308 39.408 66.153 1.00 120.09 ? 141 PRO E CG 1 ATOM 9225 C CD . PRO F 3 141 ? 44.100 40.863 65.890 1.00 120.84 ? 141 PRO E CD 1 ATOM 9226 N N . ARG F 3 142 ? 47.859 39.116 67.630 1.00 112.42 ? 142 ARG E N 1 ATOM 9227 C CA . ARG F 3 142 ? 49.154 38.535 67.284 1.00 108.21 ? 142 ARG E CA 1 ATOM 9228 C C . ARG F 3 142 ? 49.151 37.914 65.889 1.00 108.10 ? 142 ARG E C 1 ATOM 9229 O O . ARG F 3 142 ? 50.124 38.029 65.140 1.00 105.07 ? 142 ARG E O 1 ATOM 9230 C CB . ARG F 3 142 ? 49.538 37.482 68.335 1.00 110.95 ? 142 ARG E CB 1 ATOM 9231 C CG . ARG F 3 142 ? 50.656 36.519 67.946 1.00 111.26 ? 142 ARG E CG 1 ATOM 9232 C CD . ARG F 3 142 ? 52.015 37.195 67.985 1.00 109.70 ? 142 ARG E CD 1 ATOM 9233 N NE . ARG F 3 142 ? 53.055 36.317 68.517 1.00 111.20 ? 142 ARG E NE 1 ATOM 9234 C CZ . ARG F 3 142 ? 53.690 35.393 67.804 1.00 110.22 ? 142 ARG E CZ 1 ATOM 9235 N NH1 . ARG F 3 142 ? 53.388 35.218 66.524 1.00 110.28 ? 142 ARG E NH1 1 ATOM 9236 N NH2 . ARG F 3 142 ? 54.628 34.643 68.368 1.00 108.09 ? 142 ARG E NH2 1 ATOM 9237 N N . GLU F 3 143 ? 48.047 37.259 65.547 1.00 110.77 ? 143 GLU E N 1 ATOM 9238 C CA . GLU F 3 143 ? 47.921 36.560 64.272 1.00 107.53 ? 143 GLU E CA 1 ATOM 9239 C C . GLU F 3 143 ? 47.996 37.521 63.087 1.00 106.35 ? 143 GLU E C 1 ATOM 9240 O O . GLU F 3 143 ? 47.209 38.462 62.984 1.00 110.18 ? 143 GLU E O 1 ATOM 9241 C CB . GLU F 3 143 ? 46.607 35.769 64.230 1.00 108.84 ? 143 GLU E CB 1 ATOM 9242 C CG . GLU F 3 143 ? 46.570 34.530 65.130 1.00 108.14 ? 143 GLU E CG 1 ATOM 9243 C CD . GLU F 3 143 ? 46.473 34.859 66.614 1.00 105.27 ? 143 GLU E CD 1 ATOM 9244 O OE1 . GLU F 3 143 ? 46.138 36.013 66.953 1.00 105.11 ? 143 GLU E OE1 1 ATOM 9245 O OE2 . GLU F 3 143 ? 46.733 33.961 67.442 1.00 103.79 ? 143 GLU E OE2 1 ATOM 9246 N N . ALA F 3 144 ? 48.953 37.277 62.197 1.00 102.28 ? 144 ALA E N 1 ATOM 9247 C CA . ALA F 3 144 ? 49.121 38.096 61.004 1.00 104.77 ? 144 ALA E CA 1 ATOM 9248 C C . ALA F 3 144 ? 49.934 37.352 59.948 1.00 107.59 ? 144 ALA E C 1 ATOM 9249 O O . ALA F 3 144 ? 51.030 36.867 60.225 1.00 106.08 ? 144 ALA E O 1 ATOM 9250 C CB . ALA F 3 144 ? 49.789 39.420 61.351 1.00 101.17 ? 144 ALA E CB 1 ATOM 9251 N N . LYS F 3 145 ? 49.390 37.264 58.739 1.00 111.29 ? 145 LYS E N 1 ATOM 9252 C CA . LYS F 3 145 ? 50.056 36.556 57.652 1.00 109.07 ? 145 LYS E CA 1 ATOM 9253 C C . LYS F 3 145 ? 50.940 37.500 56.843 1.00 106.13 ? 145 LYS E C 1 ATOM 9254 O O . LYS F 3 145 ? 50.604 38.670 56.653 1.00 106.23 ? 145 LYS E O 1 ATOM 9255 C CB . LYS F 3 145 ? 49.027 35.883 56.740 1.00 116.28 ? 145 LYS E CB 1 ATOM 9256 C CG . LYS F 3 145 ? 49.628 34.939 55.708 1.00 119.29 ? 145 LYS E CG 1 ATOM 9257 C CD . LYS F 3 145 ? 48.584 34.463 54.708 1.00 126.72 ? 145 LYS E CD 1 ATOM 9258 C CE . LYS F 3 145 ? 48.102 35.607 53.830 1.00 126.19 ? 145 LYS E CE 1 ATOM 9259 N NZ . LYS F 3 145 ? 47.092 35.163 52.829 1.00 132.06 ? 145 LYS E NZ 1 ATOM 9260 N N . VAL F 3 146 ? 52.073 36.988 56.372 1.00 103.47 ? 146 VAL E N 1 ATOM 9261 C CA . VAL F 3 146 ? 52.994 37.777 55.562 1.00 97.18 ? 146 VAL E CA 1 ATOM 9262 C C . VAL F 3 146 ? 53.780 36.889 54.596 1.00 95.51 ? 146 VAL E C 1 ATOM 9263 O O . VAL F 3 146 ? 54.434 35.930 55.008 1.00 89.88 ? 146 VAL E O 1 ATOM 9264 C CB . VAL F 3 146 ? 53.969 38.582 56.449 1.00 90.63 ? 146 VAL E CB 1 ATOM 9265 C CG1 . VAL F 3 146 ? 54.425 37.751 57.639 1.00 89.17 ? 146 VAL E CG1 1 ATOM 9266 C CG2 . VAL F 3 146 ? 55.156 39.081 55.634 1.00 86.31 ? 146 VAL E CG2 1 ATOM 9267 N N . GLN F 3 147 ? 53.700 37.215 53.308 1.00 101.71 ? 147 GLN E N 1 ATOM 9268 C CA . GLN F 3 147 ? 54.354 36.432 52.262 1.00 104.67 ? 147 GLN E CA 1 ATOM 9269 C C . GLN F 3 147 ? 55.207 37.317 51.353 1.00 103.28 ? 147 GLN E C 1 ATOM 9270 O O . GLN F 3 147 ? 54.874 38.479 51.118 1.00 103.29 ? 147 GLN E O 1 ATOM 9271 C CB . GLN F 3 147 ? 53.313 35.681 51.428 1.00 114.58 ? 147 GLN E CB 1 ATOM 9272 C CG . GLN F 3 147 ? 52.416 34.749 52.229 1.00 118.42 ? 147 GLN E CG 1 ATOM 9273 C CD . GLN F 3 147 ? 51.324 34.119 51.384 1.00 125.18 ? 147 GLN E CD 1 ATOM 9274 O OE1 . GLN F 3 147 ? 51.211 34.393 50.190 1.00 128.67 ? 147 GLN E OE1 1 ATOM 9275 N NE2 . GLN F 3 147 ? 50.512 33.270 52.004 1.00 128.37 ? 147 GLN E NE2 1 ATOM 9276 N N . TRP F 3 148 ? 56.301 36.760 50.840 1.00 101.26 ? 148 TRP E N 1 ATOM 9277 C CA . TRP F 3 148 ? 57.204 37.502 49.963 1.00 95.49 ? 148 TRP E CA 1 ATOM 9278 C C . TRP F 3 148 ? 57.025 37.121 48.496 1.00 99.78 ? 148 TRP E C 1 ATOM 9279 O O . TRP F 3 148 ? 57.039 35.941 48.145 1.00 103.81 ? 148 TRP E O 1 ATOM 9280 C CB . TRP F 3 148 ? 58.663 37.275 50.370 1.00 88.28 ? 148 TRP E CB 1 ATOM 9281 C CG . TRP F 3 148 ? 59.069 37.956 51.643 1.00 80.87 ? 148 TRP E CG 1 ATOM 9282 C CD1 . TRP F 3 148 ? 59.129 37.400 52.888 1.00 78.33 ? 148 TRP E CD1 1 ATOM 9283 C CD2 . TRP F 3 148 ? 59.484 39.320 51.792 1.00 79.65 ? 148 TRP E CD2 1 ATOM 9284 N NE1 . TRP F 3 148 ? 59.553 38.333 53.804 1.00 73.52 ? 148 TRP E NE1 1 ATOM 9285 C CE2 . TRP F 3 148 ? 59.777 39.520 53.157 1.00 74.21 ? 148 TRP E CE2 1 ATOM 9286 C CE3 . TRP F 3 148 ? 59.633 40.391 50.906 1.00 81.19 ? 148 TRP E CE3 1 ATOM 9287 C CZ2 . TRP F 3 148 ? 60.211 40.747 53.655 1.00 71.03 ? 148 TRP E CZ2 1 ATOM 9288 C CZ3 . TRP F 3 148 ? 60.064 41.608 51.403 1.00 76.25 ? 148 TRP E CZ3 1 ATOM 9289 C CH2 . TRP F 3 148 ? 60.348 41.776 52.764 1.00 72.86 ? 148 TRP E CH2 1 ATOM 9290 N N . LYS F 3 149 ? 56.864 38.128 47.643 1.00 100.69 ? 149 LYS E N 1 ATOM 9291 C CA . LYS F 3 149 ? 56.771 37.910 46.204 1.00 109.66 ? 149 LYS E CA 1 ATOM 9292 C C . LYS F 3 149 ? 57.893 38.635 45.471 1.00 111.55 ? 149 LYS E C 1 ATOM 9293 O O . LYS F 3 149 ? 58.022 39.855 45.571 1.00 110.73 ? 149 LYS E O 1 ATOM 9294 C CB . LYS F 3 149 ? 55.414 38.372 45.669 1.00 114.14 ? 149 LYS E CB 1 ATOM 9295 C CG . LYS F 3 149 ? 54.237 37.519 46.111 1.00 116.94 ? 149 LYS E CG 1 ATOM 9296 C CD . LYS F 3 149 ? 52.951 38.005 45.461 1.00 122.72 ? 149 LYS E CD 1 ATOM 9297 C CE . LYS F 3 149 ? 51.760 37.152 45.863 1.00 127.27 ? 149 LYS E CE 1 ATOM 9298 N NZ . LYS F 3 149 ? 50.514 37.608 45.186 1.00 133.85 ? 149 LYS E NZ 1 ATOM 9299 N N . VAL F 3 150 ? 58.702 37.879 44.736 1.00 116.77 ? 150 VAL E N 1 ATOM 9300 C CA . VAL F 3 150 ? 59.811 38.454 43.981 1.00 119.11 ? 150 VAL E CA 1 ATOM 9301 C C . VAL F 3 150 ? 59.504 38.498 42.487 1.00 126.22 ? 150 VAL E C 1 ATOM 9302 O O . VAL F 3 150 ? 59.236 37.469 41.864 1.00 132.25 ? 150 VAL E O 1 ATOM 9303 C CB . VAL F 3 150 ? 61.116 37.665 44.205 1.00 120.45 ? 150 VAL E CB 1 ATOM 9304 C CG1 . VAL F 3 150 ? 62.193 38.131 43.238 1.00 121.19 ? 150 VAL E CG1 1 ATOM 9305 C CG2 . VAL F 3 150 ? 61.584 37.808 45.647 1.00 115.65 ? 150 VAL E CG2 1 ATOM 9306 N N . GLN F 3 155 ? 57.836 34.159 45.675 1.00 148.33 ? 155 GLN E N 1 ATOM 9307 C CA . GLN F 3 155 ? 58.894 33.157 45.621 1.00 150.29 ? 155 GLN E CA 1 ATOM 9308 C C . GLN F 3 155 ? 58.834 32.236 46.836 1.00 143.64 ? 155 GLN E C 1 ATOM 9309 O O . GLN F 3 155 ? 58.519 31.051 46.706 1.00 148.50 ? 155 GLN E O 1 ATOM 9310 C CB . GLN F 3 155 ? 60.266 33.830 45.532 1.00 149.96 ? 155 GLN E CB 1 ATOM 9311 C CG . GLN F 3 155 ? 61.421 32.868 45.297 1.00 154.41 ? 155 GLN E CG 1 ATOM 9312 C CD . GLN F 3 155 ? 62.742 33.584 45.080 1.00 152.05 ? 155 GLN E CD 1 ATOM 9313 O OE1 . GLN F 3 155 ? 62.822 34.808 45.182 1.00 147.53 ? 155 GLN E OE1 1 ATOM 9314 N NE2 . GLN F 3 155 ? 63.786 32.821 44.776 1.00 155.00 ? 155 GLN E NE2 1 ATOM 9315 N N . SER F 3 156 ? 59.147 32.795 48.005 1.00 134.94 ? 156 SER E N 1 ATOM 9316 C CA . SER F 3 156 ? 59.086 32.095 49.292 1.00 127.93 ? 156 SER E CA 1 ATOM 9317 C C . SER F 3 156 ? 60.097 30.951 49.419 1.00 132.13 ? 156 SER E C 1 ATOM 9318 O O . SER F 3 156 ? 60.501 30.342 48.429 1.00 135.34 ? 156 SER E O 1 ATOM 9319 C CB . SER F 3 156 ? 57.671 31.564 49.545 1.00 121.68 ? 156 SER E CB 1 ATOM 9320 O OG . SER F 3 156 ? 56.723 32.618 49.517 1.00 115.70 ? 156 SER E OG 1 ATOM 9321 N N . GLY F 3 157 ? 60.504 30.671 50.653 1.00 131.60 ? 157 GLY E N 1 ATOM 9322 C CA . GLY F 3 157 ? 61.459 29.611 50.923 1.00 131.90 ? 157 GLY E CA 1 ATOM 9323 C C . GLY F 3 157 ? 62.773 30.127 51.481 1.00 127.81 ? 157 GLY E C 1 ATOM 9324 O O . GLY F 3 157 ? 63.580 29.359 52.005 1.00 127.18 ? 157 GLY E O 1 ATOM 9325 N N . ASN F 3 158 ? 62.985 31.435 51.371 1.00 120.31 ? 158 ASN E N 1 ATOM 9326 C CA . ASN F 3 158 ? 64.226 32.053 51.822 1.00 110.71 ? 158 ASN E CA 1 ATOM 9327 C C . ASN F 3 158 ? 63.983 33.258 52.724 1.00 99.54 ? 158 ASN E C 1 ATOM 9328 O O . ASN F 3 158 ? 64.733 34.234 52.686 1.00 95.46 ? 158 ASN E O 1 ATOM 9329 C CB . ASN F 3 158 ? 65.074 32.468 50.618 1.00 114.04 ? 158 ASN E CB 1 ATOM 9330 C CG . ASN F 3 158 ? 64.259 33.162 49.544 1.00 116.09 ? 158 ASN E CG 1 ATOM 9331 O OD1 . ASN F 3 158 ? 63.099 33.514 49.759 1.00 113.46 ? 158 ASN E OD1 1 ATOM 9332 N ND2 . ASN F 3 158 ? 64.863 33.360 48.378 1.00 120.65 ? 158 ASN E ND2 1 ATOM 9333 N N . SER F 3 159 ? 62.932 33.185 53.534 1.00 92.42 ? 159 SER E N 1 ATOM 9334 C CA . SER F 3 159 ? 62.598 34.272 54.446 1.00 82.09 ? 159 SER E CA 1 ATOM 9335 C C . SER F 3 159 ? 62.557 33.787 55.890 1.00 81.20 ? 159 SER E C 1 ATOM 9336 O O . SER F 3 159 ? 62.482 32.587 56.152 1.00 85.39 ? 159 SER E O 1 ATOM 9337 C CB . SER F 3 159 ? 61.256 34.900 54.066 1.00 77.45 ? 159 SER E CB 1 ATOM 9338 O OG . SER F 3 159 ? 60.191 33.986 54.260 1.00 79.22 ? 159 SER E OG 1 ATOM 9339 N N . GLN F 3 160 ? 62.604 34.732 56.823 1.00 76.94 ? 160 GLN E N 1 ATOM 9340 C CA . GLN F 3 160 ? 62.565 34.420 58.246 1.00 73.56 ? 160 GLN E CA 1 ATOM 9341 C C . GLN F 3 160 ? 62.086 35.645 59.016 1.00 77.65 ? 160 GLN E C 1 ATOM 9342 O O . GLN F 3 160 ? 62.297 36.776 58.575 1.00 84.64 ? 160 GLN E O 1 ATOM 9343 C CB . GLN F 3 160 ? 63.943 33.973 58.734 1.00 71.79 ? 160 GLN E CB 1 ATOM 9344 C CG . GLN F 3 160 ? 63.907 32.866 59.769 1.00 74.41 ? 160 GLN E CG 1 ATOM 9345 C CD . GLN F 3 160 ? 65.286 32.318 60.075 1.00 74.60 ? 160 GLN E CD 1 ATOM 9346 O OE1 . GLN F 3 160 ? 66.288 32.788 59.533 1.00 71.03 ? 160 GLN E OE1 1 ATOM 9347 N NE2 . GLN F 3 160 ? 65.346 31.317 60.946 1.00 76.38 ? 160 GLN E NE2 1 ATOM 9348 N N . GLU F 3 161 ? 61.438 35.432 60.157 1.00 73.75 ? 161 GLU E N 1 ATOM 9349 C CA . GLU F 3 161 ? 60.851 36.550 60.890 1.00 70.78 ? 161 GLU E CA 1 ATOM 9350 C C . GLU F 3 161 ? 60.785 36.327 62.398 1.00 69.52 ? 161 GLU E C 1 ATOM 9351 O O . GLU F 3 161 ? 60.972 35.213 62.886 1.00 70.44 ? 161 GLU E O 1 ATOM 9352 C CB . GLU F 3 161 ? 59.444 36.841 60.356 1.00 74.17 ? 161 GLU E CB 1 ATOM 9353 C CG . GLU F 3 161 ? 58.423 35.755 60.657 1.00 76.37 ? 161 GLU E CG 1 ATOM 9354 C CD . GLU F 3 161 ? 57.129 35.953 59.893 1.00 82.75 ? 161 GLU E CD 1 ATOM 9355 O OE1 . GLU F 3 161 ? 56.065 35.531 60.394 1.00 83.53 ? 161 GLU E OE1 1 ATOM 9356 O OE2 . GLU F 3 161 ? 57.178 36.525 58.783 1.00 87.09 ? 161 GLU E OE2 1 ATOM 9357 N N . SER F 3 162 ? 60.520 37.407 63.128 1.00 67.82 ? 162 SER E N 1 ATOM 9358 C CA . SER F 3 162 ? 60.337 37.347 64.574 1.00 66.34 ? 162 SER E CA 1 ATOM 9359 C C . SER F 3 162 ? 59.346 38.416 65.031 1.00 64.47 ? 162 SER E C 1 ATOM 9360 O O . SER F 3 162 ? 59.053 39.359 64.296 1.00 59.93 ? 162 SER E O 1 ATOM 9361 C CB . SER F 3 162 ? 61.673 37.518 65.301 1.00 63.01 ? 162 SER E CB 1 ATOM 9362 O OG . SER F 3 162 ? 62.211 38.812 65.092 1.00 62.52 ? 162 SER E OG 1 ATOM 9363 N N . VAL F 3 163 ? 58.830 38.262 66.246 1.00 68.69 ? 163 VAL E N 1 ATOM 9364 C CA . VAL F 3 163 ? 57.847 39.195 66.786 1.00 69.63 ? 163 VAL E CA 1 ATOM 9365 C C . VAL F 3 163 ? 58.200 39.659 68.195 1.00 67.93 ? 163 VAL E C 1 ATOM 9366 O O . VAL F 3 163 ? 58.739 38.897 68.997 1.00 67.08 ? 163 VAL E O 1 ATOM 9367 C CB . VAL F 3 163 ? 56.443 38.571 66.816 1.00 73.55 ? 163 VAL E CB 1 ATOM 9368 C CG1 . VAL F 3 163 ? 55.904 38.405 65.407 1.00 75.71 ? 163 VAL E CG1 1 ATOM 9369 C CG2 . VAL F 3 163 ? 56.482 37.238 67.537 1.00 76.60 ? 163 VAL E CG2 1 ATOM 9370 N N . THR F 3 164 ? 57.890 40.917 68.488 1.00 71.26 ? 164 THR E N 1 ATOM 9371 C CA . THR F 3 164 ? 58.112 41.468 69.818 1.00 74.63 ? 164 THR E CA 1 ATOM 9372 C C . THR F 3 164 ? 57.072 40.933 70.791 1.00 75.93 ? 164 THR E C 1 ATOM 9373 O O . THR F 3 164 ? 55.997 40.494 70.384 1.00 76.43 ? 164 THR E O 1 ATOM 9374 C CB . THR F 3 164 ? 58.052 43.008 69.818 1.00 76.27 ? 164 THR E CB 1 ATOM 9375 O OG1 . THR F 3 164 ? 56.757 43.441 69.381 1.00 70.84 ? 164 THR E OG1 1 ATOM 9376 C CG2 . THR F 3 164 ? 59.113 43.587 68.897 1.00 77.51 ? 164 THR E CG2 1 ATOM 9377 N N . GLU F 3 165 ? 57.394 40.967 72.079 1.00 77.34 ? 165 GLU E N 1 ATOM 9378 C CA . GLU F 3 165 ? 56.420 40.610 73.096 1.00 82.47 ? 165 GLU E CA 1 ATOM 9379 C C . GLU F 3 165 ? 55.351 41.692 73.148 1.00 86.74 ? 165 GLU E C 1 ATOM 9380 O O . GLU F 3 165 ? 55.541 42.788 72.616 1.00 84.90 ? 165 GLU E O 1 ATOM 9381 C CB . GLU F 3 165 ? 57.078 40.445 74.466 1.00 89.57 ? 165 GLU E CB 1 ATOM 9382 C CG . GLU F 3 165 ? 57.371 41.758 75.178 1.00 95.93 ? 165 GLU E CG 1 ATOM 9383 C CD . GLU F 3 165 ? 57.662 41.567 76.656 1.00 102.73 ? 165 GLU E CD 1 ATOM 9384 O OE1 . GLU F 3 165 ? 57.962 40.425 77.063 1.00 104.05 ? 165 GLU E OE1 1 ATOM 9385 O OE2 . GLU F 3 165 ? 57.583 42.560 77.412 1.00 105.98 ? 165 GLU E OE2 1 ATOM 9386 N N . GLN F 3 166 ? 54.228 41.383 73.784 1.00 92.45 ? 166 GLN E N 1 ATOM 9387 C CA . GLN F 3 166 ? 53.142 42.344 73.911 1.00 93.41 ? 166 GLN E CA 1 ATOM 9388 C C . GLN F 3 166 ? 53.615 43.561 74.699 1.00 97.04 ? 166 GLN E C 1 ATOM 9389 O O . GLN F 3 166 ? 54.131 43.426 75.810 1.00 101.45 ? 166 GLN E O 1 ATOM 9390 C CB . GLN F 3 166 ? 51.930 41.701 74.585 1.00 91.75 ? 166 GLN E CB 1 ATOM 9391 C CG . GLN F 3 166 ? 50.637 42.464 74.382 1.00 91.95 ? 166 GLN E CG 1 ATOM 9392 C CD . GLN F 3 166 ? 49.428 41.686 74.852 1.00 94.58 ? 166 GLN E CD 1 ATOM 9393 O OE1 . GLN F 3 166 ? 49.533 40.816 75.717 1.00 96.23 ? 166 GLN E OE1 1 ATOM 9394 N NE2 . GLN F 3 166 ? 48.270 41.988 74.278 1.00 98.02 ? 166 GLN E NE2 1 ATOM 9395 N N . ASP F 3 167 ? 53.452 44.743 74.113 1.00 95.23 ? 167 ASP E N 1 ATOM 9396 C CA . ASP F 3 167 ? 53.946 45.975 74.718 1.00 100.60 ? 167 ASP E CA 1 ATOM 9397 C C . ASP F 3 167 ? 53.240 46.263 76.042 1.00 110.07 ? 167 ASP E C 1 ATOM 9398 O O . ASP F 3 167 ? 52.135 45.778 76.285 1.00 112.25 ? 167 ASP E O 1 ATOM 9399 C CB . ASP F 3 167 ? 53.774 47.147 73.753 1.00 100.01 ? 167 ASP E CB 1 ATOM 9400 C CG . ASP F 3 167 ? 54.579 48.364 74.163 1.00 102.46 ? 167 ASP E CG 1 ATOM 9401 O OD1 . ASP F 3 167 ? 55.722 48.511 73.682 1.00 103.68 ? 167 ASP E OD1 1 ATOM 9402 O OD2 . ASP F 3 167 ? 54.071 49.170 74.970 1.00 103.08 ? 167 ASP E OD2 1 ATOM 9403 N N . SER F 3 168 ? 53.881 47.054 76.896 1.00 116.79 ? 168 SER E N 1 ATOM 9404 C CA . SER F 3 168 ? 53.401 47.242 78.260 1.00 123.52 ? 168 SER E CA 1 ATOM 9405 C C . SER F 3 168 ? 52.622 48.539 78.470 1.00 127.53 ? 168 SER E C 1 ATOM 9406 O O . SER F 3 168 ? 52.158 48.808 79.578 1.00 135.22 ? 168 SER E O 1 ATOM 9407 C CB . SER F 3 168 ? 54.579 47.191 79.238 1.00 128.21 ? 168 SER E CB 1 ATOM 9408 O OG . SER F 3 168 ? 55.525 48.206 78.953 1.00 129.58 ? 168 SER E OG 1 ATOM 9409 N N . LYS F 3 169 ? 52.472 49.341 77.421 1.00 121.60 ? 169 LYS E N 1 ATOM 9410 C CA . LYS F 3 169 ? 51.750 50.604 77.556 1.00 122.19 ? 169 LYS E CA 1 ATOM 9411 C C . LYS F 3 169 ? 50.542 50.694 76.625 1.00 115.43 ? 169 LYS E C 1 ATOM 9412 O O . LYS F 3 169 ? 49.669 51.539 76.817 1.00 119.88 ? 169 LYS E O 1 ATOM 9413 C CB . LYS F 3 169 ? 52.687 51.791 77.307 1.00 123.94 ? 169 LYS E CB 1 ATOM 9414 C CG . LYS F 3 169 ? 53.027 52.037 75.846 1.00 119.47 ? 169 LYS E CG 1 ATOM 9415 C CD . LYS F 3 169 ? 53.862 53.298 75.682 1.00 120.35 ? 169 LYS E CD 1 ATOM 9416 C CE . LYS F 3 169 ? 54.179 53.569 74.220 1.00 113.42 ? 169 LYS E CE 1 ATOM 9417 N NZ . LYS F 3 169 ? 54.960 54.825 74.046 1.00 114.57 ? 169 LYS E NZ 1 ATOM 9418 N N . ASP F 3 170 ? 50.489 49.825 75.620 1.00 106.67 ? 170 ASP E N 1 ATOM 9419 C CA . ASP F 3 170 ? 49.370 49.821 74.682 1.00 103.41 ? 170 ASP E CA 1 ATOM 9420 C C . ASP F 3 170 ? 48.987 48.407 74.259 1.00 97.06 ? 170 ASP E C 1 ATOM 9421 O O . ASP F 3 170 ? 48.037 48.218 73.499 1.00 95.26 ? 170 ASP E O 1 ATOM 9422 C CB . ASP F 3 170 ? 49.702 50.665 73.448 1.00 102.16 ? 170 ASP E CB 1 ATOM 9423 C CG . ASP F 3 170 ? 50.889 50.126 72.675 1.00 99.03 ? 170 ASP E CG 1 ATOM 9424 O OD1 . ASP F 3 170 ? 51.773 49.508 73.302 1.00 99.24 ? 170 ASP E OD1 1 ATOM 9425 O OD2 . ASP F 3 170 ? 50.938 50.322 71.442 1.00 95.47 ? 170 ASP E OD2 1 ATOM 9426 N N . SER F 3 171 ? 49.740 47.425 74.749 1.00 95.68 ? 171 SER E N 1 ATOM 9427 C CA . SER F 3 171 ? 49.454 46.009 74.515 1.00 93.45 ? 171 SER E CA 1 ATOM 9428 C C . SER F 3 171 ? 49.414 45.628 73.035 1.00 88.77 ? 171 SER E C 1 ATOM 9429 O O . SER F 3 171 ? 48.549 44.864 72.608 1.00 89.44 ? 171 SER E O 1 ATOM 9430 C CB . SER F 3 171 ? 48.129 45.624 75.178 1.00 101.40 ? 171 SER E CB 1 ATOM 9431 O OG . SER F 3 171 ? 47.710 44.337 74.764 1.00 103.44 ? 171 SER E OG 1 ATOM 9432 N N . THR F 3 172 ? 50.355 46.151 72.256 1.00 86.99 ? 172 THR E N 1 ATOM 9433 C CA . THR F 3 172 ? 50.405 45.844 70.832 1.00 85.37 ? 172 THR E CA 1 ATOM 9434 C C . THR F 3 172 ? 51.617 44.985 70.487 1.00 85.59 ? 172 THR E C 1 ATOM 9435 O O . THR F 3 172 ? 52.604 44.959 71.224 1.00 75.29 ? 172 THR E O 1 ATOM 9436 C CB . THR F 3 172 ? 50.438 47.126 69.977 1.00 82.87 ? 172 THR E CB 1 ATOM 9437 O OG1 . THR F 3 172 ? 51.550 47.939 70.371 1.00 83.01 ? 172 THR E OG1 1 ATOM 9438 C CG2 . THR F 3 172 ? 49.149 47.914 70.153 1.00 84.17 ? 172 THR E CG2 1 ATOM 9439 N N . TYR F 3 173 ? 51.527 44.278 69.364 1.00 82.94 ? 173 TYR E N 1 ATOM 9440 C CA . TYR F 3 173 ? 52.625 43.447 68.881 1.00 77.75 ? 173 TYR E CA 1 ATOM 9441 C C . TYR F 3 173 ? 53.289 44.088 67.670 1.00 77.79 ? 173 TYR E C 1 ATOM 9442 O O . TYR F 3 173 ? 52.728 44.986 67.045 1.00 78.73 ? 173 TYR E O 1 ATOM 9443 C CB . TYR F 3 173 ? 52.127 42.044 68.523 1.00 74.21 ? 173 TYR E CB 1 ATOM 9444 C CG . TYR F 3 173 ? 51.550 41.277 69.689 1.00 76.94 ? 173 TYR E CG 1 ATOM 9445 C CD1 . TYR F 3 173 ? 52.342 40.422 70.444 1.00 75.89 ? 173 TYR E CD1 1 ATOM 9446 C CD2 . TYR F 3 173 ? 50.212 41.408 70.035 1.00 80.59 ? 173 TYR E CD2 1 ATOM 9447 C CE1 . TYR F 3 173 ? 51.818 39.721 71.511 1.00 80.14 ? 173 TYR E CE1 1 ATOM 9448 C CE2 . TYR F 3 173 ? 49.680 40.712 71.099 1.00 86.90 ? 173 TYR E CE2 1 ATOM 9449 C CZ . TYR F 3 173 ? 50.486 39.871 71.834 1.00 87.06 ? 173 TYR E CZ 1 ATOM 9450 O OH . TYR F 3 173 ? 49.956 39.176 72.895 1.00 94.72 ? 173 TYR E OH 1 ATOM 9451 N N . SER F 3 174 ? 54.489 43.623 67.343 1.00 76.83 ? 174 SER E N 1 ATOM 9452 C CA . SER F 3 174 ? 55.193 44.089 66.156 1.00 75.08 ? 174 SER E CA 1 ATOM 9453 C C . SER F 3 174 ? 55.909 42.926 65.482 1.00 73.96 ? 174 SER E C 1 ATOM 9454 O O . SER F 3 174 ? 56.427 42.034 66.153 1.00 73.67 ? 174 SER E O 1 ATOM 9455 C CB . SER F 3 174 ? 56.184 45.198 66.513 1.00 75.08 ? 174 SER E CB 1 ATOM 9456 O OG . SER F 3 174 ? 55.508 46.342 67.007 1.00 76.50 ? 174 SER E OG 1 ATOM 9457 N N . LEU F 3 175 ? 55.932 42.937 64.154 1.00 74.64 ? 175 LEU E N 1 ATOM 9458 C CA . LEU F 3 175 ? 56.536 41.851 63.392 1.00 77.47 ? 175 LEU E CA 1 ATOM 9459 C C . LEU F 3 175 ? 57.611 42.384 62.449 1.00 83.28 ? 175 LEU E C 1 ATOM 9460 O O . LEU F 3 175 ? 57.515 43.506 61.948 1.00 87.31 ? 175 LEU E O 1 ATOM 9461 C CB . LEU F 3 175 ? 55.462 41.088 62.609 1.00 79.82 ? 175 LEU E CB 1 ATOM 9462 C CG . LEU F 3 175 ? 55.829 39.761 61.939 1.00 78.51 ? 175 LEU E CG 1 ATOM 9463 C CD1 . LEU F 3 175 ? 54.641 38.813 61.980 1.00 84.93 ? 175 LEU E CD1 1 ATOM 9464 C CD2 . LEU F 3 175 ? 56.278 39.974 60.502 1.00 77.14 ? 175 LEU E CD2 1 ATOM 9465 N N . SER F 3 176 ? 58.637 41.571 62.219 1.00 81.08 ? 176 SER E N 1 ATOM 9466 C CA . SER F 3 176 ? 59.732 41.940 61.332 1.00 77.52 ? 176 SER E CA 1 ATOM 9467 C C . SER F 3 176 ? 60.201 40.734 60.528 1.00 78.69 ? 176 SER E C 1 ATOM 9468 O O . SER F 3 176 ? 60.697 39.761 61.093 1.00 75.47 ? 176 SER E O 1 ATOM 9469 C CB . SER F 3 176 ? 60.896 42.526 62.131 1.00 72.66 ? 176 SER E CB 1 ATOM 9470 O OG . SER F 3 176 ? 62.020 42.755 61.299 1.00 72.95 ? 176 SER E OG 1 ATOM 9471 N N . SER F 3 177 ? 60.043 40.802 59.210 1.00 81.84 ? 177 SER E N 1 ATOM 9472 C CA . SER F 3 177 ? 60.455 39.710 58.335 1.00 79.14 ? 177 SER E CA 1 ATOM 9473 C C . SER F 3 177 ? 61.609 40.130 57.432 1.00 74.32 ? 177 SER E C 1 ATOM 9474 O O . SER F 3 177 ? 61.646 41.258 56.941 1.00 70.67 ? 177 SER E O 1 ATOM 9475 C CB . SER F 3 177 ? 59.278 39.223 57.489 1.00 84.06 ? 177 SER E CB 1 ATOM 9476 O OG . SER F 3 177 ? 59.646 38.102 56.703 1.00 86.30 ? 177 SER E OG 1 ATOM 9477 N N . THR F 3 178 ? 62.550 39.216 57.215 1.00 76.03 ? 178 THR E N 1 ATOM 9478 C CA . THR F 3 178 ? 63.714 39.502 56.385 1.00 75.38 ? 178 THR E CA 1 ATOM 9479 C C . THR F 3 178 ? 63.843 38.522 55.223 1.00 76.60 ? 178 THR E C 1 ATOM 9480 O O . THR F 3 178 ? 64.027 37.320 55.424 1.00 74.40 ? 178 THR E O 1 ATOM 9481 C CB . THR F 3 178 ? 65.015 39.473 57.210 1.00 71.02 ? 178 THR E CB 1 ATOM 9482 O OG1 . THR F 3 178 ? 64.973 40.500 58.208 1.00 72.19 ? 178 THR E OG1 1 ATOM 9483 C CG2 . THR F 3 178 ? 66.219 39.700 56.309 1.00 69.20 ? 178 THR E CG2 1 ATOM 9484 N N . LEU F 3 179 ? 63.743 39.050 54.008 1.00 80.25 ? 179 LEU E N 1 ATOM 9485 C CA . LEU F 3 179 ? 63.927 38.256 52.800 1.00 83.73 ? 179 LEU E CA 1 ATOM 9486 C C . LEU F 3 179 ? 65.382 38.324 52.351 1.00 82.24 ? 179 LEU E C 1 ATOM 9487 O O . LEU F 3 179 ? 65.859 39.376 51.927 1.00 81.68 ? 179 LEU E O 1 ATOM 9488 C CB . LEU F 3 179 ? 63.003 38.745 51.684 1.00 88.99 ? 179 LEU E CB 1 ATOM 9489 C CG . LEU F 3 179 ? 63.021 37.928 50.390 1.00 91.95 ? 179 LEU E CG 1 ATOM 9490 C CD1 . LEU F 3 179 ? 62.444 36.543 50.625 1.00 94.98 ? 179 LEU E CD1 1 ATOM 9491 C CD2 . LEU F 3 179 ? 62.270 38.645 49.280 1.00 94.61 ? 179 LEU E CD2 1 ATOM 9492 N N . THR F 3 180 ? 66.083 37.200 52.445 1.00 81.33 ? 180 THR E N 1 ATOM 9493 C CA . THR F 3 180 ? 67.506 37.160 52.132 1.00 77.68 ? 180 THR E CA 1 ATOM 9494 C C . THR F 3 180 ? 67.795 36.425 50.827 1.00 81.51 ? 180 THR E C 1 ATOM 9495 O O . THR F 3 180 ? 67.494 35.239 50.689 1.00 81.12 ? 180 THR E O 1 ATOM 9496 C CB . THR F 3 180 ? 68.308 36.490 53.264 1.00 72.56 ? 180 THR E CB 1 ATOM 9497 O OG1 . THR F 3 180 ? 68.138 37.232 54.478 1.00 65.98 ? 180 THR E OG1 1 ATOM 9498 C CG2 . THR F 3 180 ? 69.785 36.439 52.909 1.00 72.99 ? 180 THR E CG2 1 ATOM 9499 N N . LEU F 3 181 ? 68.380 37.140 49.871 1.00 84.65 ? 181 LEU E N 1 ATOM 9500 C CA . LEU F 3 181 ? 68.802 36.543 48.610 1.00 88.10 ? 181 LEU E CA 1 ATOM 9501 C C . LEU F 3 181 ? 70.235 36.951 48.302 1.00 86.87 ? 181 LEU E C 1 ATOM 9502 O O . LEU F 3 181 ? 70.744 37.920 48.865 1.00 84.09 ? 181 LEU E O 1 ATOM 9503 C CB . LEU F 3 181 ? 67.883 36.964 47.459 1.00 93.95 ? 181 LEU E CB 1 ATOM 9504 C CG . LEU F 3 181 ? 66.367 36.897 47.648 1.00 95.36 ? 181 LEU E CG 1 ATOM 9505 C CD1 . LEU F 3 181 ? 65.830 38.237 48.125 1.00 94.15 ? 181 LEU E CD1 1 ATOM 9506 C CD2 . LEU F 3 181 ? 65.687 36.473 46.357 1.00 99.32 ? 181 LEU E CD2 1 ATOM 9507 N N . SER F 3 182 ? 70.886 36.213 47.409 1.00 88.62 ? 182 SER E N 1 ATOM 9508 C CA . SER F 3 182 ? 72.227 36.575 46.971 1.00 88.17 ? 182 SER E CA 1 ATOM 9509 C C . SER F 3 182 ? 72.152 37.799 46.067 1.00 93.46 ? 182 SER E C 1 ATOM 9510 O O . SER F 3 182 ? 71.083 38.135 45.558 1.00 96.74 ? 182 SER E O 1 ATOM 9511 C CB . SER F 3 182 ? 72.900 35.411 46.241 1.00 89.31 ? 182 SER E CB 1 ATOM 9512 O OG . SER F 3 182 ? 72.222 35.098 45.037 1.00 94.42 ? 182 SER E OG 1 ATOM 9513 N N . LYS F 3 183 ? 73.287 38.463 45.876 1.00 92.78 ? 183 LYS E N 1 ATOM 9514 C CA . LYS F 3 183 ? 73.352 39.653 45.036 1.00 93.21 ? 183 LYS E CA 1 ATOM 9515 C C . LYS F 3 183 ? 72.951 39.339 43.598 1.00 99.77 ? 183 LYS E C 1 ATOM 9516 O O . LYS F 3 183 ? 72.241 40.115 42.957 1.00 102.19 ? 183 LYS E O 1 ATOM 9517 C CB . LYS F 3 183 ? 74.760 40.252 45.070 1.00 91.93 ? 183 LYS E CB 1 ATOM 9518 C CG . LYS F 3 183 ? 74.932 41.499 44.214 1.00 92.43 ? 183 LYS E CG 1 ATOM 9519 C CD . LYS F 3 183 ? 76.374 41.980 44.227 1.00 88.05 ? 183 LYS E CD 1 ATOM 9520 C CE . LYS F 3 183 ? 76.525 43.293 43.479 1.00 89.58 ? 183 LYS E CE 1 ATOM 9521 N NZ . LYS F 3 183 ? 76.160 43.157 42.043 1.00 99.22 ? 183 LYS E NZ 1 ATOM 9522 N N . ALA F 3 184 ? 73.408 38.194 43.100 1.00 102.25 ? 184 ALA E N 1 ATOM 9523 C CA . ALA F 3 184 ? 73.105 37.772 41.739 1.00 108.45 ? 184 ALA E CA 1 ATOM 9524 C C . ALA F 3 184 ? 71.621 37.463 41.572 1.00 115.23 ? 184 ALA E C 1 ATOM 9525 O O . ALA F 3 184 ? 70.997 37.885 40.598 1.00 119.84 ? 184 ALA E O 1 ATOM 9526 C CB . ALA F 3 184 ? 73.944 36.561 41.364 1.00 108.40 ? 184 ALA E CB 1 ATOM 9527 N N . ASP F 3 185 ? 71.061 36.728 42.527 1.00 117.56 ? 185 ASP E N 1 ATOM 9528 C CA . ASP F 3 185 ? 69.649 36.365 42.482 1.00 120.94 ? 185 ASP E CA 1 ATOM 9529 C C . ASP F 3 185 ? 68.770 37.597 42.678 1.00 118.34 ? 185 ASP E C 1 ATOM 9530 O O . ASP F 3 185 ? 67.641 37.652 42.191 1.00 121.65 ? 185 ASP E O 1 ATOM 9531 C CB . ASP F 3 185 ? 69.332 35.308 43.544 1.00 122.55 ? 185 ASP E CB 1 ATOM 9532 C CG . ASP F 3 185 ? 67.934 34.733 43.399 1.00 128.95 ? 185 ASP E CG 1 ATOM 9533 O OD1 . ASP F 3 185 ? 67.329 34.368 44.430 1.00 128.70 ? 185 ASP E OD1 1 ATOM 9534 O OD2 . ASP F 3 185 ? 67.441 34.644 42.255 1.00 132.93 ? 185 ASP E OD2 1 ATOM 9535 N N . TYR F 3 186 ? 69.301 38.588 43.389 1.00 111.53 ? 186 TYR E N 1 ATOM 9536 C CA . TYR F 3 186 ? 68.579 39.831 43.631 1.00 104.14 ? 186 TYR E CA 1 ATOM 9537 C C . TYR F 3 186 ? 68.522 40.702 42.379 1.00 105.78 ? 186 TYR E C 1 ATOM 9538 O O . TYR F 3 186 ? 67.475 41.255 42.044 1.00 105.41 ? 186 TYR E O 1 ATOM 9539 C CB . TYR F 3 186 ? 69.224 40.611 44.781 1.00 93.18 ? 186 TYR E CB 1 ATOM 9540 C CG . TYR F 3 186 ? 68.598 41.966 45.039 1.00 87.77 ? 186 TYR E CG 1 ATOM 9541 C CD1 . TYR F 3 186 ? 67.412 42.081 45.754 1.00 86.24 ? 186 TYR E CD1 1 ATOM 9542 C CD2 . TYR F 3 186 ? 69.197 43.131 44.575 1.00 84.18 ? 186 TYR E CD2 1 ATOM 9543 C CE1 . TYR F 3 186 ? 66.837 43.317 45.994 1.00 82.74 ? 186 TYR E CE1 1 ATOM 9544 C CE2 . TYR F 3 186 ? 68.631 44.371 44.810 1.00 81.50 ? 186 TYR E CE2 1 ATOM 9545 C CZ . TYR F 3 186 ? 67.452 44.458 45.519 1.00 81.93 ? 186 TYR E CZ 1 ATOM 9546 O OH . TYR F 3 186 ? 66.886 45.690 45.754 1.00 83.18 ? 186 TYR E OH 1 ATOM 9547 N N . GLU F 3 187 ? 69.651 40.816 41.687 1.00 107.99 ? 187 GLU E N 1 ATOM 9548 C CA . GLU F 3 187 ? 69.747 41.683 40.517 1.00 114.36 ? 187 GLU E CA 1 ATOM 9549 C C . GLU F 3 187 ? 69.238 41.014 39.242 1.00 120.65 ? 187 GLU E C 1 ATOM 9550 O O . GLU F 3 187 ? 69.419 41.540 38.143 1.00 123.87 ? 187 GLU E O 1 ATOM 9551 C CB . GLU F 3 187 ? 71.191 42.145 40.319 1.00 115.38 ? 187 GLU E CB 1 ATOM 9552 C CG . GLU F 3 187 ? 71.704 43.043 41.433 1.00 112.35 ? 187 GLU E CG 1 ATOM 9553 C CD . GLU F 3 187 ? 73.116 43.534 41.186 1.00 112.15 ? 187 GLU E CD 1 ATOM 9554 O OE1 . GLU F 3 187 ? 73.778 43.009 40.265 1.00 115.47 ? 187 GLU E OE1 1 ATOM 9555 O OE2 . GLU F 3 187 ? 73.564 44.447 41.911 1.00 109.00 ? 187 GLU E OE2 1 ATOM 9556 N N . LYS F 3 188 ? 68.602 39.856 39.394 1.00 122.31 ? 188 LYS E N 1 ATOM 9557 C CA . LYS F 3 188 ? 68.005 39.158 38.261 1.00 126.60 ? 188 LYS E CA 1 ATOM 9558 C C . LYS F 3 188 ? 66.553 39.589 38.095 1.00 127.50 ? 188 LYS E C 1 ATOM 9559 O O . LYS F 3 188 ? 65.953 39.417 37.032 1.00 133.32 ? 188 LYS E O 1 ATOM 9560 C CB . LYS F 3 188 ? 68.099 37.642 38.446 1.00 128.02 ? 188 LYS E CB 1 ATOM 9561 C CG . LYS F 3 188 ? 67.841 36.847 37.175 1.00 134.66 ? 188 LYS E CG 1 ATOM 9562 C CD . LYS F 3 188 ? 68.110 35.364 37.379 1.00 134.99 ? 188 LYS E CD 1 ATOM 9563 C CE . LYS F 3 188 ? 67.151 34.753 38.390 1.00 131.69 ? 188 LYS E CE 1 ATOM 9564 N NZ . LYS F 3 188 ? 67.383 33.293 38.576 1.00 130.02 ? 188 LYS E NZ 1 ATOM 9565 N N . HIS F 3 189 ? 65.997 40.159 39.160 1.00 122.85 ? 189 HIS E N 1 ATOM 9566 C CA . HIS F 3 189 ? 64.631 40.673 39.133 1.00 123.41 ? 189 HIS E CA 1 ATOM 9567 C C . HIS F 3 189 ? 64.602 42.152 39.522 1.00 120.75 ? 189 HIS E C 1 ATOM 9568 O O . HIS F 3 189 ? 65.573 42.676 40.078 1.00 117.34 ? 189 HIS E O 1 ATOM 9569 C CB . HIS F 3 189 ? 63.734 39.855 40.062 1.00 119.54 ? 189 HIS E CB 1 ATOM 9570 C CG . HIS F 3 189 ? 63.989 38.380 39.998 1.00 117.36 ? 189 HIS E CG 1 ATOM 9571 N ND1 . HIS F 3 189 ? 65.039 37.780 40.658 1.00 111.45 ? 189 HIS E ND1 1 ATOM 9572 C CD2 . HIS F 3 189 ? 63.334 37.388 39.350 1.00 121.04 ? 189 HIS E CD2 1 ATOM 9573 C CE1 . HIS F 3 189 ? 65.017 36.479 40.424 1.00 114.49 ? 189 HIS E CE1 1 ATOM 9574 N NE2 . HIS F 3 189 ? 63.993 36.216 39.632 1.00 120.05 ? 189 HIS E NE2 1 ATOM 9575 N N . LYS F 3 190 ? 63.495 42.824 39.220 1.00 122.03 ? 190 LYS E N 1 ATOM 9576 C CA . LYS F 3 190 ? 63.379 44.247 39.497 1.00 119.55 ? 190 LYS E CA 1 ATOM 9577 C C . LYS F 3 190 ? 62.177 44.550 40.391 1.00 118.00 ? 190 LYS E C 1 ATOM 9578 O O . LYS F 3 190 ? 61.979 45.687 40.812 1.00 117.34 ? 190 LYS E O 1 ATOM 9579 C CB . LYS F 3 190 ? 63.278 45.033 38.187 1.00 125.43 ? 190 LYS E CB 1 ATOM 9580 C CG . LYS F 3 190 ? 64.490 44.897 37.281 1.00 126.31 ? 190 LYS E CG 1 ATOM 9581 C CD . LYS F 3 190 ? 64.403 45.838 36.095 1.00 130.11 ? 190 LYS E CD 1 ATOM 9582 C CE . LYS F 3 190 ? 65.669 45.799 35.253 1.00 128.87 ? 190 LYS E CE 1 ATOM 9583 N NZ . LYS F 3 190 ? 66.013 44.416 34.823 1.00 128.65 ? 190 LYS E NZ 1 ATOM 9584 N N . VAL F 3 191 ? 61.376 43.530 40.684 1.00 118.75 ? 191 VAL E N 1 ATOM 9585 C CA . VAL F 3 191 ? 60.151 43.724 41.460 1.00 118.39 ? 191 VAL E CA 1 ATOM 9586 C C . VAL F 3 191 ? 60.163 42.965 42.785 1.00 116.24 ? 191 VAL E C 1 ATOM 9587 O O . VAL F 3 191 ? 60.408 41.759 42.818 1.00 116.05 ? 191 VAL E O 1 ATOM 9588 C CB . VAL F 3 191 ? 58.907 43.290 40.658 1.00 120.87 ? 191 VAL E CB 1 ATOM 9589 C CG1 . VAL F 3 191 ? 57.636 43.538 41.462 1.00 121.47 ? 191 VAL E CG1 1 ATOM 9590 C CG2 . VAL F 3 191 ? 58.855 44.023 39.332 1.00 121.66 ? 191 VAL E CG2 1 ATOM 9591 N N . TYR F 3 192 ? 59.891 43.680 43.874 1.00 114.13 ? 192 TYR E N 1 ATOM 9592 C CA . TYR F 3 192 ? 59.867 43.083 45.206 1.00 109.14 ? 192 TYR E CA 1 ATOM 9593 C C . TYR F 3 192 ? 58.708 43.622 46.039 1.00 108.57 ? 192 TYR E C 1 ATOM 9594 O O . TYR F 3 192 ? 58.592 44.830 46.241 1.00 109.40 ? 192 TYR E O 1 ATOM 9595 C CB . TYR F 3 192 ? 61.190 43.335 45.929 1.00 104.54 ? 192 TYR E CB 1 ATOM 9596 C CG . TYR F 3 192 ? 62.377 42.703 45.246 1.00 106.79 ? 192 TYR E CG 1 ATOM 9597 C CD1 . TYR F 3 192 ? 63.117 43.407 44.306 1.00 107.79 ? 192 TYR E CD1 1 ATOM 9598 C CD2 . TYR F 3 192 ? 62.753 41.398 45.533 1.00 107.80 ? 192 TYR E CD2 1 ATOM 9599 C CE1 . TYR F 3 192 ? 64.198 42.832 43.675 1.00 108.64 ? 192 TYR E CE1 1 ATOM 9600 C CE2 . TYR F 3 192 ? 63.835 40.814 44.907 1.00 108.60 ? 192 TYR E CE2 1 ATOM 9601 C CZ . TYR F 3 192 ? 64.552 41.536 43.979 1.00 109.05 ? 192 TYR E CZ 1 ATOM 9602 O OH . TYR F 3 192 ? 65.629 40.958 43.352 1.00 109.31 ? 192 TYR E OH 1 ATOM 9603 N N . ALA F 3 193 ? 57.861 42.721 46.532 1.00 108.43 ? 193 ALA E N 1 ATOM 9604 C CA . ALA F 3 193 ? 56.670 43.120 47.274 1.00 106.82 ? 193 ALA E CA 1 ATOM 9605 C C . ALA F 3 193 ? 56.560 42.424 48.629 1.00 109.38 ? 193 ALA E C 1 ATOM 9606 O O . ALA F 3 193 ? 57.227 41.424 48.891 1.00 106.30 ? 193 ALA E O 1 ATOM 9607 C CB . ALA F 3 193 ? 55.423 42.849 46.445 1.00 105.17 ? 193 ALA E CB 1 ATOM 9608 N N . CYS F 3 194 ? 55.701 42.973 49.482 1.00 115.14 ? 194 CYS E N 1 ATOM 9609 C CA . CYS F 3 194 ? 55.440 42.420 50.804 1.00 113.69 ? 194 CYS E CA 1 ATOM 9610 C C . CYS F 3 194 ? 53.961 42.551 51.156 1.00 119.48 ? 194 CYS E C 1 ATOM 9611 O O . CYS F 3 194 ? 53.500 43.626 51.535 1.00 123.02 ? 194 CYS E O 1 ATOM 9612 C CB . CYS F 3 194 ? 56.302 43.118 51.857 1.00 110.72 ? 194 CYS E CB 1 ATOM 9613 S SG . CYS F 3 194 ? 55.944 42.594 53.542 1.00 159.79 ? 194 CYS E SG 1 ATOM 9614 N N . GLU F 3 195 ? 53.221 41.455 51.022 1.00 120.48 ? 195 GLU E N 1 ATOM 9615 C CA . GLU F 3 195 ? 51.786 41.477 51.277 1.00 118.99 ? 195 GLU E CA 1 ATOM 9616 C C . GLU F 3 195 ? 51.467 41.011 52.694 1.00 111.59 ? 195 GLU E C 1 ATOM 9617 O O . GLU F 3 195 ? 51.957 39.976 53.144 1.00 108.07 ? 195 GLU E O 1 ATOM 9618 C CB . GLU F 3 195 ? 51.046 40.615 50.250 1.00 123.08 ? 195 GLU E CB 1 ATOM 9619 C CG . GLU F 3 195 ? 49.532 40.743 50.306 1.00 127.87 ? 195 GLU E CG 1 ATOM 9620 C CD . GLU F 3 195 ? 48.848 40.119 49.103 1.00 134.15 ? 195 GLU E CD 1 ATOM 9621 O OE1 . GLU F 3 195 ? 49.272 39.025 48.674 1.00 135.21 ? 195 GLU E OE1 1 ATOM 9622 O OE2 . GLU F 3 195 ? 47.889 40.727 48.582 1.00 138.52 ? 195 GLU E OE2 1 ATOM 9623 N N . VAL F 3 196 ? 50.643 41.788 53.391 1.00 109.09 ? 196 VAL E N 1 ATOM 9624 C CA . VAL F 3 196 ? 50.270 41.482 54.767 1.00 106.21 ? 196 VAL E CA 1 ATOM 9625 C C . VAL F 3 196 ? 48.765 41.241 54.880 1.00 111.83 ? 196 VAL E C 1 ATOM 9626 O O . VAL F 3 196 ? 47.967 41.971 54.294 1.00 116.74 ? 196 VAL E O 1 ATOM 9627 C CB . VAL F 3 196 ? 50.684 42.619 55.726 1.00 100.56 ? 196 VAL E CB 1 ATOM 9628 C CG1 . VAL F 3 196 ? 50.201 42.341 57.141 1.00 95.54 ? 196 VAL E CG1 1 ATOM 9629 C CG2 . VAL F 3 196 ? 52.193 42.812 55.703 1.00 98.38 ? 196 VAL E CG2 1 ATOM 9630 N N . THR F 3 197 ? 48.387 40.208 55.625 1.00 109.18 ? 197 THR E N 1 ATOM 9631 C CA . THR F 3 197 ? 46.983 39.930 55.901 1.00 112.24 ? 197 THR E CA 1 ATOM 9632 C C . THR F 3 197 ? 46.739 39.935 57.409 1.00 111.93 ? 197 THR E C 1 ATOM 9633 O O . THR F 3 197 ? 47.429 39.243 58.157 1.00 107.70 ? 197 THR E O 1 ATOM 9634 C CB . THR F 3 197 ? 46.546 38.582 55.303 1.00 114.27 ? 197 THR E CB 1 ATOM 9635 O OG1 . THR F 3 197 ? 46.799 38.580 53.892 1.00 117.57 ? 197 THR E OG1 1 ATOM 9636 C CG2 . THR F 3 197 ? 45.065 38.348 55.546 1.00 118.78 ? 197 THR E CG2 1 ATOM 9637 N N . HIS F 3 198 ? 45.762 40.722 57.851 1.00 114.34 ? 198 HIS E N 1 ATOM 9638 C CA . HIS F 3 198 ? 45.502 40.912 59.276 1.00 109.44 ? 198 HIS E CA 1 ATOM 9639 C C . HIS F 3 198 ? 44.014 41.152 59.513 1.00 109.76 ? 198 HIS E C 1 ATOM 9640 O O . HIS F 3 198 ? 43.278 41.449 58.575 1.00 117.38 ? 198 HIS E O 1 ATOM 9641 C CB . HIS F 3 198 ? 46.334 42.084 59.808 1.00 104.31 ? 198 HIS E CB 1 ATOM 9642 C CG . HIS F 3 198 ? 46.337 42.205 61.299 1.00 99.28 ? 198 HIS E CG 1 ATOM 9643 N ND1 . HIS F 3 198 ? 45.591 43.150 61.970 1.00 99.93 ? 198 HIS E ND1 1 ATOM 9644 C CD2 . HIS F 3 198 ? 47.000 41.505 62.249 1.00 94.00 ? 198 HIS E CD2 1 ATOM 9645 C CE1 . HIS F 3 198 ? 45.796 43.028 63.268 1.00 95.42 ? 198 HIS E CE1 1 ATOM 9646 N NE2 . HIS F 3 198 ? 46.644 42.034 63.465 1.00 92.88 ? 198 HIS E NE2 1 ATOM 9647 N N . GLN F 3 199 ? 43.572 41.013 60.762 1.00 107.43 ? 199 GLN E N 1 ATOM 9648 C CA . GLN F 3 199 ? 42.164 41.211 61.101 1.00 112.57 ? 199 GLN E CA 1 ATOM 9649 C C . GLN F 3 199 ? 41.740 42.654 60.857 1.00 117.21 ? 199 GLN E C 1 ATOM 9650 O O . GLN F 3 199 ? 40.644 42.913 60.360 1.00 122.03 ? 199 GLN E O 1 ATOM 9651 C CB . GLN F 3 199 ? 41.889 40.826 62.558 1.00 108.97 ? 199 GLN E CB 1 ATOM 9652 C CG . GLN F 3 199 ? 40.438 41.027 62.983 1.00 112.17 ? 199 GLN E CG 1 ATOM 9653 C CD . GLN F 3 199 ? 40.174 40.585 64.410 1.00 112.49 ? 199 GLN E CD 1 ATOM 9654 O OE1 . GLN F 3 199 ? 41.031 39.980 65.053 1.00 112.61 ? 199 GLN E OE1 1 ATOM 9655 N NE2 . GLN F 3 199 ? 38.981 40.886 64.912 1.00 117.14 ? 199 GLN E NE2 1 ATOM 9656 N N . GLY F 3 200 ? 42.617 43.590 61.203 1.00 115.89 ? 200 GLY E N 1 ATOM 9657 C CA . GLY F 3 200 ? 42.364 44.999 60.964 1.00 121.89 ? 200 GLY E CA 1 ATOM 9658 C C . GLY F 3 200 ? 42.401 45.335 59.485 1.00 128.09 ? 200 GLY E C 1 ATOM 9659 O O . GLY F 3 200 ? 41.936 46.394 59.064 1.00 131.37 ? 200 GLY E O 1 ATOM 9660 N N . LEU F 3 201 ? 42.960 44.424 58.695 1.00 129.22 ? 201 LEU E N 1 ATOM 9661 C CA . LEU F 3 201 ? 43.032 44.602 57.251 1.00 130.80 ? 201 LEU E CA 1 ATOM 9662 C C . LEU F 3 201 ? 41.807 44.017 56.558 1.00 133.71 ? 201 LEU E C 1 ATOM 9663 O O . LEU F 3 201 ? 41.599 42.803 56.561 1.00 132.25 ? 201 LEU E O 1 ATOM 9664 C CB . LEU F 3 201 ? 44.303 43.959 56.695 1.00 130.70 ? 201 LEU E CB 1 ATOM 9665 C CG . LEU F 3 201 ? 45.610 44.526 57.250 1.00 130.56 ? 201 LEU E CG 1 ATOM 9666 C CD1 . LEU F 3 201 ? 46.811 43.897 56.564 1.00 128.68 ? 201 LEU E CD1 1 ATOM 9667 C CD2 . LEU F 3 201 ? 45.636 46.039 57.111 1.00 133.52 ? 201 LEU E CD2 1 ATOM 9668 N N . SER F 3 202 ? 41.000 44.891 55.966 1.00 137.66 ? 202 SER E N 1 ATOM 9669 C CA . SER F 3 202 ? 39.834 44.469 55.198 1.00 139.93 ? 202 SER E CA 1 ATOM 9670 C C . SER F 3 202 ? 40.279 43.790 53.907 1.00 138.17 ? 202 SER E C 1 ATOM 9671 O O . SER F 3 202 ? 39.523 43.040 53.288 1.00 138.86 ? 202 SER E O 1 ATOM 9672 C CB . SER F 3 202 ? 38.932 45.664 54.886 1.00 141.12 ? 202 SER E CB 1 ATOM 9673 O OG . SER F 3 202 ? 38.703 46.447 56.045 1.00 137.91 ? 202 SER E OG 1 ATOM 9674 N N . SER F 3 203 ? 41.517 44.067 53.513 1.00 134.49 ? 203 SER E N 1 ATOM 9675 C CA . SER F 3 203 ? 42.106 43.487 52.316 1.00 136.51 ? 203 SER E CA 1 ATOM 9676 C C . SER F 3 203 ? 43.608 43.302 52.514 1.00 134.00 ? 203 SER E C 1 ATOM 9677 O O . SER F 3 203 ? 44.236 44.067 53.247 1.00 132.91 ? 203 SER E O 1 ATOM 9678 C CB . SER F 3 203 ? 41.825 44.371 51.099 1.00 141.80 ? 203 SER E CB 1 ATOM 9679 O OG . SER F 3 203 ? 42.208 45.713 51.346 1.00 141.42 ? 203 SER E OG 1 ATOM 9680 N N . PRO F 3 204 ? 44.187 42.273 51.875 1.00 134.51 ? 204 PRO E N 1 ATOM 9681 C CA . PRO F 3 204 ? 45.630 42.021 51.965 1.00 132.28 ? 204 PRO E CA 1 ATOM 9682 C C . PRO F 3 204 ? 46.460 43.200 51.456 1.00 134.62 ? 204 PRO E C 1 ATOM 9683 O O . PRO F 3 204 ? 46.741 43.284 50.260 1.00 140.41 ? 204 PRO E O 1 ATOM 9684 C CB . PRO F 3 204 ? 45.827 40.789 51.077 1.00 133.09 ? 204 PRO E CB 1 ATOM 9685 C CG . PRO F 3 204 ? 44.498 40.117 51.061 1.00 135.24 ? 204 PRO E CG 1 ATOM 9686 C CD . PRO F 3 204 ? 43.494 41.228 51.102 1.00 137.66 ? 204 PRO E CD 1 ATOM 9687 N N . VAL F 3 205 ? 46.843 44.095 52.362 1.00 129.69 ? 205 VAL E N 1 ATOM 9688 C CA . VAL F 3 205 ? 47.593 45.294 52.001 1.00 125.96 ? 205 VAL E CA 1 ATOM 9689 C C . VAL F 3 205 ? 48.999 44.965 51.504 1.00 120.14 ? 205 VAL E C 1 ATOM 9690 O O . VAL F 3 205 ? 49.760 44.270 52.176 1.00 111.85 ? 205 VAL E O 1 ATOM 9691 C CB . VAL F 3 205 ? 47.697 46.269 53.192 1.00 123.59 ? 205 VAL E CB 1 ATOM 9692 C CG1 . VAL F 3 205 ? 48.628 47.426 52.859 1.00 123.34 ? 205 VAL E CG1 1 ATOM 9693 C CG2 . VAL F 3 205 ? 46.318 46.782 53.579 1.00 127.93 ? 205 VAL E CG2 1 ATOM 9694 N N . THR F 3 206 ? 49.333 45.473 50.321 1.00 123.43 ? 206 THR E N 1 ATOM 9695 C CA . THR F 3 206 ? 50.649 45.261 49.734 1.00 117.50 ? 206 THR E CA 1 ATOM 9696 C C . THR F 3 206 ? 51.507 46.516 49.835 1.00 114.18 ? 206 THR E C 1 ATOM 9697 O O . THR F 3 206 ? 51.026 47.628 49.621 1.00 116.76 ? 206 THR E O 1 ATOM 9698 C CB . THR F 3 206 ? 50.550 44.846 48.254 1.00 120.72 ? 206 THR E CB 1 ATOM 9699 O OG1 . THR F 3 206 ? 49.936 45.899 47.502 1.00 129.91 ? 206 THR E OG1 1 ATOM 9700 C CG2 . THR F 3 206 ? 49.725 43.579 48.106 1.00 120.27 ? 206 THR E CG2 1 ATOM 9701 N N . LYS F 3 207 ? 52.781 46.328 50.162 1.00 111.24 ? 207 LYS E N 1 ATOM 9702 C CA . LYS F 3 207 ? 53.737 47.428 50.222 1.00 108.89 ? 207 LYS E CA 1 ATOM 9703 C C . LYS F 3 207 ? 55.022 47.020 49.509 1.00 104.87 ? 207 LYS E C 1 ATOM 9704 O O . LYS F 3 207 ? 55.734 46.128 49.966 1.00 101.42 ? 207 LYS E O 1 ATOM 9705 C CB . LYS F 3 207 ? 54.020 47.820 51.674 1.00 107.12 ? 207 LYS E CB 1 ATOM 9706 C CG . LYS F 3 207 ? 54.868 49.073 51.832 1.00 108.25 ? 207 LYS E CG 1 ATOM 9707 C CD . LYS F 3 207 ? 54.168 50.299 51.263 1.00 113.76 ? 207 LYS E CD 1 ATOM 9708 C CE . LYS F 3 207 ? 52.863 50.579 51.991 1.00 117.02 ? 207 LYS E CE 1 ATOM 9709 N NZ . LYS F 3 207 ? 53.072 50.769 53.453 1.00 112.21 ? 207 LYS E NZ 1 ATOM 9710 N N . SER F 3 208 ? 55.315 47.670 48.388 1.00 105.08 ? 208 SER E N 1 ATOM 9711 C CA . SER F 3 208 ? 56.422 47.240 47.542 1.00 105.01 ? 208 SER E CA 1 ATOM 9712 C C . SER F 3 208 ? 57.320 48.383 47.080 1.00 104.40 ? 208 SER E C 1 ATOM 9713 O O . SER F 3 208 ? 57.127 49.542 47.448 1.00 103.58 ? 208 SER E O 1 ATOM 9714 C CB . SER F 3 208 ? 55.882 46.502 46.315 1.00 101.48 ? 208 SER E CB 1 ATOM 9715 O OG . SER F 3 208 ? 55.294 47.403 45.395 1.00 106.21 ? 208 SER E OG 1 ATOM 9716 N N . PHE F 3 209 ? 58.303 48.030 46.258 1.00 105.23 ? 209 PHE E N 1 ATOM 9717 C CA . PHE F 3 209 ? 59.189 48.997 45.627 1.00 106.88 ? 209 PHE E CA 1 ATOM 9718 C C . PHE F 3 209 ? 59.806 48.386 44.373 1.00 115.96 ? 209 PHE E C 1 ATOM 9719 O O . PHE F 3 209 ? 59.589 47.210 44.071 1.00 115.67 ? 209 PHE E O 1 ATOM 9720 C CB . PHE F 3 209 ? 60.289 49.452 46.594 1.00 97.65 ? 209 PHE E CB 1 ATOM 9721 C CG . PHE F 3 209 ? 61.339 48.407 46.856 1.00 94.77 ? 209 PHE E CG 1 ATOM 9722 C CD1 . PHE F 3 209 ? 62.516 48.384 46.122 1.00 92.48 ? 209 PHE E CD1 1 ATOM 9723 C CD2 . PHE F 3 209 ? 61.150 47.450 47.838 1.00 92.24 ? 209 PHE E CD2 1 ATOM 9724 C CE1 . PHE F 3 209 ? 63.478 47.424 46.359 1.00 87.64 ? 209 PHE E CE1 1 ATOM 9725 C CE2 . PHE F 3 209 ? 62.109 46.489 48.081 1.00 86.90 ? 209 PHE E CE2 1 ATOM 9726 C CZ . PHE F 3 209 ? 63.274 46.476 47.340 1.00 84.29 ? 209 PHE E CZ 1 ATOM 9727 N N . ASN F 3 210 ? 60.582 49.190 43.653 1.00 123.88 ? 210 ASN E N 1 ATOM 9728 C CA . ASN F 3 210 ? 61.275 48.726 42.460 1.00 125.95 ? 210 ASN E CA 1 ATOM 9729 C C . ASN F 3 210 ? 62.783 48.846 42.614 1.00 121.21 ? 210 ASN E C 1 ATOM 9730 O O . ASN F 3 210 ? 63.282 49.823 43.175 1.00 117.85 ? 210 ASN E O 1 ATOM 9731 C CB . ASN F 3 210 ? 60.824 49.515 41.232 1.00 132.97 ? 210 ASN E CB 1 ATOM 9732 C CG . ASN F 3 210 ? 59.325 49.491 41.042 1.00 139.87 ? 210 ASN E CG 1 ATOM 9733 O OD1 . ASN F 3 210 ? 58.773 48.528 40.511 1.00 143.81 ? 210 ASN E OD1 1 ATOM 9734 N ND2 . ASN F 3 210 ? 58.655 50.553 41.475 1.00 141.08 ? 210 ASN E ND2 1 ATOM 9735 N N . ARG F 3 211 ? 63.509 47.855 42.107 1.00 118.52 ? 211 ARG E N 1 ATOM 9736 C CA . ARG F 3 211 ? 64.964 47.874 42.192 1.00 108.89 ? 211 ARG E CA 1 ATOM 9737 C C . ARG F 3 211 ? 65.556 48.975 41.325 1.00 105.53 ? 211 ARG E C 1 ATOM 9738 O O . ARG F 3 211 ? 66.451 49.696 41.759 1.00 100.98 ? 211 ARG E O 1 ATOM 9739 C CB . ARG F 3 211 ? 65.558 46.525 41.786 1.00 107.85 ? 211 ARG E CB 1 ATOM 9740 C CG . ARG F 3 211 ? 67.074 46.540 41.695 1.00 104.09 ? 211 ARG E CG 1 ATOM 9741 C CD . ARG F 3 211 ? 67.605 45.170 41.345 1.00 103.56 ? 211 ARG E CD 1 ATOM 9742 N NE . ARG F 3 211 ? 68.465 45.218 40.161 1.00 105.67 ? 211 ARG E NE 1 ATOM 9743 C CZ . ARG F 3 211 ? 68.193 44.619 39.000 1.00 109.34 ? 211 ARG E CZ 1 ATOM 9744 N NH1 . ARG F 3 211 ? 67.087 43.893 38.844 1.00 112.61 ? 211 ARG E NH1 1 ATOM 9745 N NH2 . ARG F 3 211 ? 69.040 44.728 37.987 1.00 110.56 ? 211 ARG E NH2 1 HETATM 9746 C C1 . NAG G 4 . ? 1.249 108.472 59.277 1.00 64.94 ? 701 NAG A C1 1 HETATM 9747 C C2 . NAG G 4 . ? 0.495 109.787 59.479 1.00 71.50 ? 701 NAG A C2 1 HETATM 9748 C C3 . NAG G 4 . ? -0.782 109.798 58.643 1.00 76.09 ? 701 NAG A C3 1 HETATM 9749 C C4 . NAG G 4 . ? -0.469 109.488 57.184 1.00 77.38 ? 701 NAG A C4 1 HETATM 9750 C C5 . NAG G 4 . ? 0.332 108.194 57.074 1.00 75.97 ? 701 NAG A C5 1 HETATM 9751 C C6 . NAG G 4 . ? 0.798 107.909 55.665 1.00 76.58 ? 701 NAG A C6 1 HETATM 9752 C C7 . NAG G 4 . ? 0.745 110.971 61.614 1.00 71.01 ? 701 NAG A C7 1 HETATM 9753 C C8 . NAG G 4 . ? 0.301 111.055 63.042 1.00 68.09 ? 701 NAG A C8 1 HETATM 9754 N N2 . NAG G 4 . ? 0.184 110.003 60.883 1.00 69.22 ? 701 NAG A N2 1 HETATM 9755 O O3 . NAG G 4 . ? -1.399 111.075 58.747 1.00 78.91 ? 701 NAG A O3 1 HETATM 9756 O O4 . NAG G 4 . ? -1.680 109.351 56.449 1.00 76.08 ? 701 NAG A O4 1 HETATM 9757 O O5 . NAG G 4 . ? 1.513 108.282 57.886 1.00 73.84 ? 701 NAG A O5 1 HETATM 9758 O O6 . NAG G 4 . ? 0.126 106.787 55.111 1.00 78.88 ? 701 NAG A O6 1 HETATM 9759 O O7 . NAG G 4 . ? 1.576 111.743 61.144 1.00 74.49 ? 701 NAG A O7 1 HETATM 9760 C C1 . NAG H 4 . ? 5.859 106.087 44.879 1.00 79.50 ? 702 NAG A C1 1 HETATM 9761 C C2 . NAG H 4 . ? 4.758 107.127 45.084 1.00 84.98 ? 702 NAG A C2 1 HETATM 9762 C C3 . NAG H 4 . ? 3.721 106.605 46.076 1.00 92.24 ? 702 NAG A C3 1 HETATM 9763 C C4 . NAG H 4 . ? 3.209 105.238 45.644 1.00 94.04 ? 702 NAG A C4 1 HETATM 9764 C C5 . NAG H 4 . ? 4.380 104.286 45.415 1.00 90.48 ? 702 NAG A C5 1 HETATM 9765 C C6 . NAG H 4 . ? 3.953 102.938 44.881 1.00 87.38 ? 702 NAG A C6 1 HETATM 9766 C C7 . NAG H 4 . ? 5.631 109.393 44.710 1.00 87.66 ? 702 NAG A C7 1 HETATM 9767 C C8 . NAG H 4 . ? 6.192 110.624 45.354 1.00 87.77 ? 702 NAG A C8 1 HETATM 9768 N N2 . NAG H 4 . ? 5.310 108.391 45.538 1.00 86.47 ? 702 NAG A N2 1 HETATM 9769 O O3 . NAG H 4 . ? 2.639 107.527 46.160 1.00 97.25 ? 702 NAG A O3 1 HETATM 9770 O O4 . NAG H 4 . ? 2.356 104.697 46.647 1.00 97.66 ? 702 NAG A O4 1 HETATM 9771 O O5 . NAG H 4 . ? 5.282 104.850 44.451 1.00 86.75 ? 702 NAG A O5 1 HETATM 9772 O O6 . NAG H 4 . ? 3.493 102.087 45.922 1.00 83.75 ? 702 NAG A O6 1 HETATM 9773 O O7 . NAG H 4 . ? 5.477 109.307 43.496 1.00 87.23 ? 702 NAG A O7 1 HETATM 9774 C C1 . GOL I 5 . ? 53.507 54.169 15.327 1.00 56.49 ? 500 GOL L C1 1 HETATM 9775 O O1 . GOL I 5 . ? 54.413 54.038 16.397 1.00 53.43 ? 500 GOL L O1 1 HETATM 9776 C C2 . GOL I 5 . ? 54.121 53.535 14.088 1.00 61.22 ? 500 GOL L C2 1 HETATM 9777 O O2 . GOL I 5 . ? 53.354 52.416 13.706 1.00 68.44 ? 500 GOL L O2 1 HETATM 9778 C C3 . GOL I 5 . ? 54.145 54.551 12.955 1.00 56.10 ? 500 GOL L C3 1 HETATM 9779 O O3 . GOL I 5 . ? 54.876 54.018 11.876 1.00 55.72 ? 500 GOL L O3 1 HETATM 9780 C C1 . GOL J 5 . ? 59.959 69.226 39.583 1.00 71.24 ? 501 GOL L C1 1 HETATM 9781 O O1 . GOL J 5 . ? 58.589 68.903 39.500 1.00 71.58 ? 501 GOL L O1 1 HETATM 9782 C C2 . GOL J 5 . ? 60.166 70.623 39.016 1.00 67.11 ? 501 GOL L C2 1 HETATM 9783 O O2 . GOL J 5 . ? 61.043 71.345 39.849 1.00 70.28 ? 501 GOL L O2 1 HETATM 9784 C C3 . GOL J 5 . ? 60.776 70.516 37.626 1.00 59.49 ? 501 GOL L C3 1 HETATM 9785 O O3 . GOL J 5 . ? 60.725 71.783 37.014 1.00 60.21 ? 501 GOL L O3 1 HETATM 9786 C C1 . NAG K 4 . ? 54.594 -27.508 120.102 1.00 49.54 ? 701 NAG B C1 1 HETATM 9787 C C2 . NAG K 4 . ? 53.606 -28.558 120.604 1.00 56.87 ? 701 NAG B C2 1 HETATM 9788 C C3 . NAG K 4 . ? 53.826 -29.880 119.872 1.00 60.34 ? 701 NAG B C3 1 HETATM 9789 C C4 . NAG K 4 . ? 53.779 -29.669 118.366 1.00 62.86 ? 701 NAG B C4 1 HETATM 9790 C C5 . NAG K 4 . ? 54.771 -28.582 117.962 1.00 64.60 ? 701 NAG B C5 1 HETATM 9791 C C6 . NAG K 4 . ? 54.702 -28.233 116.493 1.00 70.77 ? 701 NAG B C6 1 HETATM 9792 C C7 . NAG K 4 . ? 52.681 -28.636 122.877 1.00 61.04 ? 701 NAG B C7 1 HETATM 9793 C C8 . NAG K 4 . ? 51.358 -28.315 122.248 1.00 61.29 ? 701 NAG B C8 1 HETATM 9794 N N2 . NAG K 4 . ? 53.718 -28.742 122.038 1.00 57.41 ? 701 NAG B N2 1 HETATM 9795 O O3 . NAG K 4 . ? 52.818 -30.805 120.263 1.00 61.73 ? 701 NAG B O3 1 HETATM 9796 O O4 . NAG K 4 . ? 54.104 -30.881 117.694 1.00 64.45 ? 701 NAG B O4 1 HETATM 9797 O O5 . NAG K 4 . ? 54.486 -27.374 118.685 1.00 59.43 ? 701 NAG B O5 1 HETATM 9798 O O6 . NAG K 4 . ? 55.265 -29.258 115.686 1.00 78.51 ? 701 NAG B O6 1 HETATM 9799 O O7 . NAG K 4 . ? 52.804 -28.790 124.086 1.00 67.38 ? 701 NAG B O7 1 HETATM 9800 C C1 . NAG L 4 . ? 53.749 -27.490 106.226 1.00 71.26 ? 702 NAG B C1 1 HETATM 9801 C C2 . NAG L 4 . ? 55.183 -28.017 106.219 1.00 82.79 ? 702 NAG B C2 1 HETATM 9802 C C3 . NAG L 4 . ? 55.275 -29.338 106.980 1.00 87.61 ? 702 NAG B C3 1 HETATM 9803 C C4 . NAG L 4 . ? 54.681 -29.190 108.373 1.00 85.39 ? 702 NAG B C4 1 HETATM 9804 C C5 . NAG L 4 . ? 53.258 -28.657 108.266 1.00 83.03 ? 702 NAG B C5 1 HETATM 9805 C C6 . NAG L 4 . ? 52.620 -28.390 109.610 1.00 86.73 ? 702 NAG B C6 1 HETATM 9806 C C7 . NAG L 4 . ? 56.627 -27.404 104.329 1.00 85.16 ? 702 NAG B C7 1 HETATM 9807 C C8 . NAG L 4 . ? 57.007 -27.708 102.911 1.00 82.99 ? 702 NAG B C8 1 HETATM 9808 N N2 . NAG L 4 . ? 55.672 -28.176 104.859 1.00 86.08 ? 702 NAG B N2 1 HETATM 9809 O O3 . NAG L 4 . ? 56.641 -29.728 107.074 1.00 92.59 ? 702 NAG B O3 1 HETATM 9810 O O4 . NAG L 4 . ? 54.670 -30.447 109.040 1.00 87.08 ? 702 NAG B O4 1 HETATM 9811 O O5 . NAG L 4 . ? 53.272 -27.406 107.564 1.00 76.15 ? 702 NAG B O5 1 HETATM 9812 O O6 . NAG L 4 . ? 51.648 -27.356 109.524 1.00 85.64 ? 702 NAG B O6 1 HETATM 9813 O O7 . NAG L 4 . ? 57.161 -26.501 104.966 1.00 85.99 ? 702 NAG B O7 1 HETATM 9814 O O . HOH M 6 . ? 40.420 80.400 65.320 1.00 44.67 ? 801 HOH A O 1 HETATM 9815 O O . HOH M 6 . ? -6.116 93.376 65.970 1.00 34.92 ? 802 HOH A O 1 HETATM 9816 O O . HOH M 6 . ? 20.124 99.586 42.932 1.00 55.12 ? 803 HOH A O 1 HETATM 9817 O O . HOH M 6 . ? -0.702 87.575 61.231 1.00 64.61 ? 804 HOH A O 1 HETATM 9818 O O . HOH M 6 . ? 24.723 69.391 57.247 1.00 59.40 ? 805 HOH A O 1 HETATM 9819 O O . HOH M 6 . ? 0.706 90.814 71.915 1.00 45.91 ? 806 HOH A O 1 HETATM 9820 O O . HOH M 6 . ? 11.012 86.558 44.213 1.00 46.42 ? 807 HOH A O 1 HETATM 9821 O O . HOH M 6 . ? 17.840 93.185 38.081 1.00 57.64 ? 808 HOH A O 1 HETATM 9822 O O . HOH M 6 . ? 38.945 75.851 74.388 1.00 61.38 ? 809 HOH A O 1 HETATM 9823 O O . HOH M 6 . ? 12.985 84.298 42.828 1.00 39.84 ? 810 HOH A O 1 HETATM 9824 O O . HOH M 6 . ? -0.898 99.778 73.974 1.00 45.27 ? 811 HOH A O 1 HETATM 9825 O O . HOH M 6 . ? 11.519 90.037 38.473 1.00 51.02 ? 812 HOH A O 1 HETATM 9826 O O . HOH M 6 . ? 22.994 73.899 66.843 1.00 52.12 ? 813 HOH A O 1 HETATM 9827 O O . HOH M 6 . ? 24.292 75.645 67.755 1.00 72.01 ? 814 HOH A O 1 HETATM 9828 O O . HOH M 6 . ? 34.987 73.019 65.393 1.00 49.94 ? 815 HOH A O 1 HETATM 9829 O O . HOH M 6 . ? 25.155 90.465 53.605 1.00 47.43 ? 816 HOH A O 1 HETATM 9830 O O . HOH M 6 . ? 5.048 87.415 56.241 1.00 47.08 ? 817 HOH A O 1 HETATM 9831 O O . HOH M 6 . ? 7.741 92.057 43.702 1.00 49.27 ? 818 HOH A O 1 HETATM 9832 O O . HOH M 6 . ? 1.746 103.576 63.228 1.00 37.75 ? 819 HOH A O 1 HETATM 9833 O O . HOH M 6 . ? 26.812 93.239 49.834 1.00 66.25 ? 820 HOH A O 1 HETATM 9834 O O . HOH M 6 . ? 12.681 88.324 67.170 1.00 47.92 ? 821 HOH A O 1 HETATM 9835 O O . HOH M 6 . ? 0.678 106.152 63.659 1.00 55.17 ? 822 HOH A O 1 HETATM 9836 O O . HOH M 6 . ? 29.076 87.902 56.513 1.00 45.67 ? 823 HOH A O 1 HETATM 9837 O O . HOH M 6 . ? 11.411 107.582 58.994 1.00 60.30 ? 824 HOH A O 1 HETATM 9838 O O . HOH M 6 . ? 30.464 77.728 66.943 1.00 48.19 ? 825 HOH A O 1 HETATM 9839 O O . HOH M 6 . ? 12.726 91.134 65.090 1.00 60.31 ? 826 HOH A O 1 HETATM 9840 O O . HOH M 6 . ? 25.842 92.627 46.194 1.00 45.67 ? 827 HOH A O 1 HETATM 9841 O O . HOH M 6 . ? 6.858 81.049 61.242 1.00 57.17 ? 828 HOH A O 1 HETATM 9842 O O . HOH M 6 . ? 31.447 83.159 47.360 1.00 38.50 ? 829 HOH A O 1 HETATM 9843 O O . HOH M 6 . ? 34.484 86.490 54.408 1.00 46.09 ? 830 HOH A O 1 HETATM 9844 O O . HOH M 6 . ? 10.558 89.703 49.994 1.00 40.48 ? 831 HOH A O 1 HETATM 9845 O O . HOH M 6 . ? 10.886 102.948 75.446 1.00 67.00 ? 832 HOH A O 1 HETATM 9846 O O . HOH M 6 . ? 30.134 76.862 69.350 1.00 56.51 ? 833 HOH A O 1 HETATM 9847 O O . HOH M 6 . ? 17.416 76.470 67.993 1.00 52.39 ? 834 HOH A O 1 HETATM 9848 O O . HOH M 6 . ? 33.014 87.777 56.367 1.00 52.20 ? 835 HOH A O 1 HETATM 9849 O O . HOH M 6 . ? 41.857 78.274 57.512 1.00 44.05 ? 836 HOH A O 1 HETATM 9850 O O . HOH M 6 . ? 40.881 77.602 55.507 1.00 48.93 ? 837 HOH A O 1 HETATM 9851 O O . HOH M 6 . ? 25.846 81.408 40.622 1.00 43.00 ? 838 HOH A O 1 HETATM 9852 O O . HOH M 6 . ? 25.540 67.509 55.349 1.00 69.20 ? 839 HOH A O 1 HETATM 9853 O O . HOH M 6 . ? 43.199 73.264 65.273 1.00 61.37 ? 840 HOH A O 1 HETATM 9854 O O . HOH M 6 . ? 43.899 76.122 52.495 1.00 60.52 ? 841 HOH A O 1 HETATM 9855 O O . HOH M 6 . ? 15.238 91.394 72.413 1.00 69.32 ? 842 HOH A O 1 HETATM 9856 O O . HOH M 6 . ? 13.398 89.056 71.833 1.00 54.00 ? 843 HOH A O 1 HETATM 9857 O O . HOH M 6 . ? 8.157 83.969 65.650 1.00 62.19 ? 844 HOH A O 1 HETATM 9858 O O . HOH M 6 . ? 11.449 83.323 62.193 1.00 53.30 ? 845 HOH A O 1 HETATM 9859 O O . HOH M 6 . ? 13.963 84.806 73.075 1.00 52.73 ? 846 HOH A O 1 HETATM 9860 O O . HOH M 6 . ? 13.008 82.895 72.036 1.00 61.47 ? 847 HOH A O 1 HETATM 9861 O O . HOH M 6 . ? 28.570 84.244 38.071 1.00 63.92 ? 848 HOH A O 1 HETATM 9862 O O . HOH N 6 . ? 25.096 71.858 41.724 1.00 64.58 ? 301 HOH H O 1 HETATM 9863 O O . HOH N 6 . ? 63.554 38.500 26.707 1.00 45.41 ? 302 HOH H O 1 HETATM 9864 O O . HOH N 6 . ? 72.732 53.396 20.119 1.00 50.97 ? 303 HOH H O 1 HETATM 9865 O O . HOH N 6 . ? 25.672 67.270 24.713 1.00 56.81 ? 304 HOH H O 1 HETATM 9866 O O . HOH N 6 . ? 68.447 31.939 11.248 1.00 66.26 ? 305 HOH H O 1 HETATM 9867 O O . HOH N 6 . ? 25.041 75.999 35.353 1.00 55.90 ? 306 HOH H O 1 HETATM 9868 O O . HOH N 6 . ? 25.875 60.440 34.224 1.00 46.73 ? 307 HOH H O 1 HETATM 9869 O O . HOH N 6 . ? 26.144 67.727 22.434 1.00 52.91 ? 308 HOH H O 1 HETATM 9870 O O . HOH N 6 . ? 24.664 55.460 21.451 1.00 64.48 ? 309 HOH H O 1 HETATM 9871 O O . HOH N 6 . ? 41.376 67.550 26.595 1.00 31.47 ? 310 HOH H O 1 HETATM 9872 O O . HOH N 6 . ? 38.928 72.601 49.266 1.00 39.53 ? 311 HOH H O 1 HETATM 9873 O O . HOH N 6 . ? 51.377 52.315 24.360 1.00 46.99 ? 312 HOH H O 1 HETATM 9874 O O . HOH N 6 . ? 30.437 75.994 32.942 1.00 43.00 ? 313 HOH H O 1 HETATM 9875 O O . HOH N 6 . ? 48.753 60.393 33.816 1.00 52.02 ? 314 HOH H O 1 HETATM 9876 O O . HOH N 6 . ? 43.082 53.550 23.818 1.00 29.24 ? 315 HOH H O 1 HETATM 9877 O O . HOH N 6 . ? 49.970 64.894 43.515 1.00 38.15 ? 316 HOH H O 1 HETATM 9878 O O . HOH N 6 . ? 48.205 42.026 11.672 1.00 58.05 ? 317 HOH H O 1 HETATM 9879 O O . HOH N 6 . ? 50.433 69.196 50.185 1.00 58.03 ? 318 HOH H O 1 HETATM 9880 O O . HOH N 6 . ? 49.641 71.182 49.357 1.00 43.84 ? 319 HOH H O 1 HETATM 9881 O O . HOH N 6 . ? 35.281 49.455 23.061 1.00 47.78 ? 320 HOH H O 1 HETATM 9882 O O . HOH N 6 . ? 39.295 52.749 18.277 1.00 41.88 ? 321 HOH H O 1 HETATM 9883 O O . HOH N 6 . ? 27.447 62.249 47.002 1.00 34.60 ? 322 HOH H O 1 HETATM 9884 O O . HOH N 6 . ? 39.168 62.562 22.409 1.00 46.45 ? 323 HOH H O 1 HETATM 9885 O O . HOH N 6 . ? 51.152 54.941 22.706 1.00 46.76 ? 324 HOH H O 1 HETATM 9886 O O . HOH N 6 . ? 41.273 52.746 28.148 1.00 36.64 ? 325 HOH H O 1 HETATM 9887 O O . HOH N 6 . ? 30.605 49.242 26.739 1.00 51.62 ? 326 HOH H O 1 HETATM 9888 O O . HOH N 6 . ? 28.031 57.074 44.347 1.00 51.28 ? 327 HOH H O 1 HETATM 9889 O O . HOH N 6 . ? 38.507 56.343 20.634 1.00 55.43 ? 328 HOH H O 1 HETATM 9890 O O . HOH N 6 . ? 70.297 42.300 2.969 1.00 61.39 ? 329 HOH H O 1 HETATM 9891 O O . HOH N 6 . ? 36.157 48.614 30.967 1.00 52.93 ? 330 HOH H O 1 HETATM 9892 O O . HOH N 6 . ? 38.599 67.717 26.160 1.00 56.17 ? 331 HOH H O 1 HETATM 9893 O O . HOH N 6 . ? 48.859 73.279 52.675 1.00 59.68 ? 332 HOH H O 1 HETATM 9894 O O . HOH N 6 . ? 29.254 59.760 40.775 1.00 57.89 ? 333 HOH H O 1 HETATM 9895 O O . HOH N 6 . ? 27.626 57.916 49.277 1.00 49.25 ? 334 HOH H O 1 HETATM 9896 O O . HOH N 6 . ? 26.785 59.503 47.621 1.00 46.24 ? 335 HOH H O 1 HETATM 9897 O O . HOH N 6 . ? 76.563 40.323 22.734 1.00 59.32 ? 336 HOH H O 1 HETATM 9898 O O . HOH N 6 . ? 28.599 56.853 47.027 1.00 63.12 ? 337 HOH H O 1 HETATM 9899 O O . HOH N 6 . ? 30.510 67.508 25.535 1.00 45.33 ? 338 HOH H O 1 HETATM 9900 O O . HOH N 6 . ? 69.483 40.249 2.165 1.00 68.44 ? 339 HOH H O 1 HETATM 9901 O O . HOH N 6 . ? 34.403 72.418 24.182 1.00 64.27 ? 340 HOH H O 1 HETATM 9902 O O . HOH N 6 . ? 43.923 47.706 11.180 1.00 48.83 ? 341 HOH H O 1 HETATM 9903 O O . HOH N 6 . ? 32.212 65.657 24.618 1.00 76.07 ? 342 HOH H O 1 HETATM 9904 O O . HOH N 6 . ? 34.259 47.628 25.226 1.00 54.52 ? 343 HOH H O 1 HETATM 9905 O O . HOH N 6 . ? 27.543 75.059 41.503 1.00 43.29 ? 344 HOH H O 1 HETATM 9906 O O . HOH N 6 . ? 25.991 64.104 45.854 1.00 46.08 ? 345 HOH H O 1 HETATM 9907 O O . HOH N 6 . ? 71.989 49.051 27.759 1.00 71.41 ? 346 HOH H O 1 HETATM 9908 O O . HOH N 6 . ? 62.514 56.704 23.051 1.00 49.55 ? 347 HOH H O 1 HETATM 9909 O O . HOH N 6 . ? 49.539 57.695 20.611 1.00 50.59 ? 348 HOH H O 1 HETATM 9910 O O . HOH N 6 . ? 44.819 53.677 8.491 1.00 53.80 ? 349 HOH H O 1 HETATM 9911 O O . HOH N 6 . ? 47.401 56.374 34.047 1.00 56.15 ? 350 HOH H O 1 HETATM 9912 O O . HOH N 6 . ? 35.367 73.315 31.457 1.00 43.25 ? 351 HOH H O 1 HETATM 9913 O O . HOH N 6 . ? 34.497 74.523 29.769 1.00 48.54 ? 352 HOH H O 1 HETATM 9914 O O . HOH N 6 . ? 36.358 83.307 51.096 1.00 56.76 ? 353 HOH H O 1 HETATM 9915 O O . HOH N 6 . ? 27.776 75.811 37.076 1.00 53.82 ? 354 HOH H O 1 HETATM 9916 O O . HOH N 6 . ? 34.258 88.806 47.753 1.00 62.25 ? 355 HOH H O 1 HETATM 9917 O O . HOH N 6 . ? 46.818 72.659 52.287 1.00 58.07 ? 356 HOH H O 1 HETATM 9918 O O . HOH O 6 . ? 68.832 67.748 36.571 1.00 64.80 ? 601 HOH L O 1 HETATM 9919 O O . HOH O 6 . ? 64.980 61.897 -2.751 1.00 70.15 ? 602 HOH L O 1 HETATM 9920 O O . HOH O 6 . ? 49.423 83.219 49.293 1.00 43.31 ? 603 HOH L O 1 HETATM 9921 O O . HOH O 6 . ? 66.212 80.276 42.617 1.00 30.98 ? 604 HOH L O 1 HETATM 9922 O O . HOH O 6 . ? 69.068 71.231 39.113 1.00 49.97 ? 605 HOH L O 1 HETATM 9923 O O . HOH O 6 . ? 58.770 87.328 38.417 1.00 60.62 ? 606 HOH L O 1 HETATM 9924 O O . HOH O 6 . ? 53.166 77.196 49.815 1.00 37.14 ? 607 HOH L O 1 HETATM 9925 O O . HOH O 6 . ? 50.985 89.124 42.077 1.00 62.24 ? 608 HOH L O 1 HETATM 9926 O O . HOH O 6 . ? 67.416 83.852 28.201 1.00 55.54 ? 609 HOH L O 1 HETATM 9927 O O . HOH O 6 . ? 58.860 75.204 49.740 1.00 44.82 ? 610 HOH L O 1 HETATM 9928 O O . HOH O 6 . ? 65.772 81.901 40.921 1.00 37.91 ? 611 HOH L O 1 HETATM 9929 O O . HOH O 6 . ? 63.141 83.210 40.446 1.00 34.64 ? 612 HOH L O 1 HETATM 9930 O O . HOH O 6 . ? 71.990 79.265 29.149 1.00 38.45 ? 613 HOH L O 1 HETATM 9931 O O . HOH O 6 . ? 59.820 76.316 47.979 1.00 43.81 ? 614 HOH L O 1 HETATM 9932 O O . HOH O 6 . ? 48.913 49.584 -4.841 1.00 72.46 ? 615 HOH L O 1 HETATM 9933 O O . HOH O 6 . ? 64.133 76.368 46.483 1.00 49.51 ? 616 HOH L O 1 HETATM 9934 O O . HOH O 6 . ? 73.089 66.102 4.086 1.00 58.75 ? 617 HOH L O 1 HETATM 9935 O O . HOH O 6 . ? 70.009 56.041 29.145 1.00 68.76 ? 618 HOH L O 1 HETATM 9936 O O . HOH O 6 . ? 74.111 63.659 19.423 1.00 55.89 ? 619 HOH L O 1 HETATM 9937 O O . HOH O 6 . ? 62.309 75.853 48.246 1.00 62.36 ? 620 HOH L O 1 HETATM 9938 O O . HOH O 6 . ? 53.422 90.616 42.329 1.00 58.89 ? 621 HOH L O 1 HETATM 9939 O O . HOH O 6 . ? 57.547 66.230 12.395 1.00 39.26 ? 622 HOH L O 1 HETATM 9940 O O . HOH O 6 . ? 44.010 73.398 28.338 1.00 34.75 ? 623 HOH L O 1 HETATM 9941 O O . HOH O 6 . ? 54.103 66.247 35.681 1.00 35.10 ? 624 HOH L O 1 HETATM 9942 O O . HOH O 6 . ? 50.458 63.624 30.724 1.00 45.67 ? 625 HOH L O 1 HETATM 9943 O O . HOH O 6 . ? 62.042 71.416 17.396 1.00 33.69 ? 626 HOH L O 1 HETATM 9944 O O . HOH O 6 . ? 56.204 65.169 10.565 1.00 56.02 ? 627 HOH L O 1 HETATM 9945 O O . HOH O 6 . ? 65.726 60.742 19.389 1.00 29.73 ? 628 HOH L O 1 HETATM 9946 O O . HOH O 6 . ? 50.340 63.599 28.506 1.00 56.40 ? 629 HOH L O 1 HETATM 9947 O O . HOH O 6 . ? 33.499 72.165 43.216 1.00 37.62 ? 630 HOH L O 1 HETATM 9948 O O . HOH O 6 . ? 48.850 42.565 9.479 1.00 51.66 ? 631 HOH L O 1 HETATM 9949 O O . HOH O 6 . ? 57.719 64.837 20.253 1.00 37.63 ? 632 HOH L O 1 HETATM 9950 O O . HOH O 6 . ? 62.211 83.554 37.858 1.00 44.17 ? 633 HOH L O 1 HETATM 9951 O O . HOH O 6 . ? 45.384 79.630 25.622 1.00 38.10 ? 634 HOH L O 1 HETATM 9952 O O . HOH O 6 . ? 49.083 85.656 26.578 1.00 39.10 ? 635 HOH L O 1 HETATM 9953 O O . HOH O 6 . ? 63.680 70.197 8.895 1.00 43.28 ? 636 HOH L O 1 HETATM 9954 O O . HOH O 6 . ? 59.726 69.197 26.373 1.00 55.82 ? 637 HOH L O 1 HETATM 9955 O O . HOH O 6 . ? 43.767 82.758 44.742 1.00 39.29 ? 638 HOH L O 1 HETATM 9956 O O . HOH O 6 . ? 46.527 93.095 35.057 1.00 65.28 ? 639 HOH L O 1 HETATM 9957 O O . HOH O 6 . ? 56.953 86.203 36.478 1.00 53.21 ? 640 HOH L O 1 HETATM 9958 O O . HOH O 6 . ? 41.974 75.126 27.182 1.00 58.29 ? 641 HOH L O 1 HETATM 9959 O O . HOH O 6 . ? 53.534 61.934 16.757 1.00 33.37 ? 642 HOH L O 1 HETATM 9960 O O . HOH O 6 . ? 73.844 66.664 10.895 1.00 42.77 ? 643 HOH L O 1 HETATM 9961 O O . HOH O 6 . ? 73.408 76.951 24.711 1.00 43.18 ? 644 HOH L O 1 HETATM 9962 O O . HOH O 6 . ? 54.820 67.864 27.311 1.00 46.77 ? 645 HOH L O 1 HETATM 9963 O O . HOH O 6 . ? 55.361 63.528 7.171 1.00 59.14 ? 646 HOH L O 1 HETATM 9964 O O . HOH O 6 . ? 59.091 73.228 17.745 1.00 64.15 ? 647 HOH L O 1 HETATM 9965 O O . HOH O 6 . ? 63.463 60.794 21.305 1.00 33.70 ? 648 HOH L O 1 HETATM 9966 O O . HOH O 6 . ? 66.730 71.376 3.437 1.00 55.99 ? 649 HOH L O 1 HETATM 9967 O O . HOH O 6 . ? 50.983 65.913 41.197 1.00 46.97 ? 650 HOH L O 1 HETATM 9968 O O . HOH O 6 . ? 64.438 60.870 27.130 1.00 55.02 ? 651 HOH L O 1 HETATM 9969 O O . HOH O 6 . ? 59.568 75.160 20.024 1.00 63.14 ? 652 HOH L O 1 HETATM 9970 O O . HOH O 6 . ? 35.739 87.698 42.167 1.00 54.45 ? 653 HOH L O 1 HETATM 9971 O O . HOH O 6 . ? 68.088 56.234 30.495 1.00 66.12 ? 654 HOH L O 1 HETATM 9972 O O . HOH O 6 . ? 40.812 91.823 39.225 1.00 49.35 ? 655 HOH L O 1 HETATM 9973 O O . HOH O 6 . ? 36.518 89.626 41.234 1.00 57.42 ? 656 HOH L O 1 HETATM 9974 O O . HOH O 6 . ? 51.241 84.340 38.005 1.00 37.34 ? 657 HOH L O 1 HETATM 9975 O O . HOH O 6 . ? 50.895 69.112 42.521 1.00 43.68 ? 658 HOH L O 1 HETATM 9976 O O . HOH O 6 . ? 53.273 70.290 43.510 1.00 39.30 ? 659 HOH L O 1 HETATM 9977 O O . HOH O 6 . ? 71.356 56.523 14.656 1.00 61.80 ? 660 HOH L O 1 HETATM 9978 O O . HOH O 6 . ? 55.096 63.288 20.370 1.00 55.79 ? 661 HOH L O 1 HETATM 9979 O O . HOH O 6 . ? 51.311 60.560 15.288 1.00 61.76 ? 662 HOH L O 1 HETATM 9980 O O . HOH O 6 . ? 52.283 50.915 12.403 1.00 49.39 ? 663 HOH L O 1 HETATM 9981 O O . HOH O 6 . ? 61.009 73.695 16.249 1.00 56.89 ? 664 HOH L O 1 HETATM 9982 O O . HOH O 6 . ? 60.714 83.696 26.462 1.00 48.26 ? 665 HOH L O 1 HETATM 9983 O O . HOH O 6 . ? 62.155 66.767 27.808 1.00 69.03 ? 666 HOH L O 1 HETATM 9984 O O . HOH O 6 . ? 50.496 68.332 28.286 1.00 47.33 ? 667 HOH L O 1 HETATM 9985 O O . HOH O 6 . ? 70.830 58.757 6.016 1.00 48.29 ? 668 HOH L O 1 HETATM 9986 O O . HOH O 6 . ? 73.550 68.811 9.682 1.00 48.30 ? 669 HOH L O 1 HETATM 9987 O O . HOH O 6 . ? 61.452 70.743 6.464 1.00 60.28 ? 670 HOH L O 1 HETATM 9988 O O . HOH O 6 . ? 68.659 52.555 -0.118 1.00 48.30 ? 671 HOH L O 1 HETATM 9989 O O . HOH O 6 . ? 53.075 64.250 15.324 1.00 46.00 ? 672 HOH L O 1 HETATM 9990 O O . HOH O 6 . ? 65.642 70.885 0.904 1.00 71.58 ? 673 HOH L O 1 HETATM 9991 O O . HOH O 6 . ? 71.421 56.180 6.594 1.00 59.93 ? 674 HOH L O 1 HETATM 9992 O O . HOH O 6 . ? 63.783 58.790 23.931 1.00 63.69 ? 675 HOH L O 1 HETATM 9993 O O . HOH O 6 . ? 72.878 62.819 17.205 1.00 52.34 ? 676 HOH L O 1 HETATM 9994 O O . HOH O 6 . ? 73.452 60.921 9.982 1.00 65.89 ? 677 HOH L O 1 HETATM 9995 O O . HOH O 6 . ? 32.431 84.392 33.924 1.00 61.20 ? 678 HOH L O 1 HETATM 9996 O O . HOH O 6 . ? 56.088 66.781 36.891 1.00 56.15 ? 679 HOH L O 1 HETATM 9997 O O . HOH P 6 . ? 73.935 -10.288 102.349 1.00 55.53 ? 801 HOH B O 1 HETATM 9998 O O . HOH P 6 . ? 58.521 -21.087 92.366 1.00 59.29 ? 802 HOH B O 1 HETATM 9999 O O . HOH P 6 . ? 76.903 -5.816 105.193 1.00 65.45 ? 803 HOH B O 1 HETATM 10000 O O . HOH P 6 . ? 77.598 -16.728 122.022 1.00 46.44 ? 804 HOH B O 1 HETATM 10001 O O . HOH P 6 . ? 73.547 -21.965 115.307 1.00 48.74 ? 805 HOH B O 1 HETATM 10002 O O . HOH P 6 . ? 69.244 -11.980 130.938 1.00 34.15 ? 806 HOH B O 1 HETATM 10003 O O . HOH P 6 . ? 71.799 -25.425 119.572 1.00 45.20 ? 807 HOH B O 1 HETATM 10004 O O . HOH P 6 . ? 69.939 -3.458 126.828 1.00 50.74 ? 808 HOH B O 1 HETATM 10005 O O . HOH P 6 . ? 70.567 -7.553 132.058 1.00 47.75 ? 809 HOH B O 1 HETATM 10006 O O . HOH P 6 . ? 65.815 -8.122 136.522 1.00 44.13 ? 810 HOH B O 1 HETATM 10007 O O . HOH P 6 . ? 56.944 -22.669 92.999 1.00 57.93 ? 811 HOH B O 1 HETATM 10008 O O . HOH P 6 . ? 66.379 -1.452 93.274 1.00 72.31 ? 812 HOH B O 1 HETATM 10009 O O . HOH P 6 . ? 64.713 -13.117 106.062 1.00 48.77 ? 813 HOH B O 1 HETATM 10010 O O . HOH P 6 . ? 71.953 -3.426 125.416 1.00 45.38 ? 814 HOH B O 1 HETATM 10011 O O . HOH P 6 . ? 66.902 -1.547 117.709 1.00 43.98 ? 815 HOH B O 1 HETATM 10012 O O . HOH P 6 . ? 56.008 1.094 94.492 1.00 61.57 ? 816 HOH B O 1 HETATM 10013 O O . HOH P 6 . ? 74.410 2.919 119.572 1.00 57.29 ? 817 HOH B O 1 HETATM 10014 O O . HOH P 6 . ? 67.134 -6.863 122.057 1.00 45.50 ? 818 HOH B O 1 HETATM 10015 O O . HOH P 6 . ? 59.697 -0.944 121.350 1.00 66.48 ? 819 HOH B O 1 HETATM 10016 O O . HOH P 6 . ? 61.619 -24.911 109.421 1.00 50.86 ? 820 HOH B O 1 HETATM 10017 O O . HOH P 6 . ? 57.473 -1.710 121.191 1.00 60.28 ? 821 HOH B O 1 HETATM 10018 O O . HOH P 6 . ? 62.166 -14.837 94.257 1.00 54.63 ? 822 HOH B O 1 HETATM 10019 O O . HOH P 6 . ? 45.840 -18.939 127.749 1.00 62.44 ? 823 HOH B O 1 HETATM 10020 O O . HOH P 6 . ? 51.744 -8.582 111.344 1.00 57.16 ? 824 HOH B O 1 HETATM 10021 O O . HOH P 6 . ? 46.479 -14.294 113.560 1.00 52.10 ? 825 HOH B O 1 HETATM 10022 O O . HOH P 6 . ? 58.496 -25.512 131.398 1.00 60.49 ? 826 HOH B O 1 HETATM 10023 O O . HOH P 6 . ? 63.004 -21.241 102.174 1.00 70.66 ? 827 HOH B O 1 HETATM 10024 O O . HOH P 6 . ? 55.545 -3.467 105.047 1.00 49.21 ? 828 HOH B O 1 HETATM 10025 O O . HOH P 6 . ? 49.533 -29.326 125.212 1.00 59.29 ? 829 HOH B O 1 HETATM 10026 O O . HOH P 6 . ? 47.495 -18.362 123.834 1.00 52.65 ? 830 HOH B O 1 HETATM 10027 O O . HOH P 6 . ? 62.022 1.679 93.914 1.00 60.49 ? 831 HOH B O 1 HETATM 10028 O O . HOH Q 6 . ? 71.490 31.329 56.433 1.00 59.25 ? 301 HOH D O 1 HETATM 10029 O O . HOH Q 6 . ? 62.887 22.253 76.686 1.00 64.88 ? 302 HOH D O 1 HETATM 10030 O O . HOH Q 6 . ? 73.807 31.789 70.983 1.00 47.28 ? 303 HOH D O 1 HETATM 10031 O O . HOH Q 6 . ? 70.094 51.682 46.716 1.00 76.16 ? 304 HOH D O 1 HETATM 10032 O O . HOH Q 6 . ? 73.595 32.424 80.729 1.00 55.81 ? 305 HOH D O 1 HETATM 10033 O O . HOH Q 6 . ? 67.795 38.061 70.549 1.00 54.84 ? 306 HOH D O 1 HETATM 10034 O O . HOH Q 6 . ? 70.216 39.111 71.277 1.00 57.56 ? 307 HOH D O 1 HETATM 10035 O O . HOH Q 6 . ? 74.219 45.431 78.358 1.00 62.11 ? 308 HOH D O 1 HETATM 10036 O O . HOH Q 6 . ? 73.615 12.795 73.010 1.00 54.53 ? 309 HOH D O 1 HETATM 10037 O O . HOH Q 6 . ? 65.161 39.624 63.100 1.00 55.94 ? 310 HOH D O 1 HETATM 10038 O O . HOH Q 6 . ? 69.457 33.783 81.354 1.00 58.58 ? 311 HOH D O 1 HETATM 10039 O O . HOH R 6 . ? 69.832 33.893 46.848 1.00 69.16 ? 301 HOH E O 1 HETATM 10040 O O . HOH R 6 . ? 56.452 22.440 79.660 1.00 55.04 ? 302 HOH E O 1 HETATM 10041 O O . HOH R 6 . ? 58.980 34.375 56.641 1.00 55.66 ? 303 HOH E O 1 HETATM 10042 O O . HOH R 6 . ? 66.613 41.805 33.868 1.00 80.83 ? 304 HOH E O 1 HETATM 10043 O O . HOH R 6 . ? 62.274 29.604 54.528 1.00 69.15 ? 305 HOH E O 1 HETATM 10044 O O . HOH R 6 . ? 42.108 21.134 98.614 1.00 64.90 ? 306 HOH E O 1 HETATM 10045 O O . HOH R 6 . ? 57.890 46.235 72.659 1.00 71.33 ? 307 HOH E O 1 HETATM 10046 O O . HOH R 6 . ? 51.417 37.743 89.269 1.00 58.82 ? 308 HOH E O 1 HETATM 10047 O O . HOH R 6 . ? 53.271 37.138 90.730 1.00 56.56 ? 309 HOH E O 1 HETATM 10048 O O . HOH R 6 . ? 56.592 36.512 87.631 1.00 56.38 ? 310 HOH E O 1 HETATM 10049 O O . HOH R 6 . ? 59.057 37.531 87.979 1.00 57.63 ? 311 HOH E O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . VAL A 15 ? 0.8995 0.6821 0.9521 -0.1065 0.2353 -0.4172 381 VAL A N 2 C CA . VAL A 15 ? 0.9044 0.6676 0.9274 -0.0800 0.2409 -0.3956 381 VAL A CA 3 C C . VAL A 15 ? 0.9112 0.6712 0.9175 -0.0710 0.2419 -0.3574 381 VAL A C 4 O O . VAL A 15 ? 0.9443 0.7405 0.9275 -0.0521 0.2278 -0.3374 381 VAL A O 5 C CB . VAL A 15 ? 0.9453 0.6460 0.9755 -0.0741 0.2627 -0.3901 381 VAL A CB 6 C CG1 . VAL A 15 ? 0.9470 0.6307 0.9490 -0.0449 0.2688 -0.3641 381 VAL A CG1 7 C CG2 . VAL A 15 ? 1.0250 0.7311 1.0708 -0.0804 0.2609 -0.4274 381 VAL A CG2 8 N N . GLU A 16 ? 0.9118 0.6378 0.9321 -0.0834 0.2533 -0.3371 382 GLU A N 9 C CA . GLU A 16 ? 0.8981 0.6266 0.9050 -0.0730 0.2487 -0.2913 382 GLU A CA 10 C C . GLU A 16 ? 0.8007 0.5677 0.8152 -0.0878 0.2341 -0.2864 382 GLU A C 11 O O . GLU A 16 ? 0.8088 0.5744 0.8466 -0.1107 0.2383 -0.3080 382 GLU A O 12 C CB . GLU A 16 ? 0.9961 0.6622 1.0063 -0.0696 0.2718 -0.2658 382 GLU A CB 13 C CG . GLU A 16 ? 1.0249 0.6964 1.0207 -0.0572 0.2668 -0.2219 382 GLU A CG 14 C CD . GLU A 16 ? 1.1160 0.7304 1.1093 -0.0478 0.2892 -0.1952 382 GLU A CD 15 O OE1 . GLU A 16 ? 1.1093 0.7261 1.0948 -0.0424 0.2876 -0.1642 382 GLU A OE1 16 O OE2 . GLU A 16 ? 1.1652 0.7331 1.1635 -0.0439 0.3088 -0.2053 382 GLU A OE2 17 N N . CYS A 17 ? 0.7254 0.5271 0.7235 -0.0747 0.2182 -0.2591 383 CYS A N 18 C CA . CYS A 17 ? 0.7533 0.5900 0.7573 -0.0847 0.2046 -0.2507 383 CYS A CA 19 C C . CYS A 17 ? 0.8486 0.6538 0.8651 -0.0970 0.2171 -0.2340 383 CYS A C 20 O O . CYS A 17 ? 0.9470 0.7172 0.9550 -0.0864 0.2288 -0.2077 383 CYS A O 21 C CB . CYS A 17 ? 0.7430 0.6154 0.7293 -0.0669 0.1888 -0.2239 383 CYS A CB 22 S SG . CYS A 17 ? 0.8748 0.7904 0.8436 -0.0504 0.1759 -0.2369 383 CYS A SG 23 N N . ASP A 18 ? 0.8588 0.6806 0.8947 -0.1175 0.2146 -0.2488 384 ASP A N 24 C CA . ASP A 18 ? 0.8737 0.6678 0.9230 -0.1309 0.2290 -0.2356 384 ASP A CA 25 C C . ASP A 18 ? 0.7598 0.5848 0.8050 -0.1291 0.2161 -0.2130 384 ASP A C 26 O O . ASP A 18 ? 0.7144 0.5827 0.7687 -0.1370 0.2009 -0.2263 384 ASP A O 27 C CB . ASP A 18 ? 0.9444 0.7313 1.0249 -0.1579 0.2402 -0.2695 384 ASP A CB 28 C CG . ASP A 18 ? 1.0458 0.7992 1.1414 -0.1722 0.2609 -0.2549 384 ASP A CG 29 O OD1 . ASP A 18 ? 1.0589 0.7743 1.1384 -0.1589 0.2743 -0.2220 384 ASP A OD1 30 O OD2 . ASP A 18 ? 1.1094 0.8774 1.2329 -0.1953 0.2641 -0.2760 384 ASP A OD2 31 N N . PHE A 19 ? 0.7774 0.5818 0.8092 -0.1173 0.2220 -0.1802 385 PHE A N 32 C CA . PHE A 19 ? 0.7794 0.6101 0.8078 -0.1146 0.2111 -0.1603 385 PHE A CA 33 C C . PHE A 19 ? 0.8473 0.6576 0.8861 -0.1274 0.2269 -0.1520 385 PHE A C 34 O O . PHE A 19 ? 0.8883 0.7109 0.9210 -0.1224 0.2226 -0.1325 385 PHE A O 35 C CB . PHE A 19 ? 0.7728 0.6057 0.7804 -0.0914 0.2041 -0.1324 385 PHE A CB 36 C CG . PHE A 19 ? 0.8278 0.6789 0.8259 -0.0778 0.1926 -0.1365 385 PHE A CG 37 C CD1 . PHE A 19 ? 0.7711 0.6655 0.7703 -0.0758 0.1745 -0.1397 385 PHE A CD1 38 C CD2 . PHE A 19 ? 0.8795 0.7039 0.8676 -0.0655 0.2018 -0.1352 385 PHE A CD2 39 C CE1 . PHE A 19 ? 0.7299 0.6410 0.7195 -0.0626 0.1670 -0.1406 385 PHE A CE1 40 C CE2 . PHE A 19 ? 0.8751 0.7186 0.8546 -0.0525 0.1929 -0.1385 385 PHE A CE2 41 C CZ . PHE A 19 ? 0.7873 0.6746 0.7672 -0.0515 0.1761 -0.1406 385 PHE A CZ 42 N N . SER A 20 ? 0.8780 0.6574 0.9339 -0.1441 0.2465 -0.1680 386 SER A N 43 C CA . SER A 20 ? 0.8558 0.6106 0.9236 -0.1574 0.2675 -0.1592 386 SER A CA 44 C C . SER A 20 ? 0.8158 0.6093 0.8974 -0.1702 0.2588 -0.1624 386 SER A C 45 O O . SER A 20 ? 0.8052 0.5902 0.8812 -0.1682 0.2687 -0.1406 386 SER A O 46 C CB . SER A 20 ? 0.9254 0.6421 1.0174 -0.1770 0.2912 -0.1816 386 SER A CB 47 O OG . SER A 20 ? 1.0221 0.6936 1.1013 -0.1634 0.3046 -0.1742 386 SER A OG 48 N N . PRO A 21 ? 0.8103 0.6483 0.9088 -0.1811 0.2409 -0.1893 387 PRO A N 49 C CA . PRO A 21 ? 0.7962 0.6714 0.9088 -0.1909 0.2332 -0.1918 387 PRO A CA 50 C C . PRO A 21 ? 0.8636 0.7528 0.9555 -0.1736 0.2228 -0.1630 387 PRO A C 51 O O . PRO A 21 ? 0.9500 0.8555 1.0502 -0.1796 0.2243 -0.1582 387 PRO A O 52 C CB . PRO A 21 ? 0.7834 0.7071 0.9090 -0.1955 0.2114 -0.2209 387 PRO A CB 53 C CG . PRO A 21 ? 0.8240 0.7301 0.9544 -0.2000 0.2167 -0.2439 387 PRO A CG 54 C CD . PRO A 21 ? 0.8257 0.6840 0.9317 -0.1842 0.2286 -0.2196 387 PRO A CD 55 N N . LEU A 22 ? 0.8477 0.7327 0.9157 -0.1528 0.2128 -0.1466 388 LEU A N 56 C CA . LEU A 22 ? 0.8305 0.7289 0.8821 -0.1366 0.2029 -0.1232 388 LEU A CA 57 C C . LEU A 22 ? 0.8525 0.7227 0.8926 -0.1319 0.2208 -0.1009 388 LEU A C 58 O O . LEU A 22 ? 0.8320 0.7196 0.8675 -0.1270 0.2167 -0.0895 388 LEU A O 59 C CB . LEU A 22 ? 0.8470 0.7492 0.8814 -0.1173 0.1898 -0.1142 388 LEU A CB 60 C CG . LEU A 22 ? 0.8626 0.7676 0.8805 -0.0989 0.1843 -0.0906 388 LEU A CG 61 C CD1 . LEU A 22 ? 0.8849 0.8238 0.9104 -0.1001 0.1716 -0.0893 388 LEU A CD1 62 C CD2 . LEU A 22 ? 0.8597 0.7675 0.8673 -0.0831 0.1750 -0.0856 388 LEU A CD2 63 N N . LEU A 23 ? 0.8811 0.7080 0.9159 -0.1318 0.2418 -0.0949 389 LEU A N 64 C CA . LEU A 23 ? 0.8347 0.6320 0.8521 -0.1209 0.2605 -0.0685 389 LEU A CA 65 C C . LEU A 23 ? 0.8116 0.5991 0.8426 -0.1378 0.2815 -0.0675 389 LEU A C 66 O O . LEU A 23 ? 0.8431 0.6071 0.8583 -0.1285 0.3002 -0.0437 389 LEU A O 67 C CB . LEU A 23 ? 0.8307 0.5819 0.8353 -0.1096 0.2763 -0.0584 389 LEU A CB 68 C CG . LEU A 23 ? 0.7566 0.5162 0.7481 -0.0914 0.2590 -0.0580 389 LEU A CG 69 C CD1 . LEU A 23 ? 0.8343 0.5470 0.8170 -0.0812 0.2767 -0.0512 389 LEU A CD1 70 C CD2 . LEU A 23 ? 0.7169 0.5050 0.6899 -0.0706 0.2425 -0.0395 389 LEU A CD2 71 N N . SER A 24 ? 0.8045 0.6130 0.8646 -0.1610 0.2791 -0.0927 390 SER A N 72 C CA . SER A 24 ? 0.8217 0.6231 0.9019 -0.1804 0.3012 -0.0955 390 SER A CA 73 C C . SER A 24 ? 0.8328 0.6845 0.9306 -0.1908 0.2864 -0.1093 390 SER A C 74 O O . SER A 24 ? 0.8896 0.7768 0.9998 -0.1947 0.2637 -0.1304 390 SER A O 75 C CB . SER A 24 ? 0.8445 0.6170 0.9533 -0.2030 0.3205 -0.1173 390 SER A CB 76 O OG . SER A 24 ? 0.9582 0.7249 1.0928 -0.2245 0.3443 -0.1214 390 SER A OG 77 N N . GLY A 25 ? 0.8030 0.6581 0.9003 -0.1929 0.3005 -0.0959 391 GLY A N 78 C CA . GLY A 25 ? 0.7318 0.6326 0.8468 -0.2017 0.2899 -0.1081 391 GLY A CA 79 C C . GLY A 25 ? 0.7166 0.6475 0.8098 -0.1809 0.2679 -0.0964 391 GLY A C 80 O O . GLY A 25 ? 0.7049 0.6237 0.7698 -0.1603 0.2610 -0.0788 391 GLY A O 81 N N . THR A 26 ? 0.6787 0.6502 0.7883 -0.1865 0.2571 -0.1082 392 THR A N 82 C CA . THR A 26 ? 0.5698 0.5705 0.6658 -0.1693 0.2370 -0.1022 392 THR A CA 83 C C . THR A 26 ? 0.5995 0.6249 0.7032 -0.1649 0.2097 -0.1163 392 THR A C 84 O O . THR A 26 ? 0.6548 0.7052 0.7830 -0.1764 0.2021 -0.1361 392 THR A O 85 C CB . THR A 26 ? 0.5566 0.5866 0.6653 -0.1746 0.2419 -0.1059 392 THR A CB 86 O OG1 . THR A 26 ? 0.5692 0.5773 0.6668 -0.1759 0.2695 -0.0887 392 THR A OG1 87 C CG2 . THR A 26 ? 0.4813 0.5399 0.5797 -0.1572 0.2209 -0.1038 392 THR A CG2 88 N N . PRO A 27 ? 0.6081 0.6287 0.6916 -0.1472 0.1959 -0.1057 393 PRO A N 89 C CA . PRO A 27 ? 0.5830 0.6245 0.6727 -0.1414 0.1734 -0.1146 393 PRO A CA 90 C C . PRO A 27 ? 0.5625 0.6407 0.6680 -0.1402 0.1606 -0.1230 393 PRO A C 91 O O . PRO A 27 ? 0.5925 0.6791 0.6952 -0.1358 0.1633 -0.1177 393 PRO A O 92 C CB . PRO A 27 ? 0.5439 0.5721 0.6115 -0.1234 0.1663 -0.0992 393 PRO A CB 93 C CG . PRO A 27 ? 0.6026 0.6183 0.6528 -0.1162 0.1788 -0.0843 393 PRO A CG 94 C CD . PRO A 27 ? 0.6387 0.6374 0.6941 -0.1306 0.2012 -0.0847 393 PRO A CD 95 N N . PRO A 28 ? 0.5123 0.6131 0.6332 -0.1420 0.1471 -0.1360 394 PRO A N 96 C CA . PRO A 28 ? 0.4703 0.6051 0.6080 -0.1388 0.1357 -0.1435 394 PRO A CA 97 C C . PRO A 28 ? 0.4906 0.6288 0.6218 -0.1226 0.1240 -0.1333 394 PRO A C 98 O O . PRO A 28 ? 0.5435 0.6627 0.6591 -0.1146 0.1225 -0.1225 394 PRO A O 99 C CB . PRO A 28 ? 0.4087 0.5642 0.5594 -0.1416 0.1255 -0.1578 394 PRO A CB 100 C CG . PRO A 28 ? 0.4499 0.5821 0.5843 -0.1386 0.1250 -0.1531 394 PRO A CG 101 C CD . PRO A 28 ? 0.4943 0.5909 0.6152 -0.1440 0.1419 -0.1437 394 PRO A CD 102 N N . GLN A 29 ? 0.4396 0.6023 0.5857 -0.1179 0.1166 -0.1383 395 GLN A N 103 C CA . GLN A 29 ? 0.4098 0.5747 0.5569 -0.1041 0.1066 -0.1320 395 GLN A CA 104 C C . GLN A 29 ? 0.4206 0.5862 0.5693 -0.0962 0.0963 -0.1278 395 GLN A C 105 O O . GLN A 29 ? 0.4212 0.5923 0.5692 -0.0996 0.0947 -0.1320 395 GLN A O 106 C CB . GLN A 29 ? 0.4098 0.5973 0.5740 -0.1006 0.1039 -0.1393 395 GLN A CB 107 C CG . GLN A 29 ? 0.4703 0.6639 0.6340 -0.1083 0.1158 -0.1444 395 GLN A CG 108 C CD . GLN A 29 ? 0.5763 0.7522 0.7192 -0.1051 0.1228 -0.1361 395 GLN A CD 109 O OE1 . GLN A 29 ? 0.5900 0.7563 0.7254 -0.0958 0.1158 -0.1307 395 GLN A OE1 110 N NE2 . GLN A 29 ? 0.6777 0.8517 0.8121 -0.1118 0.1376 -0.1348 395 GLN A NE2 111 N N . VAL A 30 ? 0.3958 0.5576 0.5482 -0.0854 0.0904 -0.1205 396 VAL A N 112 C CA . VAL A 30 ? 0.3263 0.4844 0.4786 -0.0767 0.0847 -0.1117 396 VAL A CA 113 C C . VAL A 30 ? 0.3312 0.5104 0.4912 -0.0712 0.0789 -0.1139 396 VAL A C 114 O O . VAL A 30 ? 0.3716 0.5524 0.5226 -0.0674 0.0764 -0.1101 396 VAL A O 115 C CB . VAL A 30 ? 0.3635 0.5142 0.5264 -0.0681 0.0825 -0.1051 396 VAL A CB 116 C CG1 . VAL A 30 ? 0.3940 0.5564 0.5757 -0.0650 0.0809 -0.1122 396 VAL A CG1 117 C CG2 . VAL A 30 ? 0.3843 0.5307 0.5499 -0.0591 0.0803 -0.0932 396 VAL A CG2 118 N N . TYR A 31 ? 0.3260 0.5249 0.5015 -0.0689 0.0764 -0.1208 397 TYR A N 119 C CA . TYR A 31 ? 0.3231 0.5479 0.5062 -0.0597 0.0696 -0.1227 397 TYR A CA 120 C C . TYR A 31 ? 0.3563 0.6000 0.5348 -0.0689 0.0682 -0.1362 397 TYR A C 121 O O . TYR A 31 ? 0.3796 0.6492 0.5597 -0.0601 0.0605 -0.1396 397 TYR A O 122 C CB . TYR A 31 ? 0.3278 0.5704 0.5310 -0.0529 0.0676 -0.1272 397 TYR A CB 123 C CG . TYR A 31 ? 0.3314 0.5803 0.5420 -0.0654 0.0731 -0.1406 397 TYR A CG 124 C CD1 . TYR A 31 ? 0.3169 0.5488 0.5276 -0.0681 0.0784 -0.1400 397 TYR A CD1 125 C CD2 . TYR A 31 ? 0.3419 0.6176 0.5606 -0.0738 0.0737 -0.1548 397 TYR A CD2 126 C CE1 . TYR A 31 ? 0.4247 0.6645 0.6384 -0.0769 0.0850 -0.1503 397 TYR A CE1 127 C CE2 . TYR A 31 ? 0.4205 0.7021 0.6467 -0.0852 0.0820 -0.1649 397 TYR A CE2 128 C CZ . TYR A 31 ? 0.4686 0.7315 0.6899 -0.0856 0.0881 -0.1610 397 TYR A CZ 129 O OH . TYR A 31 ? 0.4364 0.7071 0.6613 -0.0944 0.0978 -0.1691 397 TYR A OH 130 N N . ASN A 32 ? 0.3755 0.6069 0.5490 -0.0857 0.0762 -0.1445 398 ASN A N 131 C CA . ASN A 32 ? 0.4306 0.6738 0.6041 -0.0977 0.0777 -0.1599 398 ASN A CA 132 C C . ASN A 32 ? 0.4906 0.7051 0.6459 -0.1042 0.0836 -0.1569 398 ASN A C 133 O O . ASN A 32 ? 0.5726 0.7791 0.7290 -0.1194 0.0922 -0.1682 398 ASN A O 134 C CB . ASN A 32 ? 0.4226 0.6761 0.6120 -0.1138 0.0863 -0.1742 398 ASN A CB 135 C CG . ASN A 32 ? 0.4749 0.7678 0.6861 -0.1085 0.0795 -0.1840 398 ASN A CG 136 O OD1 . ASN A 32 ? 0.4944 0.8156 0.7101 -0.0963 0.0677 -0.1876 398 ASN A OD1 137 N ND2 . ASN A 32 ? 0.4748 0.7721 0.6985 -0.1154 0.0875 -0.1878 398 ASN A ND2 138 N N . PHE A 33 ? 0.4790 0.6774 0.6201 -0.0924 0.0805 -0.1417 399 PHE A N 139 C CA . PHE A 33 ? 0.4714 0.6426 0.5953 -0.0953 0.0862 -0.1371 399 PHE A CA 140 C C . PHE A 33 ? 0.4794 0.6565 0.6003 -0.1038 0.0873 -0.1537 399 PHE A C 141 O O . PHE A 33 ? 0.4863 0.6933 0.6110 -0.0990 0.0785 -0.1645 399 PHE A O 142 C CB . PHE A 33 ? 0.3792 0.5421 0.4931 -0.0803 0.0821 -0.1203 399 PHE A CB 143 C CG . PHE A 33 ? 0.3867 0.5743 0.4994 -0.0668 0.0734 -0.1185 399 PHE A CG 144 C CD1 . PHE A 33 ? 0.3623 0.5551 0.4606 -0.0629 0.0717 -0.1225 399 PHE A CD1 145 C CD2 . PHE A 33 ? 0.4063 0.6121 0.5306 -0.0555 0.0678 -0.1121 399 PHE A CD2 146 C CE1 . PHE A 33 ? 0.3925 0.6119 0.4851 -0.0470 0.0641 -0.1192 399 PHE A CE1 147 C CE2 . PHE A 33 ? 0.3613 0.5901 0.4813 -0.0390 0.0612 -0.1065 399 PHE A CE2 148 C CZ . PHE A 33 ? 0.3823 0.6197 0.4848 -0.0342 0.0591 -0.1096 399 PHE A CZ 149 N N . LYS A 34 ? 0.4505 0.5996 0.5648 -0.1151 0.0987 -0.1567 400 LYS A N 150 C CA . LYS A 34 ? 0.4567 0.6043 0.5710 -0.1248 0.1025 -0.1749 400 LYS A CA 151 C C . LYS A 34 ? 0.4747 0.6142 0.5703 -0.1131 0.0987 -0.1699 400 LYS A C 152 O O . LYS A 34 ? 0.5250 0.6406 0.6073 -0.1051 0.1020 -0.1518 400 LYS A O 153 C CB . LYS A 34 ? 0.4950 0.6108 0.6124 -0.1412 0.1201 -0.1786 400 LYS A CB 154 C CG . LYS A 34 ? 0.5852 0.6925 0.7077 -0.1537 0.1273 -0.1998 400 LYS A CG 155 C CD . LYS A 34 ? 0.6663 0.8138 0.8126 -0.1645 0.1208 -0.2278 400 LYS A CD 156 C CE . LYS A 34 ? 0.7900 0.9293 0.9468 -0.1795 0.1289 -0.2544 400 LYS A CE 157 N NZ . LYS A 34 ? 0.8495 1.0338 1.0349 -0.1920 0.1224 -0.2867 400 LYS A NZ 158 N N . ARG A 35 ? 0.4730 0.6369 0.5682 -0.1113 0.0915 -0.1873 401 ARG A N 159 C CA . ARG A 35 ? 0.5057 0.6685 0.5817 -0.0981 0.0879 -0.1837 401 ARG A CA 160 C C . ARG A 35 ? 0.5811 0.7317 0.6546 -0.1078 0.0944 -0.2056 401 ARG A C 161 O O . ARG A 35 ? 0.5777 0.7481 0.6656 -0.1195 0.0929 -0.2329 401 ARG A O 162 C CB . ARG A 35 ? 0.4814 0.6859 0.5525 -0.0811 0.0738 -0.1831 401 ARG A CB 163 C CG . ARG A 35 ? 0.4752 0.6857 0.5248 -0.0666 0.0711 -0.1819 401 ARG A CG 164 C CD . ARG A 35 ? 0.5250 0.7695 0.5647 -0.0442 0.0609 -0.1684 401 ARG A CD 165 N NE . ARG A 35 ? 0.5251 0.7525 0.5656 -0.0351 0.0646 -0.1377 401 ARG A NE 166 C CZ . ARG A 35 ? 0.5237 0.7646 0.5551 -0.0149 0.0624 -0.1170 401 ARG A CZ 167 N NH1 . ARG A 35 ? 0.3989 0.6734 0.4142 0.0015 0.0558 -0.1210 401 ARG A NH1 168 N NH2 . ARG A 35 ? 0.4810 0.7027 0.5202 -0.0105 0.0679 -0.0927 401 ARG A NH2 169 N N . LEU A 36 ? 0.6179 0.7370 0.6758 -0.1027 0.1021 -0.1954 402 LEU A N 170 C CA . LEU A 36 ? 0.5761 0.6805 0.6298 -0.1080 0.1089 -0.2153 402 LEU A CA 171 C C . LEU A 36 ? 0.5559 0.6785 0.5895 -0.0898 0.1012 -0.2147 402 LEU A C 172 O O . LEU A 36 ? 0.5889 0.7086 0.6090 -0.0745 0.0997 -0.1897 402 LEU A O 173 C CB . LEU A 36 ? 0.5831 0.6367 0.6339 -0.1138 0.1257 -0.2049 402 LEU A CB 174 C CG . LEU A 36 ? 0.6152 0.6479 0.6807 -0.1287 0.1368 -0.1999 402 LEU A CG 175 C CD1 . LEU A 36 ? 0.6474 0.6318 0.7037 -0.1275 0.1533 -0.1844 402 LEU A CD1 176 C CD2 . LEU A 36 ? 0.6341 0.6790 0.7239 -0.1491 0.1407 -0.2290 402 LEU A CD2 177 N N . VAL A 37 ? 0.6112 0.7553 0.6444 -0.0915 0.0970 -0.2438 403 VAL A N 178 C CA . VAL A 37 ? 0.6526 0.8184 0.6637 -0.0729 0.0906 -0.2464 403 VAL A CA 179 C C . VAL A 37 ? 0.6794 0.8200 0.6855 -0.0770 0.1004 -0.2665 403 VAL A C 180 O O . VAL A 37 ? 0.6823 0.8199 0.7048 -0.0935 0.1040 -0.2986 403 VAL A O 181 C CB . VAL A 37 ? 0.6365 0.8602 0.6461 -0.0647 0.0745 -0.2655 403 VAL A CB 182 C CG1 . VAL A 37 ? 0.6575 0.9051 0.6399 -0.0431 0.0696 -0.2676 403 VAL A CG1 183 C CG2 . VAL A 37 ? 0.5944 0.8411 0.6091 -0.0573 0.0659 -0.2440 403 VAL A CG2 184 N N . PHE A 38 ? 0.7066 0.8291 0.6933 -0.0625 0.1059 -0.2488 404 PHE A N 185 C CA . PHE A 38 ? 0.6854 0.7801 0.6666 -0.0632 0.1167 -0.2648 404 PHE A CA 186 C C . PHE A 38 ? 0.7077 0.8316 0.6662 -0.0443 0.1112 -0.2747 404 PHE A C 187 O O . PHE A 38 ? 0.7283 0.8675 0.6689 -0.0255 0.1084 -0.2491 404 PHE A O 188 C CB . PHE A 38 ? 0.6066 0.6533 0.5851 -0.0609 0.1302 -0.2383 404 PHE A CB 189 C CG . PHE A 38 ? 0.6363 0.6510 0.6326 -0.0771 0.1386 -0.2300 404 PHE A CG 190 C CD1 . PHE A 38 ? 0.6857 0.6686 0.6970 -0.0939 0.1515 -0.2505 404 PHE A CD1 191 C CD2 . PHE A 38 ? 0.6163 0.6320 0.6147 -0.0750 0.1354 -0.2019 404 PHE A CD2 192 C CE1 . PHE A 38 ? 0.6587 0.6122 0.6838 -0.1070 0.1620 -0.2394 404 PHE A CE1 193 C CE2 . PHE A 38 ? 0.5917 0.5816 0.6028 -0.0875 0.1436 -0.1941 404 PHE A CE2 194 C CZ . PHE A 38 ? 0.6103 0.5694 0.6331 -0.1028 0.1574 -0.2111 404 PHE A CZ 195 N N . THR A 39 ? 0.6813 0.8134 0.6420 -0.0497 0.1113 -0.3132 405 THR A N 196 C CA . THR A 39 ? 0.6902 0.8470 0.6279 -0.0316 0.1083 -0.3277 405 THR A CA 197 C C . THR A 39 ? 0.7633 0.8861 0.7084 -0.0408 0.1206 -0.3589 405 THR A C 198 O O . THR A 39 ? 0.8222 0.9181 0.7935 -0.0631 0.1277 -0.3800 405 THR A O 199 C CB . THR A 39 ? 0.7055 0.9272 0.6343 -0.0228 0.0907 -0.3508 405 THR A CB 200 O OG1 . THR A 39 ? 0.7365 0.9685 0.6918 -0.0444 0.0864 -0.3913 405 THR A OG1 201 C CG2 . THR A 39 ? 0.6888 0.9410 0.6095 -0.0103 0.0806 -0.3175 405 THR A CG2 202 N N . ASN A 40 ? 0.7517 0.8740 0.6755 -0.0232 0.1251 -0.3608 406 ASN A N 203 C CA . ASN A 40 ? 0.8415 0.9323 0.7706 -0.0279 0.1373 -0.3917 406 ASN A CA 204 C C . ASN A 40 ? 0.8153 0.8389 0.7665 -0.0442 0.1554 -0.3834 406 ASN A C 205 O O . ASN A 40 ? 0.8398 0.8384 0.8143 -0.0633 0.1639 -0.4151 406 ASN A O 206 C CB . ASN A 40 ? 0.9373 1.0591 0.8795 -0.0380 0.1268 -0.4379 406 ASN A CB 207 C CG . ASN A 40 ? 0.9915 1.1799 0.9085 -0.0168 0.1084 -0.4438 406 ASN A CG 208 O OD1 . ASN A 40 ? 1.0433 1.2448 0.9295 0.0069 0.1101 -0.4268 406 ASN A OD1 209 N ND2 . ASN A 40 ? 0.9797 1.2124 0.9107 -0.0240 0.0917 -0.4662 406 ASN A ND2 210 N N . CYS A 41 ? 0.7623 0.7580 0.7072 -0.0361 0.1621 -0.3412 407 CYS A N 211 C CA . CYS A 41 ? 0.7037 0.6388 0.6636 -0.0455 0.1794 -0.3284 407 CYS A CA 212 C C . CYS A 41 ? 0.7686 0.6836 0.7145 -0.0269 0.1855 -0.2889 407 CYS A C 213 O O . CYS A 41 ? 0.7458 0.6932 0.6757 -0.0111 0.1768 -0.2686 407 CYS A O 214 C CB . CYS A 41 ? 0.6870 0.6129 0.6684 -0.0666 0.1793 -0.3220 407 CYS A CB 215 S SG . CYS A 41 ? 0.8471 0.8102 0.8216 -0.0615 0.1633 -0.2854 407 CYS A SG 216 N N . ASN A 42 ? 0.7519 0.6142 0.7055 -0.0284 0.2017 -0.2781 408 ASN A N 217 C CA . ASN A 42 ? 0.7089 0.5537 0.6522 -0.0100 0.2073 -0.2437 408 ASN A CA 218 C C . ASN A 42 ? 0.7202 0.5467 0.6712 -0.0159 0.2091 -0.2143 408 ASN A C 219 O O . ASN A 42 ? 0.7522 0.5482 0.7166 -0.0315 0.2184 -0.2197 408 ASN A O 220 C CB . ASN A 42 ? 0.7676 0.5700 0.7089 0.0010 0.2244 -0.2521 408 ASN A CB 221 C CG . ASN A 42 ? 0.8780 0.6971 0.8124 0.0062 0.2238 -0.2870 408 ASN A CG 222 O OD1 . ASN A 42 ? 0.8795 0.7484 0.8011 0.0127 0.2103 -0.2923 408 ASN A OD1 223 N ND2 . ASN A 42 ? 0.9139 0.6912 0.8564 0.0045 0.2396 -0.3110 408 ASN A ND2 224 N N . TYR A 43 ? 0.6447 0.4913 0.5886 -0.0036 0.2015 -0.1845 409 TYR A N 225 C CA . TYR A 43 ? 0.6231 0.4625 0.5728 -0.0077 0.2001 -0.1594 409 TYR A CA 226 C C . TYR A 43 ? 0.6819 0.5029 0.6260 0.0107 0.2065 -0.1332 409 TYR A C 227 O O . TYR A 43 ? 0.6727 0.5009 0.6098 0.0280 0.2075 -0.1287 409 TYR A O 228 C CB . TYR A 43 ? 0.5910 0.4749 0.5428 -0.0116 0.1835 -0.1498 409 TYR A CB 229 C CG . TYR A 43 ? 0.6234 0.5389 0.5680 0.0048 0.1766 -0.1361 409 TYR A CG 230 C CD1 . TYR A 43 ? 0.6109 0.5295 0.5579 0.0159 0.1760 -0.1113 409 TYR A CD1 231 C CD2 . TYR A 43 ? 0.6247 0.5698 0.5612 0.0095 0.1717 -0.1487 409 TYR A CD2 232 C CE1 . TYR A 43 ? 0.5709 0.5185 0.5175 0.0283 0.1723 -0.0999 409 TYR A CE1 233 C CE2 . TYR A 43 ? 0.5933 0.5657 0.5245 0.0241 0.1692 -0.1336 409 TYR A CE2 234 C CZ . TYR A 43 ? 0.5911 0.5634 0.5299 0.0319 0.1704 -0.1095 409 TYR A CZ 235 O OH . TYR A 43 ? 0.6146 0.6142 0.5542 0.0440 0.1704 -0.0956 409 TYR A OH 236 N N . ASN A 44 ? 0.6958 0.4972 0.6427 0.0081 0.2108 -0.1162 410 ASN A N 237 C CA . ASN A 44 ? 0.8429 0.6408 0.7842 0.0268 0.2119 -0.0901 410 ASN A CA 238 C C . ASN A 44 ? 0.9056 0.7297 0.8517 0.0213 0.2001 -0.0751 410 ASN A C 239 O O . ASN A 44 ? 0.9685 0.7755 0.9146 0.0152 0.2050 -0.0675 410 ASN A O 240 C CB . ASN A 44 ? 0.8954 0.6432 0.8311 0.0358 0.2305 -0.0817 410 ASN A CB 241 C CG . ASN A 44 ? 1.0317 0.7815 0.9587 0.0618 0.2308 -0.0569 410 ASN A CG 242 O OD1 . ASN A 44 ? 1.0234 0.8134 0.9529 0.0687 0.2165 -0.0469 410 ASN A OD1 243 N ND2 . ASN A 44 ? 1.2891 0.9964 1.2082 0.0769 0.2477 -0.0476 410 ASN A ND2 244 N N . LEU A 45 ? 0.8542 0.7191 0.8054 0.0237 0.1864 -0.0714 411 LEU A N 245 C CA . LEU A 45 ? 0.8317 0.7228 0.7912 0.0179 0.1750 -0.0612 411 LEU A CA 246 C C . LEU A 45 ? 0.8690 0.7561 0.8257 0.0309 0.1758 -0.0433 411 LEU A C 247 O O . LEU A 45 ? 0.8688 0.7597 0.8272 0.0248 0.1724 -0.0376 411 LEU A O 248 C CB . LEU A 45 ? 0.8211 0.7518 0.7898 0.0192 0.1639 -0.0601 411 LEU A CB 249 C CG . LEU A 45 ? 0.8525 0.8107 0.8347 0.0139 0.1529 -0.0515 411 LEU A CG 250 C CD1 . LEU A 45 ? 0.8079 0.7916 0.7978 0.0065 0.1465 -0.0559 411 LEU A CD1 251 C CD2 . LEU A 45 ? 0.9645 0.9398 0.9553 0.0278 0.1499 -0.0394 411 LEU A CD2 252 N N . THR A 46 ? 0.9143 0.7973 0.8659 0.0507 0.1800 -0.0354 412 THR A N 253 C CA . THR A 46 ? 0.9305 0.8178 0.8780 0.0681 0.1789 -0.0191 412 THR A CA 254 C C . THR A 46 ? 0.9616 0.8136 0.8951 0.0690 0.1901 -0.0105 412 THR A C 255 O O . THR A 46 ? 1.0351 0.8977 0.9637 0.0769 0.1865 0.0016 412 THR A O 256 C CB . THR A 46 ? 0.9683 0.8580 0.9132 0.0918 0.1824 -0.0131 412 THR A CB 257 O OG1 . THR A 46 ? 1.0427 0.8881 0.9746 0.0982 0.1986 -0.0151 412 THR A OG1 258 C CG2 . THR A 46 ? 0.9261 0.8497 0.8859 0.0907 0.1754 -0.0204 412 THR A CG2 259 N N . LYS A 47 ? 0.9417 0.7529 0.8698 0.0608 0.2050 -0.0177 413 LYS A N 260 C CA . LYS A 47 ? 0.9715 0.7431 0.8894 0.0599 0.2210 -0.0084 413 LYS A CA 261 C C . LYS A 47 ? 0.9582 0.7403 0.8817 0.0395 0.2169 -0.0111 413 LYS A C 262 O O . LYS A 47 ? 1.0250 0.7944 0.9390 0.0434 0.2248 0.0033 413 LYS A O 263 C CB . LYS A 47 ? 1.0341 0.7578 0.9519 0.0539 0.2401 -0.0193 413 LYS A CB 264 C CG . LYS A 47 ? 1.1519 0.8254 1.0583 0.0633 0.2629 -0.0025 413 LYS A CG 265 C CD . LYS A 47 ? 1.2580 0.8831 1.1671 0.0643 0.2824 -0.0130 413 LYS A CD 266 C CE . LYS A 47 ? 1.3382 0.9089 1.2357 0.0792 0.3083 0.0092 413 LYS A CE 267 N NZ . LYS A 47 ? 1.3969 0.9165 1.2998 0.0821 0.3288 -0.0018 413 LYS A NZ 268 N N . LEU A 48 ? 0.8643 0.6712 0.8020 0.0202 0.2054 -0.0284 414 LEU A N 269 C CA . LEU A 48 ? 0.8203 0.6420 0.7659 0.0019 0.2002 -0.0328 414 LEU A CA 270 C C . LEU A 48 ? 0.7333 0.5867 0.6773 0.0109 0.1879 -0.0203 414 LEU A C 271 O O . LEU A 48 ? 0.7145 0.5685 0.6559 0.0058 0.1903 -0.0150 414 LEU A O 272 C CB . LEU A 48 ? 0.8059 0.6505 0.7660 -0.0159 0.1896 -0.0529 414 LEU A CB 273 C CG . LEU A 48 ? 0.7630 0.6276 0.7336 -0.0327 0.1827 -0.0582 414 LEU A CG 274 C CD1 . LEU A 48 ? 0.8191 0.6544 0.7901 -0.0447 0.1989 -0.0592 414 LEU A CD1 275 C CD2 . LEU A 48 ? 0.7410 0.6318 0.7234 -0.0445 0.1715 -0.0754 414 LEU A CD2 276 N N . LEU A 49 ? 0.7029 0.5845 0.6503 0.0239 0.1756 -0.0175 415 LEU A N 277 C CA . LEU A 49 ? 0.6846 0.6012 0.6362 0.0314 0.1626 -0.0115 415 LEU A CA 278 C C . LEU A 49 ? 0.7441 0.6554 0.6779 0.0533 0.1675 0.0048 415 LEU A C 279 O O . LEU A 49 ? 0.7916 0.7295 0.7245 0.0594 0.1587 0.0082 415 LEU A O 280 C CB . LEU A 49 ? 0.6410 0.5912 0.6090 0.0353 0.1497 -0.0165 415 LEU A CB 281 C CG . LEU A 49 ? 0.6293 0.5900 0.6122 0.0184 0.1449 -0.0284 415 LEU A CG 282 C CD1 . LEU A 49 ? 0.7041 0.6988 0.7058 0.0224 0.1350 -0.0291 415 LEU A CD1 283 C CD2 . LEU A 49 ? 0.5483 0.5114 0.5363 0.0009 0.1421 -0.0346 415 LEU A CD2 284 N N . SER A 50 ? 0.7309 0.6085 0.6498 0.0669 0.1818 0.0145 416 SER A N 285 C CA . SER A 50 ? 0.7292 0.5984 0.6272 0.0924 0.1889 0.0339 416 SER A CA 286 C C . SER A 50 ? 0.7561 0.6057 0.6398 0.0881 0.2009 0.0443 416 SER A C 287 O O . SER A 50 ? 0.7944 0.6484 0.6583 0.1095 0.2041 0.0614 416 SER A O 288 C CB . SER A 50 ? 0.8131 0.6466 0.7004 0.1095 0.2035 0.0427 416 SER A CB 289 O OG . SER A 50 ? 0.8711 0.6565 0.7585 0.0934 0.2219 0.0379 416 SER A OG 290 N N . LEU A 51 ? 0.7662 0.5978 0.6597 0.0618 0.2079 0.0338 417 LEU A N 291 C CA . LEU A 51 ? 0.7955 0.6109 0.6806 0.0539 0.2211 0.0417 417 LEU A CA 292 C C . LEU A 51 ? 0.7974 0.6563 0.6858 0.0502 0.2054 0.0375 417 LEU A C 293 O O . LEU A 51 ? 0.8331 0.6885 0.7114 0.0487 0.2145 0.0457 417 LEU A O 294 C CB . LEU A 51 ? 0.7687 0.5532 0.6687 0.0260 0.2346 0.0284 417 LEU A CB 295 C CG . LEU A 51 ? 0.8073 0.5441 0.7079 0.0256 0.2533 0.0275 417 LEU A CG 296 C CD1 . LEU A 51 ? 0.8212 0.5398 0.7425 -0.0047 0.2625 0.0070 417 LEU A CD1 297 C CD2 . LEU A 51 ? 0.8367 0.5340 0.7152 0.0472 0.2761 0.0541 417 LEU A CD2 298 N N . PHE A 52 ? 0.7388 0.6377 0.6428 0.0488 0.1837 0.0243 418 PHE A N 299 C CA . PHE A 52 ? 0.6475 0.5868 0.5606 0.0439 0.1682 0.0156 418 PHE A CA 300 C C . PHE A 52 ? 0.6734 0.6529 0.5872 0.0639 0.1515 0.0151 418 PHE A C 301 O O . PHE A 52 ? 0.7568 0.7374 0.6682 0.0796 0.1498 0.0199 418 PHE A O 302 C CB . PHE A 52 ? 0.5813 0.5326 0.5204 0.0195 0.1587 -0.0032 418 PHE A CB 303 C CG . PHE A 52 ? 0.6148 0.5391 0.5582 -0.0013 0.1713 -0.0084 418 PHE A CG 304 C CD1 . PHE A 52 ? 0.6079 0.5055 0.5552 -0.0090 0.1794 -0.0133 418 PHE A CD1 305 C CD2 . PHE A 52 ? 0.6034 0.5329 0.5494 -0.0131 0.1748 -0.0112 418 PHE A CD2 306 C CE1 . PHE A 52 ? 0.6064 0.4850 0.5621 -0.0291 0.1898 -0.0230 418 PHE A CE1 307 C CE2 . PHE A 52 ? 0.6788 0.5892 0.6339 -0.0330 0.1861 -0.0187 418 PHE A CE2 308 C CZ . PHE A 52 ? 0.6804 0.5663 0.6415 -0.0415 0.1931 -0.0257 418 PHE A CZ 309 N N . SER A 53 ? 0.6382 0.6532 0.5581 0.0630 0.1393 0.0066 419 SER A N 310 C CA . SER A 53 ? 0.6138 0.6739 0.5448 0.0762 0.1212 -0.0023 419 SER A CA 311 C C . SER A 53 ? 0.6266 0.7065 0.5929 0.0566 0.1087 -0.0213 419 SER A C 312 O O . SER A 53 ? 0.5897 0.6859 0.5696 0.0445 0.1022 -0.0332 419 SER A O 313 C CB . SER A 53 ? 0.6361 0.7264 0.5524 0.0902 0.1154 -0.0027 419 SER A CB 314 O OG . SER A 53 ? 0.8289 0.9020 0.7095 0.1127 0.1287 0.0193 419 SER A OG 315 N N . VAL A 54 ? 0.5980 0.6751 0.5789 0.0550 0.1072 -0.0228 420 VAL A N 316 C CA . VAL A 54 ? 0.5289 0.6211 0.5420 0.0390 0.0992 -0.0360 420 VAL A CA 317 C C . VAL A 54 ? 0.4882 0.6241 0.5257 0.0418 0.0848 -0.0503 420 VAL A C 318 O O . VAL A 54 ? 0.4343 0.5959 0.4777 0.0568 0.0783 -0.0526 420 VAL A O 319 C CB . VAL A 54 ? 0.4640 0.5461 0.4844 0.0399 0.1032 -0.0325 420 VAL A CB 320 C CG1 . VAL A 54 ? 0.4510 0.5473 0.5025 0.0249 0.0983 -0.0420 420 VAL A CG1 321 C CG2 . VAL A 54 ? 0.4811 0.5213 0.4801 0.0367 0.1171 -0.0236 420 VAL A CG2 322 N N . ASN A 55 ? 0.4885 0.6343 0.5429 0.0276 0.0799 -0.0620 421 ASN A N 323 C CA . ASN A 55 ? 0.4436 0.6282 0.5258 0.0274 0.0674 -0.0802 421 ASN A CA 324 C C . ASN A 55 ? 0.4090 0.6024 0.5307 0.0152 0.0656 -0.0882 421 ASN A C 325 O O . ASN A 55 ? 0.4655 0.6915 0.6165 0.0167 0.0574 -0.1028 421 ASN A O 326 C CB . ASN A 55 ? 0.4669 0.6565 0.5489 0.0197 0.0647 -0.0899 421 ASN A CB 327 C CG . ASN A 55 ? 0.5114 0.6944 0.5550 0.0320 0.0694 -0.0804 421 ASN A CG 328 O OD1 . ASN A 55 ? 0.6303 0.7896 0.6599 0.0234 0.0782 -0.0738 421 ASN A OD1 329 N ND2 . ASN A 55 ? 0.4568 0.6628 0.4839 0.0532 0.0644 -0.0789 421 ASN A ND2 330 N N . ASP A 56 ? 0.4248 0.5908 0.5479 0.0037 0.0741 -0.0791 422 ASP A N 331 C CA . ASP A 56 ? 0.4317 0.6017 0.5881 -0.0065 0.0762 -0.0815 422 ASP A CA 332 C C . ASP A 56 ? 0.4774 0.6206 0.6205 -0.0093 0.0862 -0.0669 422 ASP A C 333 O O . ASP A 56 ? 0.5274 0.6472 0.6463 -0.0123 0.0903 -0.0607 422 ASP A O 334 C CB . ASP A 56 ? 0.4939 0.6684 0.6767 -0.0197 0.0739 -0.0924 422 ASP A CB 335 C CG . ASP A 56 ? 0.6550 0.8319 0.8751 -0.0288 0.0792 -0.0925 422 ASP A CG 336 O OD1 . ASP A 56 ? 0.7512 0.9526 1.0053 -0.0302 0.0763 -0.1049 422 ASP A OD1 337 O OD2 . ASP A 56 ? 0.6750 0.8310 0.8910 -0.0340 0.0871 -0.0802 422 ASP A OD2 338 N N . PHE A 57 ? 0.5076 0.6573 0.6682 -0.0084 0.0904 -0.0633 423 PHE A N 339 C CA . PHE A 57 ? 0.4704 0.6007 0.6169 -0.0079 0.0995 -0.0511 423 PHE A CA 340 C C . PHE A 57 ? 0.4454 0.5859 0.6224 -0.0130 0.1058 -0.0478 423 PHE A C 341 O O . PHE A 57 ? 0.4658 0.6240 0.6615 -0.0083 0.1079 -0.0486 423 PHE A O 342 C CB . PHE A 57 ? 0.4749 0.5989 0.5978 0.0059 0.1021 -0.0457 423 PHE A CB 343 C CG . PHE A 57 ? 0.5063 0.6066 0.6077 0.0069 0.1110 -0.0375 423 PHE A CG 344 C CD1 . PHE A 57 ? 0.5510 0.6439 0.6540 -0.0021 0.1149 -0.0349 423 PHE A CD1 345 C CD2 . PHE A 57 ? 0.5484 0.6353 0.6274 0.0190 0.1154 -0.0335 423 PHE A CD2 346 C CE1 . PHE A 57 ? 0.5679 0.6454 0.6504 0.0002 0.1215 -0.0315 423 PHE A CE1 347 C CE2 . PHE A 57 ? 0.6169 0.6832 0.6781 0.0197 0.1235 -0.0307 423 PHE A CE2 348 C CZ . PHE A 57 ? 0.6193 0.6833 0.6821 0.0100 0.1257 -0.0312 423 PHE A CZ 349 N N . THR A 58 ? 0.4206 0.5510 0.6034 -0.0214 0.1099 -0.0432 424 THR A N 350 C CA . THR A 58 ? 0.4275 0.5630 0.6370 -0.0248 0.1195 -0.0354 424 THR A CA 351 C C . THR A 58 ? 0.5085 0.6288 0.6953 -0.0223 0.1269 -0.0219 424 THR A C 352 O O . THR A 58 ? 0.5427 0.6507 0.7044 -0.0229 0.1226 -0.0230 424 THR A O 353 C CB . THR A 58 ? 0.4185 0.5600 0.6648 -0.0348 0.1194 -0.0418 424 THR A CB 354 O OG1 . THR A 58 ? 0.4562 0.5840 0.6885 -0.0382 0.1152 -0.0424 424 THR A OG1 355 C CG2 . THR A 58 ? 0.4701 0.6336 0.7410 -0.0369 0.1107 -0.0601 424 THR A CG2 356 N N . CYS A 59 ? 0.5605 0.6855 0.7572 -0.0189 0.1384 -0.0103 425 CYS A N 357 C CA . CYS A 59 ? 0.5061 0.6234 0.6781 -0.0126 0.1453 0.0021 425 CYS A CA 358 C C . CYS A 59 ? 0.4776 0.5986 0.6713 -0.0118 0.1592 0.0183 425 CYS A C 359 O O . CYS A 59 ? 0.4263 0.5549 0.6577 -0.0172 0.1667 0.0197 425 CYS A O 360 C CB . CYS A 59 ? 0.4016 0.5194 0.5484 -0.0032 0.1479 0.0023 425 CYS A CB 361 S SG . CYS A 59 ? 0.7678 0.8758 0.8923 -0.0015 0.1372 -0.0122 425 CYS A SG 362 N N . SER A 60 ? 0.5004 0.6175 0.6712 -0.0042 0.1636 0.0303 426 SER A N 363 C CA . SER A 60 ? 0.4643 0.5829 0.6484 0.0010 0.1795 0.0511 426 SER A CA 364 C C . SER A 60 ? 0.4238 0.5503 0.5768 0.0154 0.1881 0.0634 426 SER A C 365 O O . SER A 60 ? 0.4214 0.5497 0.5379 0.0220 0.1791 0.0565 426 SER A O 366 C CB . SER A 60 ? 0.4699 0.5803 0.6570 0.0011 0.1777 0.0572 426 SER A CB 367 O OG . SER A 60 ? 0.6106 0.7185 0.8124 0.0081 0.1959 0.0808 426 SER A OG 368 N N . GLN A 61 ? 0.3982 0.5312 0.5680 0.0196 0.2064 0.0799 427 GLN A N 369 C CA . GLN A 61 ? 0.4373 0.5816 0.5801 0.0345 0.2174 0.0920 427 GLN A CA 370 C C . GLN A 61 ? 0.5039 0.6534 0.6218 0.0374 0.2081 0.0741 427 GLN A C 371 O O . GLN A 61 ? 0.4983 0.6564 0.5838 0.0505 0.2114 0.0761 427 GLN A O 372 C CB . GLN A 61 ? 0.4714 0.6189 0.5805 0.0493 0.2186 0.1055 427 GLN A CB 373 C CG . GLN A 61 ? 0.5055 0.6454 0.6358 0.0517 0.2314 0.1284 427 GLN A CG 374 C CD . GLN A 61 ? 0.6402 0.7898 0.7340 0.0729 0.2354 0.1467 427 GLN A CD 375 O OE1 . GLN A 61 ? 0.6537 0.8145 0.7323 0.0882 0.2522 0.1668 427 GLN A OE1 376 N NE2 . GLN A 61 ? 0.7023 0.8516 0.7813 0.0756 0.2200 0.1396 427 GLN A NE2 377 N N . ILE A 62 ? 0.3874 0.5319 0.5203 0.0269 0.1972 0.0566 428 ILE A N 378 C CA . ILE A 62 ? 0.5245 0.6697 0.6398 0.0307 0.1911 0.0421 428 ILE A CA 379 C C . ILE A 62 ? 0.4531 0.5976 0.5955 0.0213 0.1831 0.0299 428 ILE A C 380 O O . ILE A 62 ? 0.4418 0.5852 0.6111 0.0109 0.1794 0.0284 428 ILE A O 381 C CB . ILE A 62 ? 0.5447 0.6800 0.6198 0.0343 0.1793 0.0290 428 ILE A CB 382 C CG1 . ILE A 62 ? 0.4048 0.5387 0.4593 0.0426 0.1801 0.0182 428 ILE A CG1 383 C CG2 . ILE A 62 ? 0.3771 0.4989 0.4556 0.0227 0.1648 0.0169 428 ILE A CG2 384 C CD1 . ILE A 62 ? 0.5036 0.6282 0.5234 0.0453 0.1723 0.0029 428 ILE A CD1 385 N N . SER A 63 ? 0.4487 0.5956 0.5838 0.0270 0.1806 0.0208 429 SER A N 386 C CA . SER A 63 ? 0.4463 0.5971 0.6009 0.0231 0.1717 0.0097 429 SER A CA 387 C C . SER A 63 ? 0.4691 0.6014 0.5932 0.0259 0.1600 -0.0018 429 SER A C 388 O O . SER A 63 ? 0.5212 0.6397 0.6140 0.0314 0.1612 -0.0038 429 SER A O 389 C CB . SER A 63 ? 0.4654 0.6373 0.6415 0.0301 0.1794 0.0103 429 SER A CB 390 O OG . SER A 63 ? 0.5544 0.7214 0.7014 0.0436 0.1826 0.0089 429 SER A OG 391 N N . PRO A 64 ? 0.4498 0.5824 0.5841 0.0222 0.1498 -0.0099 430 PRO A N 392 C CA . PRO A 64 ? 0.4656 0.5794 0.5735 0.0258 0.1420 -0.0173 430 PRO A CA 393 C C . PRO A 64 ? 0.4733 0.5777 0.5598 0.0397 0.1474 -0.0179 430 PRO A C 394 O O . PRO A 64 ? 0.5097 0.5894 0.5688 0.0413 0.1477 -0.0220 430 PRO A O 395 C CB . PRO A 64 ? 0.4593 0.5872 0.5869 0.0250 0.1330 -0.0231 430 PRO A CB 396 C CG . PRO A 64 ? 0.4259 0.5708 0.5879 0.0133 0.1330 -0.0232 430 PRO A CG 397 C CD . PRO A 64 ? 0.4159 0.5669 0.5880 0.0139 0.1459 -0.0132 430 PRO A CD 398 N N . ALA A 65 ? 0.4804 0.6046 0.5828 0.0491 0.1529 -0.0150 431 ALA A N 399 C CA . ALA A 65 ? 0.5379 0.6553 0.6233 0.0647 0.1590 -0.0157 431 ALA A CA 400 C C . ALA A 65 ? 0.6154 0.7197 0.6777 0.0662 0.1677 -0.0160 431 ALA A C 401 O O . ALA A 65 ? 0.6863 0.7690 0.7242 0.0741 0.1706 -0.0221 431 ALA A O 402 C CB . ALA A 65 ? 0.4713 0.6198 0.5839 0.0745 0.1629 -0.0135 431 ALA A CB 403 N N . ALA A 66 ? 0.5705 0.6881 0.6407 0.0596 0.1724 -0.0099 432 ALA A N 404 C CA . ALA A 66 ? 0.5605 0.6754 0.6078 0.0643 0.1801 -0.0101 432 ALA A CA 405 C C . ALA A 66 ? 0.6057 0.6992 0.6267 0.0577 0.1736 -0.0199 432 ALA A C 406 O O . ALA A 66 ? 0.6514 0.7372 0.6484 0.0636 0.1769 -0.0293 432 ALA A O 407 C CB . ALA A 66 ? 0.5126 0.6502 0.5751 0.0627 0.1891 0.0034 432 ALA A CB 408 N N . ILE A 67 ? 0.5243 0.6112 0.5521 0.0454 0.1646 -0.0204 433 ILE A N 409 C CA . ILE A 67 ? 0.5420 0.6143 0.5509 0.0376 0.1587 -0.0304 433 ILE A CA 410 C C . ILE A 67 ? 0.5291 0.5739 0.5219 0.0380 0.1582 -0.0438 433 ILE A C 411 O O . ILE A 67 ? 0.5171 0.5491 0.4959 0.0313 0.1560 -0.0564 433 ILE A O 412 C CB . ILE A 67 ? 0.5543 0.6286 0.5767 0.0250 0.1504 -0.0272 433 ILE A CB 413 C CG1 . ILE A 67 ? 0.5519 0.6252 0.5587 0.0194 0.1459 -0.0352 433 ILE A CG1 414 C CG2 . ILE A 67 ? 0.5698 0.6303 0.5992 0.0200 0.1448 -0.0305 433 ILE A CG2 415 C CD1 . ILE A 67 ? 0.5286 0.6032 0.5475 0.0085 0.1382 -0.0336 433 ILE A CD1 416 N N . ALA A 68 ? 0.5657 0.6022 0.5627 0.0465 0.1613 -0.0410 434 ALA A N 417 C CA . ALA A 68 ? 0.5765 0.5821 0.5590 0.0499 0.1646 -0.0493 434 ALA A CA 418 C C . ALA A 68 ? 0.6288 0.6269 0.5991 0.0634 0.1740 -0.0560 434 ALA A C 419 O O . ALA A 68 ? 0.7367 0.7061 0.6974 0.0696 0.1799 -0.0617 434 ALA A O 420 C CB . ALA A 68 ? 0.5375 0.5371 0.5282 0.0547 0.1622 -0.0407 434 ALA A CB 421 N N . SER A 69 ? 0.6008 0.6233 0.5712 0.0691 0.1772 -0.0547 435 SER A N 422 C CA . SER A 69 ? 0.6345 0.6557 0.5945 0.0840 0.1868 -0.0610 435 SER A CA 423 C C . SER A 69 ? 0.5837 0.6259 0.5311 0.0868 0.1901 -0.0672 435 SER A C 424 O O . SER A 69 ? 0.5809 0.6332 0.5222 0.1008 0.1988 -0.0690 435 SER A O 425 C CB . SER A 69 ? 0.7055 0.7429 0.6819 0.0977 0.1908 -0.0482 435 SER A CB 426 O OG . SER A 69 ? 0.6969 0.7674 0.6937 0.0935 0.1893 -0.0353 435 SER A OG 427 N N . ASN A 70 ? 0.5444 0.5957 0.4864 0.0759 0.1835 -0.0703 436 ASN A N 428 C CA . ASN A 70 ? 0.6071 0.6830 0.5331 0.0817 0.1855 -0.0747 436 ASN A CA 429 C C . ASN A 70 ? 0.6631 0.7328 0.5711 0.0751 0.1794 -0.0989 436 ASN A C 430 O O . ASN A 70 ? 0.6572 0.7061 0.5705 0.0613 0.1733 -0.1082 436 ASN A O 431 C CB . ASN A 70 ? 0.6113 0.7141 0.5477 0.0797 0.1844 -0.0537 436 ASN A CB 432 C CG . ASN A 70 ? 0.5961 0.7156 0.5504 0.0882 0.1948 -0.0341 436 ASN A CG 433 O OD1 . ASN A 70 ? 0.6465 0.7594 0.6092 0.0945 0.1996 -0.0350 436 ASN A OD1 434 N ND2 . ASN A 70 ? 0.6191 0.7610 0.5816 0.0889 0.1995 -0.0158 436 ASN A ND2 435 N N . CYS A 71 ? 0.6548 0.7464 0.5427 0.0854 0.1817 -0.1102 437 CYS A N 436 C CA . CYS A 71 ? 0.6917 0.7885 0.5643 0.0805 0.1744 -0.1377 437 CYS A CA 437 C C . CYS A 71 ? 0.6494 0.7802 0.5150 0.0808 0.1657 -0.1301 437 CYS A C 438 O O . CYS A 71 ? 0.6546 0.8117 0.5136 0.0935 0.1703 -0.1089 437 CYS A O 439 C CB . CYS A 71 ? 0.6203 0.7239 0.4729 0.0939 0.1806 -0.1611 437 CYS A CB 440 S SG . CYS A 71 ? 0.8265 0.8845 0.6862 0.0952 0.1914 -0.1765 437 CYS A SG 441 N N . TYR A 72 ? 0.6182 0.7488 0.4865 0.0676 0.1548 -0.1463 438 TYR A N 442 C CA . TYR A 72 ? 0.6121 0.7759 0.4745 0.0698 0.1454 -0.1399 438 TYR A CA 443 C C . TYR A 72 ? 0.6705 0.8565 0.5195 0.0686 0.1352 -0.1743 438 TYR A C 444 O O . TYR A 72 ? 0.7426 0.9112 0.5939 0.0601 0.1358 -0.2048 438 TYR A O 445 C CB . TYR A 72 ? 0.5811 0.7322 0.4658 0.0554 0.1399 -0.1235 438 TYR A CB 446 C CG . TYR A 72 ? 0.5865 0.7088 0.4905 0.0502 0.1474 -0.1034 438 TYR A CG 447 C CD1 . TYR A 72 ? 0.5138 0.6449 0.4243 0.0596 0.1551 -0.0760 438 TYR A CD1 448 C CD2 . TYR A 72 ? 0.6228 0.7115 0.5398 0.0367 0.1476 -0.1124 438 TYR A CD2 449 C CE1 . TYR A 72 ? 0.4916 0.6039 0.4226 0.0552 0.1599 -0.0622 438 TYR A CE1 450 C CE2 . TYR A 72 ? 0.5751 0.6441 0.5070 0.0355 0.1526 -0.0952 438 TYR A CE2 451 C CZ . TYR A 72 ? 0.5527 0.6362 0.4924 0.0445 0.1573 -0.0722 438 TYR A CZ 452 O OH . TYR A 72 ? 0.5746 0.6459 0.5322 0.0435 0.1604 -0.0594 438 TYR A OH 453 N N . SER A 73 ? 0.6958 0.9211 0.5326 0.0780 0.1265 -0.1701 439 SER A N 454 C CA . SER A 73 ? 0.7610 1.0175 0.5882 0.0776 0.1137 -0.2043 439 SER A CA 455 C C . SER A 73 ? 0.7620 1.0085 0.6138 0.0557 0.1041 -0.2162 439 SER A C 456 O O . SER A 73 ? 0.8301 1.0911 0.6865 0.0463 0.0953 -0.2522 439 SER A O 457 C CB . SER A 73 ? 0.8599 1.1691 0.6600 0.1020 0.1080 -0.1940 439 SER A CB 458 O OG . SER A 73 ? 0.9142 1.2269 0.7210 0.1062 0.1083 -0.1569 439 SER A OG 459 N N . SER A 74 ? 0.7285 0.9523 0.5983 0.0472 0.1065 -0.1877 440 SER A N 460 C CA . SER A 74 ? 0.7658 0.9775 0.6593 0.0269 0.1000 -0.1954 440 SER A CA 461 C C . SER A 74 ? 0.7355 0.9118 0.6470 0.0180 0.1069 -0.1664 440 SER A C 462 O O . SER A 74 ? 0.6789 0.8549 0.5880 0.0290 0.1121 -0.1367 440 SER A O 463 C CB . SER A 74 ? 0.7830 1.0384 0.6742 0.0329 0.0864 -0.1980 440 SER A CB 464 O OG . SER A 74 ? 0.7805 1.0484 0.6642 0.0495 0.0879 -0.1613 440 SER A OG 465 N N . LEU A 75 ? 0.7420 0.8903 0.6728 -0.0017 0.1078 -0.1763 441 LEU A N 466 C CA . LEU A 75 ? 0.6820 0.8021 0.6284 -0.0093 0.1124 -0.1528 441 LEU A CA 467 C C . LEU A 75 ? 0.6642 0.7869 0.6281 -0.0240 0.1059 -0.1578 441 LEU A C 468 O O . LEU A 75 ? 0.5947 0.7110 0.5675 -0.0386 0.1058 -0.1818 441 LEU A O 469 C CB . LEU A 75 ? 0.6345 0.7138 0.5839 -0.0145 0.1237 -0.1537 441 LEU A CB 470 C CG . LEU A 75 ? 0.6043 0.6613 0.5642 -0.0151 0.1284 -0.1280 441 LEU A CG 471 C CD1 . LEU A 75 ? 0.6745 0.7065 0.6289 -0.0076 0.1387 -0.1238 441 LEU A CD1 472 C CD2 . LEU A 75 ? 0.5282 0.5681 0.5029 -0.0309 0.1277 -0.1293 441 LEU A CD2 473 N N . ILE A 76 ? 0.6774 0.8093 0.6487 -0.0205 0.1022 -0.1357 442 ILE A N 474 C CA . ILE A 76 ? 0.6784 0.8155 0.6663 -0.0318 0.0964 -0.1382 442 ILE A CA 475 C C . ILE A 76 ? 0.6402 0.7479 0.6413 -0.0401 0.1020 -0.1228 442 ILE A C 476 O O . ILE A 76 ? 0.5679 0.6687 0.5702 -0.0324 0.1050 -0.1017 442 ILE A O 477 C CB . ILE A 76 ? 0.6773 0.8489 0.6648 -0.0197 0.0876 -0.1271 442 ILE A CB 478 C CG1 . ILE A 76 ? 0.6490 0.8580 0.6214 -0.0096 0.0796 -0.1455 442 ILE A CG1 479 C CG2 . ILE A 76 ? 0.6593 0.8339 0.6661 -0.0298 0.0828 -0.1269 442 ILE A CG2 480 C CD1 . ILE A 76 ? 0.6475 0.8930 0.6162 0.0067 0.0711 -0.1334 442 ILE A CD1 481 N N . LEU A 77 ? 0.6238 0.7169 0.6357 -0.0557 0.1042 -0.1344 443 LEU A N 482 C CA . LEU A 77 ? 0.5054 0.5748 0.5260 -0.0618 0.1094 -0.1216 443 LEU A CA 483 C C . LEU A 77 ? 0.4812 0.5619 0.5169 -0.0716 0.1052 -0.1250 443 LEU A C 484 O O . LEU A 77 ? 0.5016 0.5861 0.5447 -0.0838 0.1062 -0.1431 443 LEU A O 485 C CB . LEU A 77 ? 0.4929 0.5280 0.5094 -0.0683 0.1208 -0.1269 443 LEU A CB 486 C CG . LEU A 77 ? 0.5542 0.5667 0.5746 -0.0718 0.1271 -0.1140 443 LEU A CG 487 C CD1 . LEU A 77 ? 0.5671 0.5850 0.5874 -0.0599 0.1231 -0.0941 443 LEU A CD1 488 C CD2 . LEU A 77 ? 0.6295 0.6064 0.6429 -0.0746 0.1407 -0.1168 443 LEU A CD2 489 N N . ASP A 78 ? 0.5177 0.6047 0.5609 -0.0665 0.1015 -0.1092 444 ASP A N 490 C CA . ASP A 78 ? 0.5392 0.6365 0.5968 -0.0735 0.0982 -0.1113 444 ASP A CA 491 C C . ASP A 78 ? 0.5507 0.6273 0.6114 -0.0780 0.1041 -0.1033 444 ASP A C 492 O O . ASP A 78 ? 0.5153 0.5830 0.5737 -0.0704 0.1048 -0.0903 444 ASP A O 493 C CB . ASP A 78 ? 0.5081 0.6290 0.5734 -0.0630 0.0900 -0.1017 444 ASP A CB 494 C CG . ASP A 78 ? 0.5179 0.6634 0.5749 -0.0531 0.0842 -0.1058 444 ASP A CG 495 O OD1 . ASP A 78 ? 0.5509 0.7056 0.6029 -0.0587 0.0828 -0.1248 444 ASP A OD1 496 O OD2 . ASP A 78 ? 0.5131 0.6696 0.5693 -0.0392 0.0819 -0.0905 444 ASP A OD2 497 N N . TYR A 79 ? 0.5188 0.5912 0.5854 -0.0896 0.1088 -0.1116 445 TYR A N 498 C CA . TYR A 79 ? 0.5035 0.5606 0.5690 -0.0911 0.1149 -0.1033 445 TYR A CA 499 C C . TYR A 79 ? 0.5371 0.6085 0.6154 -0.0982 0.1143 -0.1083 445 TYR A C 500 O O . TYR A 79 ? 0.5620 0.6494 0.6509 -0.1064 0.1131 -0.1210 445 TYR A O 501 C CB . TYR A 79 ? 0.4766 0.5040 0.5301 -0.0954 0.1280 -0.1027 445 TYR A CB 502 C CG . TYR A 79 ? 0.4509 0.4719 0.5110 -0.1107 0.1373 -0.1176 445 TYR A CG 503 C CD1 . TYR A 79 ? 0.4102 0.4309 0.4719 -0.1157 0.1378 -0.1327 445 TYR A CD1 504 C CD2 . TYR A 79 ? 0.4559 0.4726 0.5226 -0.1205 0.1470 -0.1184 445 TYR A CD2 505 C CE1 . TYR A 79 ? 0.4721 0.4888 0.5463 -0.1322 0.1469 -0.1508 445 TYR A CE1 506 C CE2 . TYR A 79 ? 0.4589 0.4699 0.5377 -0.1370 0.1582 -0.1331 445 TYR A CE2 507 C CZ . TYR A 79 ? 0.4874 0.4982 0.5720 -0.1438 0.1579 -0.1506 445 TYR A CZ 508 O OH . TYR A 79 ? 0.5260 0.5330 0.6288 -0.1625 0.1695 -0.1696 445 TYR A OH 509 N N . PHE A 80 ? 0.5287 0.5980 0.6066 -0.0941 0.1149 -0.1001 446 PHE A N 510 C CA . PHE A 80 ? 0.4632 0.5478 0.5524 -0.0979 0.1143 -0.1044 446 PHE A CA 511 C C . PHE A 80 ? 0.4910 0.5706 0.5731 -0.0918 0.1168 -0.0969 446 PHE A C 512 O O . PHE A 80 ? 0.5076 0.5802 0.5821 -0.0825 0.1141 -0.0892 446 PHE A O 513 C CB . PHE A 80 ? 0.4514 0.5600 0.5568 -0.0932 0.1029 -0.1077 446 PHE A CB 514 C CG . PHE A 80 ? 0.4443 0.5516 0.5508 -0.0819 0.0962 -0.0982 446 PHE A CG 515 C CD1 . PHE A 80 ? 0.4616 0.5704 0.5646 -0.0772 0.0932 -0.0950 446 PHE A CD1 516 C CD2 . PHE A 80 ? 0.4411 0.5479 0.5539 -0.0762 0.0941 -0.0938 446 PHE A CD2 517 C CE1 . PHE A 80 ? 0.4923 0.5996 0.5986 -0.0676 0.0905 -0.0844 446 PHE A CE1 518 C CE2 . PHE A 80 ? 0.4672 0.5730 0.5874 -0.0685 0.0904 -0.0866 446 PHE A CE2 519 C CZ . PHE A 80 ? 0.5066 0.6113 0.6238 -0.0645 0.0898 -0.0802 446 PHE A CZ 520 N N . SER A 81 ? 0.5314 0.6189 0.6165 -0.0960 0.1219 -0.1006 447 SER A N 521 C CA . SER A 81 ? 0.4578 0.5493 0.5357 -0.0880 0.1224 -0.0966 447 SER A CA 522 C C . SER A 81 ? 0.4851 0.5931 0.5777 -0.0803 0.1092 -0.1007 447 SER A C 523 O O . SER A 81 ? 0.5222 0.6434 0.6331 -0.0824 0.1034 -0.1072 447 SER A O 524 C CB . SER A 81 ? 0.4584 0.5584 0.5367 -0.0938 0.1321 -0.1004 447 SER A CB 525 O OG . SER A 81 ? 0.4694 0.5518 0.5404 -0.1037 0.1478 -0.0970 447 SER A OG 526 N N . TYR A 82 ? 0.4895 0.5972 0.5765 -0.0707 0.1050 -0.0973 448 TYR A N 527 C CA . TYR A 82 ? 0.4623 0.5834 0.5690 -0.0656 0.0947 -0.1035 448 TYR A CA 528 C C . TYR A 82 ? 0.4377 0.5693 0.5393 -0.0563 0.0911 -0.1072 448 TYR A C 529 O O . TYR A 82 ? 0.4603 0.5860 0.5453 -0.0498 0.0925 -0.0999 448 TYR A O 530 C CB . TYR A 82 ? 0.4729 0.5869 0.5895 -0.0648 0.0908 -0.0979 448 TYR A CB 531 C CG . TYR A 82 ? 0.4146 0.5378 0.5583 -0.0626 0.0845 -0.1027 448 TYR A CG 532 C CD1 . TYR A 82 ? 0.3703 0.4981 0.5298 -0.0644 0.0835 -0.1051 448 TYR A CD1 533 C CD2 . TYR A 82 ? 0.3694 0.4970 0.5258 -0.0583 0.0808 -0.1053 448 TYR A CD2 534 C CE1 . TYR A 82 ? 0.3196 0.4500 0.5053 -0.0612 0.0810 -0.1072 448 TYR A CE1 535 C CE2 . TYR A 82 ? 0.3882 0.5201 0.5748 -0.0583 0.0784 -0.1104 448 TYR A CE2 536 C CZ . TYR A 82 ? 0.3772 0.5074 0.5776 -0.0595 0.0796 -0.1100 448 TYR A CZ 537 O OH . TYR A 82 ? 0.3759 0.5046 0.6075 -0.0583 0.0804 -0.1127 448 TYR A OH 538 N N . PRO A 83 ? 0.3689 0.5186 0.4856 -0.0543 0.0858 -0.1204 449 PRO A N 539 C CA . PRO A 83 ? 0.4172 0.5852 0.5322 -0.0449 0.0800 -0.1301 449 PRO A CA 540 C C . PRO A 83 ? 0.4306 0.6025 0.5630 -0.0419 0.0725 -0.1330 449 PRO A C 541 O O . PRO A 83 ? 0.4249 0.5920 0.5846 -0.0476 0.0705 -0.1355 449 PRO A O 542 C CB . PRO A 83 ? 0.3638 0.5488 0.4968 -0.0458 0.0768 -0.1473 449 PRO A CB 543 C CG . PRO A 83 ? 0.3175 0.4912 0.4717 -0.0542 0.0782 -0.1454 449 PRO A CG 544 C CD . PRO A 83 ? 0.2940 0.4502 0.4310 -0.0593 0.0848 -0.1290 449 PRO A CD 545 N N . LEU A 84 ? 0.4032 0.5848 0.5203 -0.0319 0.0698 -0.1317 450 LEU A N 546 C CA . LEU A 84 ? 0.3938 0.5837 0.5280 -0.0287 0.0634 -0.1351 450 LEU A CA 547 C C . LEU A 84 ? 0.3654 0.5731 0.5401 -0.0333 0.0561 -0.1561 450 LEU A C 548 O O . LEU A 84 ? 0.2868 0.4934 0.4886 -0.0376 0.0552 -0.1575 450 LEU A O 549 C CB . LEU A 84 ? 0.4022 0.6078 0.5125 -0.0133 0.0602 -0.1327 450 LEU A CB 550 C CG . LEU A 84 ? 0.4171 0.6360 0.5433 -0.0081 0.0539 -0.1355 450 LEU A CG 551 C CD1 . LEU A 84 ? 0.3096 0.5018 0.4411 -0.0154 0.0609 -0.1198 450 LEU A CD1 552 C CD2 . LEU A 84 ? 0.3393 0.5765 0.4373 0.0114 0.0505 -0.1315 450 LEU A CD2 553 N N . SER A 85 ? 0.3389 0.5618 0.5191 -0.0328 0.0528 -0.1729 451 SER A N 554 C CA . SER A 85 ? 0.4056 0.6445 0.6260 -0.0371 0.0469 -0.1975 451 SER A CA 555 C C . SER A 85 ? 0.3918 0.6081 0.6470 -0.0485 0.0527 -0.1938 451 SER A C 556 O O . SER A 85 ? 0.3786 0.6002 0.6734 -0.0537 0.0514 -0.2085 451 SER A O 557 C CB . SER A 85 ? 0.4325 0.6895 0.6479 -0.0332 0.0440 -0.2158 451 SER A CB 558 O OG . SER A 85 ? 0.5131 0.7509 0.7198 -0.0379 0.0519 -0.2055 451 SER A OG 559 N N . MET A 86 ? 0.4097 0.6023 0.6512 -0.0518 0.0600 -0.1744 452 MET A N 560 C CA . MET A 86 ? 0.3306 0.5040 0.5989 -0.0579 0.0659 -0.1675 452 MET A CA 561 C C . MET A 86 ? 0.3039 0.4624 0.5726 -0.0594 0.0708 -0.1482 452 MET A C 562 O O . MET A 86 ? 0.3258 0.4674 0.5969 -0.0606 0.0769 -0.1330 452 MET A O 563 C CB . MET A 86 ? 0.3421 0.5061 0.5978 -0.0580 0.0695 -0.1604 452 MET A CB 564 C CG . MET A 86 ? 0.2773 0.4570 0.5321 -0.0558 0.0666 -0.1788 452 MET A CG 565 S SD . MET A 86 ? 0.5199 0.6938 0.7686 -0.0559 0.0714 -0.1725 452 MET A SD 566 C CE . MET A 86 ? 0.7831 0.9409 1.0724 -0.0555 0.0749 -0.1703 452 MET A CE 567 N N . LYS A 87 ? 0.3394 0.5081 0.6048 -0.0573 0.0679 -0.1493 453 LYS A N 568 C CA . LYS A 87 ? 0.3592 0.5187 0.6260 -0.0576 0.0728 -0.1335 453 LYS A CA 569 C C . LYS A 87 ? 0.3671 0.5127 0.6674 -0.0627 0.0816 -0.1262 453 LYS A C 570 O O . LYS A 87 ? 0.4044 0.5346 0.6937 -0.0612 0.0883 -0.1064 453 LYS A O 571 C CB . LYS A 87 ? 0.3254 0.5058 0.5972 -0.0539 0.0674 -0.1427 453 LYS A CB 572 C CG . LYS A 87 ? 0.2987 0.4747 0.5813 -0.0545 0.0733 -0.1304 453 LYS A CG 573 C CD . LYS A 87 ? 0.3527 0.5565 0.6466 -0.0500 0.0667 -0.1434 453 LYS A CD 574 C CE . LYS A 87 ? 0.3839 0.5881 0.7003 -0.0523 0.0741 -0.1348 453 LYS A CE 575 N NZ . LYS A 87 ? 0.4357 0.6732 0.7660 -0.0469 0.0665 -0.1495 453 LYS A NZ 576 N N . SER A 88 ? 0.3574 0.5084 0.6987 -0.0679 0.0827 -0.1425 454 SER A N 577 C CA . SER A 88 ? 0.4055 0.5399 0.7831 -0.0724 0.0949 -0.1338 454 SER A CA 578 C C . SER A 88 ? 0.5118 0.6251 0.8817 -0.0685 0.1011 -0.1180 454 SER A C 579 O O . SER A 88 ? 0.5916 0.6879 0.9753 -0.0669 0.1130 -0.0998 454 SER A O 580 C CB . SER A 88 ? 0.4232 0.5663 0.8519 -0.0805 0.0963 -0.1587 454 SER A CB 581 O OG . SER A 88 ? 0.5878 0.7344 1.0219 -0.0804 0.0906 -0.1780 454 SER A OG 582 N N . ASP A 89 ? 0.5311 0.6482 0.8790 -0.0654 0.0939 -0.1242 455 ASP A N 583 C CA . ASP A 89 ? 0.5684 0.6728 0.9087 -0.0599 0.0977 -0.1114 455 ASP A CA 584 C C . ASP A 89 ? 0.5898 0.6892 0.8976 -0.0545 0.0995 -0.0885 455 ASP A C 585 O O . ASP A 89 ? 0.6077 0.6996 0.9113 -0.0475 0.1037 -0.0740 455 ASP A O 586 C CB . ASP A 89 ? 0.5354 0.6500 0.8633 -0.0587 0.0901 -0.1262 455 ASP A CB 587 C CG . ASP A 89 ? 0.5814 0.6880 0.9385 -0.0560 0.0944 -0.1329 455 ASP A CG 588 O OD1 . ASP A 89 ? 0.5973 0.6923 0.9539 -0.0487 0.1000 -0.1156 455 ASP A OD1 589 O OD2 . ASP A 89 ? 0.6556 0.7690 1.0354 -0.0594 0.0919 -0.1563 455 ASP A OD2 590 N N . LEU A 90 ? 0.5755 0.6813 0.8602 -0.0561 0.0960 -0.0866 456 LEU A N 591 C CA . LEU A 90 ? 0.5673 0.6697 0.8212 -0.0518 0.0972 -0.0702 456 LEU A CA 592 C C . LEU A 90 ? 0.7121 0.8075 0.9757 -0.0489 0.1065 -0.0541 456 LEU A C 593 O O . LEU A 90 ? 0.7285 0.8252 0.9719 -0.0471 0.1073 -0.0467 456 LEU A O 594 C CB . LEU A 90 ? 0.4966 0.6052 0.7205 -0.0539 0.0911 -0.0760 456 LEU A CB 595 C CG . LEU A 90 ? 0.4767 0.5823 0.6685 -0.0519 0.0910 -0.0674 456 LEU A CG 596 C CD1 . LEU A 90 ? 0.4484 0.5567 0.6375 -0.0495 0.0901 -0.0652 456 LEU A CD1 597 C CD2 . LEU A 90 ? 0.4854 0.5918 0.6541 -0.0549 0.0878 -0.0750 456 LEU A CD2 598 N N . SER A 91 ? 0.8392 0.9260 1.1355 -0.0482 0.1155 -0.0486 457 SER A N 599 C CA . SER A 91 ? 0.9585 1.0372 1.2670 -0.0449 0.1286 -0.0299 457 SER A CA 600 C C . SER A 91 ? 1.0893 1.1547 1.4088 -0.0358 0.1389 -0.0123 457 SER A C 601 O O . SER A 91 ? 1.0296 1.0886 1.3697 -0.0361 0.1390 -0.0197 457 SER A O 602 C CB . SER A 91 ? 0.9504 1.0310 1.2967 -0.0542 0.1343 -0.0396 457 SER A CB 603 O OG . SER A 91 ? 0.9387 1.0350 1.2712 -0.0578 0.1249 -0.0522 457 SER A OG 604 N N . VAL A 92 ? 1.2626 1.3250 1.5667 -0.0253 0.1481 0.0114 458 VAL A N 605 C CA . VAL A 92 ? 1.3230 1.3745 1.6315 -0.0115 0.1589 0.0331 458 VAL A CA 606 C C . VAL A 92 ? 1.3235 1.3542 1.6794 -0.0152 0.1775 0.0407 458 VAL A C 607 O O . VAL A 92 ? 1.3345 1.3494 1.7050 -0.0050 0.1884 0.0556 458 VAL A O 608 C CB . VAL A 92 ? 1.3859 1.4448 1.6602 0.0039 0.1637 0.0568 458 VAL A CB 609 C CG1 . VAL A 92 ? 1.4123 1.4733 1.6728 0.0227 0.1642 0.0724 458 VAL A CG1 610 C CG2 . VAL A 92 ? 1.4115 1.4883 1.6494 0.0005 0.1497 0.0444 458 VAL A CG2 611 N N . SER A 93 ? 1.2935 1.3246 1.6760 -0.0294 0.1819 0.0296 459 SER A N 612 C CA . SER A 93 ? 1.2101 1.2234 1.6464 -0.0378 0.1999 0.0298 459 SER A CA 613 C C . SER A 93 ? 1.1774 1.1813 1.6418 -0.0427 0.1956 0.0097 459 SER A C 614 O O . SER A 93 ? 1.2024 1.1829 1.7063 -0.0429 0.2124 0.0157 459 SER A O 615 C CB . SER A 93 ? 1.1126 1.1378 1.5746 -0.0533 0.2015 0.0144 459 SER A CB 616 O OG . SER A 93 ? 1.0656 1.1028 1.5482 -0.0662 0.1873 -0.0200 459 SER A OG 617 N N . SER A 94 ? 1.1334 1.1544 1.5774 -0.0460 0.1746 -0.0139 460 SER A N 618 C CA . SER A 94 ? 1.0940 1.1112 1.5573 -0.0487 0.1686 -0.0350 460 SER A CA 619 C C . SER A 94 ? 1.0365 1.0451 1.4805 -0.0322 0.1691 -0.0185 460 SER A C 620 O O . SER A 94 ? 1.0063 1.0245 1.4096 -0.0206 0.1639 -0.0013 460 SER A O 621 C CB . SER A 94 ? 1.1141 1.1559 1.5608 -0.0569 0.1480 -0.0647 460 SER A CB 622 O OG . SER A 94 ? 1.1473 1.1889 1.6069 -0.0572 0.1422 -0.0844 460 SER A OG 623 N N . ALA A 95 ? 0.9297 0.9224 1.4050 -0.0303 0.1750 -0.0260 461 ALA A N 624 C CA . ALA A 95 ? 0.8488 0.8357 1.3105 -0.0125 0.1753 -0.0121 461 ALA A CA 625 C C . ALA A 95 ? 0.8454 0.8520 1.2932 -0.0144 0.1569 -0.0380 461 ALA A C 626 O O . ALA A 95 ? 0.8858 0.8848 1.3503 -0.0076 0.1584 -0.0447 461 ALA A O 627 C CB . ALA A 95 ? 0.8133 0.7669 1.3178 -0.0054 0.1962 -0.0003 461 ALA A CB 628 N N . GLY A 96 ? 0.7919 0.8228 1.2096 -0.0230 0.1414 -0.0515 462 GLY A N 629 C CA . GLY A 96 ? 0.6804 0.7309 1.0831 -0.0258 0.1266 -0.0740 462 GLY A CA 630 C C . GLY A 96 ? 0.5847 0.6498 0.9542 -0.0139 0.1193 -0.0632 462 GLY A C 631 O O . GLY A 96 ? 0.5179 0.5836 0.8683 -0.0038 0.1221 -0.0403 462 GLY A O 632 N N . PRO A 97 ? 0.5455 0.6264 0.9089 -0.0149 0.1101 -0.0815 463 PRO A N 633 C CA . PRO A 97 ? 0.4827 0.5831 0.8215 -0.0058 0.1031 -0.0764 463 PRO A CA 634 C C . PRO A 97 ? 0.3895 0.5050 0.6926 -0.0112 0.0960 -0.0718 463 PRO A C 635 O O . PRO A 97 ? 0.3683 0.4996 0.6530 -0.0032 0.0918 -0.0641 463 PRO A O 636 C CB . PRO A 97 ? 0.4629 0.5765 0.8088 -0.0098 0.0974 -0.1007 463 PRO A CB 637 C CG . PRO A 97 ? 0.4791 0.5881 0.8356 -0.0233 0.0969 -0.1195 463 PRO A CG 638 C CD . PRO A 97 ? 0.4920 0.5778 0.8722 -0.0246 0.1062 -0.1098 463 PRO A CD 639 N N . ILE A 98 ? 0.3989 0.5111 0.6945 -0.0238 0.0948 -0.0782 464 ILE A N 640 C CA . ILE A 98 ? 0.4104 0.5313 0.6747 -0.0289 0.0903 -0.0745 464 ILE A CA 641 C C . ILE A 98 ? 0.4347 0.5528 0.6869 -0.0195 0.0939 -0.0531 464 ILE A C 642 O O . ILE A 98 ? 0.5605 0.6931 0.7894 -0.0164 0.0890 -0.0504 464 ILE A O 643 C CB . ILE A 98 ? 0.4162 0.5327 0.6763 -0.0403 0.0894 -0.0832 464 ILE A CB 644 C CG1 . ILE A 98 ? 0.4126 0.5366 0.6799 -0.0465 0.0856 -0.1042 464 ILE A CG1 645 C CG2 . ILE A 98 ? 0.4219 0.5429 0.6507 -0.0441 0.0867 -0.0789 464 ILE A CG2 646 C CD1 . ILE A 98 ? 0.4098 0.5487 0.6584 -0.0483 0.0816 -0.1118 464 ILE A CD1 647 N N . SER A 99 ? 0.4219 0.5232 0.6914 -0.0149 0.1035 -0.0391 465 SER A N 648 C CA . SER A 99 ? 0.5268 0.6263 0.7830 -0.0038 0.1094 -0.0165 465 SER A CA 649 C C . SER A 99 ? 0.5089 0.6128 0.7661 0.0153 0.1121 -0.0009 465 SER A C 650 O O . SER A 99 ? 0.5728 0.6848 0.8104 0.0290 0.1141 0.0169 465 SER A O 651 C CB . SER A 99 ? 0.5830 0.6637 0.8578 -0.0070 0.1217 -0.0056 465 SER A CB 652 O OG . SER A 99 ? 0.6174 0.6805 0.9306 -0.0077 0.1310 -0.0066 465 SER A OG 653 N N . GLN A 100 ? 0.4782 0.5793 0.7567 0.0185 0.1120 -0.0081 466 GLN A N 654 C CA . GLN A 100 ? 0.5075 0.6133 0.7889 0.0398 0.1146 0.0068 466 GLN A CA 655 C C . GLN A 100 ? 0.5180 0.6576 0.7784 0.0459 0.1006 -0.0030 466 GLN A C 656 O O . GLN A 100 ? 0.5315 0.6887 0.7775 0.0655 0.0986 0.0115 466 GLN A O 657 C CB . GLN A 100 ? 0.4850 0.5700 0.8032 0.0426 0.1229 0.0035 466 GLN A CB 658 C CG . GLN A 100 ? 0.5083 0.5595 0.8549 0.0423 0.1410 0.0182 466 GLN A CG 659 C CD . GLN A 100 ? 0.6394 0.6683 1.0266 0.0435 0.1499 0.0102 466 GLN A CD 660 O OE1 . GLN A 100 ? 0.6800 0.7197 1.0734 0.0407 0.1409 -0.0116 466 GLN A OE1 661 N NE2 . GLN A 100 ? 0.7465 0.7434 1.1632 0.0476 0.1695 0.0271 466 GLN A NE2 662 N N . PHE A 101 ? 0.4985 0.6501 0.7583 0.0300 0.0916 -0.0276 467 PHE A N 663 C CA . PHE A 101 ? 0.4412 0.6253 0.6911 0.0330 0.0808 -0.0400 467 PHE A CA 664 C C . PHE A 101 ? 0.4139 0.6144 0.6425 0.0162 0.0731 -0.0558 467 PHE A C 665 O O . PHE A 101 ? 0.4478 0.6779 0.6682 0.0177 0.0652 -0.0654 467 PHE A O 666 C CB . PHE A 101 ? 0.3651 0.5517 0.6380 0.0318 0.0802 -0.0550 467 PHE A CB 667 C CG . PHE A 101 ? 0.3586 0.5269 0.6564 0.0489 0.0889 -0.0424 467 PHE A CG 668 C CD1 . PHE A 101 ? 0.4227 0.6014 0.7185 0.0741 0.0898 -0.0234 467 PHE A CD1 669 C CD2 . PHE A 101 ? 0.3676 0.5094 0.6917 0.0412 0.0965 -0.0507 467 PHE A CD2 670 C CE1 . PHE A 101 ? 0.4675 0.6240 0.7870 0.0915 0.1006 -0.0092 467 PHE A CE1 671 C CE2 . PHE A 101 ? 0.3728 0.4932 0.7242 0.0557 0.1069 -0.0409 467 PHE A CE2 672 C CZ . PHE A 101 ? 0.3967 0.5214 0.7458 0.0811 0.1101 -0.0185 467 PHE A CZ 673 N N . ASN A 102 ? 0.3912 0.5732 0.6135 0.0008 0.0761 -0.0594 468 ASN A N 674 C CA . ASN A 102 ? 0.3729 0.5633 0.5774 -0.0149 0.0719 -0.0733 468 ASN A CA 675 C C . ASN A 102 ? 0.4339 0.6220 0.6166 -0.0152 0.0720 -0.0660 468 ASN A C 676 O O . ASN A 102 ? 0.4243 0.6335 0.5931 -0.0129 0.0666 -0.0708 468 ASN A O 677 C CB . ASN A 102 ? 0.3920 0.5670 0.6015 -0.0300 0.0749 -0.0844 468 ASN A CB 678 C CG . ASN A 102 ? 0.4411 0.6229 0.6686 -0.0306 0.0747 -0.0964 468 ASN A CG 679 O OD1 . ASN A 102 ? 0.4378 0.6345 0.6619 -0.0386 0.0732 -0.1095 468 ASN A OD1 680 N ND2 . ASN A 102 ? 0.4125 0.5830 0.6615 -0.0225 0.0779 -0.0925 468 ASN A ND2 681 N N . TYR A 103 ? 0.4715 0.6369 0.6530 -0.0179 0.0780 -0.0568 469 TYR A N 682 C CA . TYR A 103 ? 0.4900 0.6521 0.6511 -0.0188 0.0792 -0.0514 469 TYR A CA 683 C C . TYR A 103 ? 0.5144 0.6633 0.6790 -0.0082 0.0871 -0.0309 469 TYR A C 684 O O . TYR A 103 ? 0.5035 0.6357 0.6895 -0.0093 0.0935 -0.0253 469 TYR A O 685 C CB . TYR A 103 ? 0.5040 0.6536 0.6572 -0.0345 0.0802 -0.0623 469 TYR A CB 686 C CG . TYR A 103 ? 0.5331 0.6782 0.6658 -0.0355 0.0819 -0.0599 469 TYR A CG 687 C CD1 . TYR A 103 ? 0.5436 0.7043 0.6600 -0.0343 0.0780 -0.0670 469 TYR A CD1 688 C CD2 . TYR A 103 ? 0.5544 0.6825 0.6861 -0.0373 0.0871 -0.0533 469 TYR A CD2 689 C CE1 . TYR A 103 ? 0.5139 0.6698 0.6123 -0.0346 0.0801 -0.0676 469 TYR A CE1 690 C CE2 . TYR A 103 ? 0.5789 0.7029 0.6924 -0.0367 0.0894 -0.0516 469 TYR A CE2 691 C CZ . TYR A 103 ? 0.5492 0.6853 0.6454 -0.0353 0.0863 -0.0588 469 TYR A CZ 692 O OH . TYR A 103 ? 0.5756 0.7069 0.6544 -0.0341 0.0891 -0.0597 469 TYR A OH 693 N N . LYS A 104 ? 0.4935 0.6516 0.6384 0.0016 0.0877 -0.0214 470 LYS A N 694 C CA . LYS A 104 ? 0.4749 0.6240 0.6204 0.0141 0.0977 0.0013 470 LYS A CA 695 C C . LYS A 104 ? 0.5067 0.6642 0.6252 0.0178 0.0980 0.0036 470 LYS A C 696 O O . LYS A 104 ? 0.4735 0.6544 0.5714 0.0268 0.0912 -0.0007 470 LYS A O 697 C CB . LYS A 104 ? 0.5024 0.6599 0.6532 0.0340 0.1005 0.0181 470 LYS A CB 698 C CG . LYS A 104 ? 0.5156 0.6567 0.6747 0.0468 0.1161 0.0457 470 LYS A CG 699 C CD . LYS A 104 ? 0.6203 0.7681 0.7821 0.0698 0.1197 0.0644 470 LYS A CD 700 C CE . LYS A 104 ? 0.6971 0.8205 0.8745 0.0813 0.1402 0.0944 470 LYS A CE 701 N NZ . LYS A 104 ? 0.7808 0.9091 0.9561 0.1084 0.1457 0.1174 470 LYS A NZ 702 N N . GLN A 105 ? 0.5449 0.6866 0.6649 0.0115 0.1054 0.0077 471 GLN A N 703 C CA . GLN A 105 ? 0.5038 0.6515 0.5992 0.0147 0.1067 0.0078 471 GLN A CA 704 C C . GLN A 105 ? 0.5260 0.6839 0.6088 0.0348 0.1149 0.0301 471 GLN A C 705 O O . GLN A 105 ? 0.5391 0.6923 0.6357 0.0453 0.1231 0.0498 471 GLN A O 706 C CB . GLN A 105 ? 0.5145 0.6447 0.6164 0.0031 0.1118 0.0045 471 GLN A CB 707 C CG . GLN A 105 ? 0.4567 0.5804 0.5574 -0.0121 0.1042 -0.0163 471 GLN A CG 708 C CD . GLN A 105 ? 0.5484 0.6583 0.6545 -0.0190 0.1085 -0.0177 471 GLN A CD 709 O OE1 . GLN A 105 ? 0.6651 0.7692 0.7935 -0.0199 0.1141 -0.0101 471 GLN A OE1 710 N NE2 . GLN A 105 ? 0.5166 0.6222 0.6049 -0.0231 0.1065 -0.0285 471 GLN A NE2 711 N N . SER A 106 ? 0.5851 0.7561 0.6411 0.0411 0.1141 0.0271 472 SER A N 712 C CA . SER A 106 ? 0.6495 0.8353 0.6861 0.0627 0.1221 0.0476 472 SER A CA 713 C C . SER A 106 ? 0.6988 0.8654 0.7529 0.0661 0.1411 0.0736 472 SER A C 714 O O . SER A 106 ? 0.6111 0.7581 0.6872 0.0505 0.1460 0.0696 472 SER A O 715 C CB . SER A 106 ? 0.6755 0.8790 0.6813 0.0666 0.1176 0.0337 472 SER A CB 716 O OG . SER A 106 ? 0.7568 0.9804 0.7390 0.0902 0.1248 0.0523 472 SER A OG 717 N N . PHE A 107 ? 0.8153 0.9898 0.8604 0.0874 0.1524 0.1003 473 PHE A N 718 C CA . PHE A 107 ? 0.8439 1.0006 0.9077 0.0913 0.1746 0.1276 473 PHE A CA 719 C C . PHE A 107 ? 0.8232 0.9924 0.8618 0.1026 0.1848 0.1381 473 PHE A C 720 O O . PHE A 107 ? 0.8253 0.9816 0.8813 0.0949 0.1992 0.1457 473 PHE A O 721 C CB . PHE A 107 ? 0.9746 1.1254 1.0480 0.1089 0.1863 0.1560 473 PHE A CB 722 C CG . PHE A 107 ? 1.0785 1.2128 1.1830 0.0983 0.1805 0.1477 473 PHE A CG 723 C CD1 . PHE A 107 ? 1.1035 1.2082 1.2514 0.0838 0.1936 0.1522 473 PHE A CD1 724 C CD2 . PHE A 107 ? 1.1321 1.2834 1.2248 0.1026 0.1623 0.1326 473 PHE A CD2 725 C CE1 . PHE A 107 ? 1.1004 1.1912 1.2765 0.0750 0.1884 0.1417 473 PHE A CE1 726 C CE2 . PHE A 107 ? 1.1143 1.2520 1.2353 0.0941 0.1579 0.1244 473 PHE A CE2 727 C CZ . PHE A 107 ? 1.0926 1.1993 1.2538 0.0809 0.1709 0.1289 473 PHE A CZ 728 N N . SER A 108 ? 0.7986 0.9971 0.7974 0.1214 0.1770 0.1360 474 SER A N 729 C CA . SER A 108 ? 0.7910 1.0069 0.7603 0.1370 0.1867 0.1459 474 SER A CA 730 C C . SER A 108 ? 0.7406 0.9615 0.6979 0.1241 0.1770 0.1162 474 SER A C 731 O O . SER A 108 ? 0.8297 1.0686 0.7591 0.1368 0.1815 0.1165 474 SER A O 732 C CB . SER A 108 ? 0.8181 1.0686 0.7480 0.1671 0.1828 0.1565 474 SER A CB 733 O OG . SER A 108 ? 0.8293 1.1024 0.7450 0.1646 0.1581 0.1255 474 SER A OG 734 N N . ASN A 109 ? 0.6240 0.8283 0.6012 0.1006 0.1649 0.0915 475 ASN A N 735 C CA . ASN A 109 ? 0.5656 0.7673 0.5350 0.0886 0.1584 0.0660 475 ASN A CA 736 C C . ASN A 109 ? 0.5627 0.7371 0.5648 0.0678 0.1610 0.0609 475 ASN A C 737 O O . ASN A 109 ? 0.5918 0.7522 0.6208 0.0569 0.1588 0.0627 475 ASN A O 738 C CB . ASN A 109 ? 0.5578 0.7725 0.5099 0.0838 0.1389 0.0354 475 ASN A CB 739 C CG . ASN A 109 ? 0.6657 0.9164 0.5837 0.1052 0.1333 0.0325 475 ASN A CG 740 O OD1 . ASN A 109 ? 0.7109 0.9769 0.6044 0.1136 0.1341 0.0218 475 ASN A OD1 741 N ND2 . ASN A 109 ? 0.7363 1.0038 0.6524 0.1160 0.1271 0.0405 475 ASN A ND2 742 N N . PRO A 110 ? 0.4903 0.6602 0.4898 0.0641 0.1654 0.0533 476 PRO A N 743 C CA . PRO A 110 ? 0.5056 0.6563 0.5322 0.0477 0.1656 0.0458 476 PRO A CA 744 C C . PRO A 110 ? 0.5035 0.6425 0.5353 0.0331 0.1503 0.0253 476 PRO A C 745 O O . PRO A 110 ? 0.4912 0.6339 0.5017 0.0324 0.1405 0.0076 476 PRO A O 746 C CB . PRO A 110 ? 0.5112 0.6645 0.5231 0.0521 0.1702 0.0380 476 PRO A CB 747 C CG . PRO A 110 ? 0.5366 0.7102 0.5225 0.0708 0.1790 0.0497 476 PRO A CG 748 C CD . PRO A 110 ? 0.4649 0.6508 0.4348 0.0778 0.1702 0.0505 476 PRO A CD 749 N N . THR A 111 ? 0.4789 0.6058 0.5402 0.0215 0.1493 0.0264 477 THR A N 750 C CA . THR A 111 ? 0.4210 0.5383 0.4870 0.0091 0.1370 0.0097 477 THR A CA 751 C C . THR A 111 ? 0.4367 0.5433 0.5224 -0.0005 0.1365 0.0036 477 THR A C 752 O O . THR A 111 ? 0.4943 0.6032 0.6009 0.0001 0.1444 0.0122 477 THR A O 753 C CB . THR A 111 ? 0.3991 0.5181 0.4786 0.0071 0.1331 0.0142 477 THR A CB 754 O OG1 . THR A 111 ? 0.4812 0.5969 0.5886 0.0084 0.1437 0.0313 477 THR A OG1 755 C CG2 . THR A 111 ? 0.4415 0.5763 0.4983 0.0183 0.1294 0.0160 477 THR A CG2 756 N N . CYS A 112 ? 0.5123 0.6099 0.5918 -0.0084 0.1276 -0.0114 478 CYS A N 757 C CA . CYS A 112 ? 0.5778 0.6692 0.6723 -0.0145 0.1252 -0.0169 478 CYS A CA 758 C C . CYS A 112 ? 0.5874 0.6742 0.6856 -0.0232 0.1168 -0.0263 478 CYS A C 759 O O . CYS A 112 ? 0.5456 0.6307 0.6305 -0.0260 0.1130 -0.0320 478 CYS A O 760 C CB . CYS A 112 ? 0.6140 0.6977 0.6924 -0.0105 0.1265 -0.0226 478 CYS A CB 761 S SG . CYS A 112 ? 0.8278 0.9214 0.9139 -0.0005 0.1366 -0.0130 478 CYS A SG 762 N N . LEU A 113 ? 0.5455 0.6343 0.6630 -0.0271 0.1142 -0.0296 479 LEU A N 763 C CA . LEU A 113 ? 0.5088 0.5958 0.6292 -0.0338 0.1073 -0.0387 479 LEU A CA 764 C C . LEU A 113 ? 0.4819 0.5687 0.5998 -0.0328 0.1042 -0.0451 479 LEU A C 765 O O . LEU A 113 ? 0.5320 0.6299 0.6675 -0.0298 0.1038 -0.0457 479 LEU A O 766 C CB . LEU A 113 ? 0.5241 0.6185 0.6721 -0.0374 0.1064 -0.0379 479 LEU A CB 767 C CG . LEU A 113 ? 0.6919 0.7873 0.8438 -0.0432 0.0999 -0.0485 479 LEU A CG 768 C CD1 . LEU A 113 ? 0.7111 0.8028 0.8439 -0.0451 0.0980 -0.0504 479 LEU A CD1 769 C CD2 . LEU A 113 ? 0.8059 0.9069 0.9903 -0.0458 0.1002 -0.0503 479 LEU A CD2 770 N N . ILE A 114 ? 0.4747 0.5509 0.5719 -0.0343 0.1029 -0.0497 480 ILE A N 771 C CA . ILE A 114 ? 0.4364 0.5108 0.5242 -0.0293 0.1018 -0.0518 480 ILE A CA 772 C C . ILE A 114 ? 0.4696 0.5470 0.5563 -0.0335 0.0981 -0.0582 480 ILE A C 773 O O . ILE A 114 ? 0.3944 0.4641 0.4739 -0.0408 0.0997 -0.0606 480 ILE A O 774 C CB . ILE A 114 ? 0.4477 0.5019 0.5095 -0.0245 0.1084 -0.0483 480 ILE A CB 775 C CG1 . ILE A 114 ? 0.3975 0.4504 0.4586 -0.0190 0.1125 -0.0438 480 ILE A CG1 776 C CG2 . ILE A 114 ? 0.4566 0.5079 0.5063 -0.0148 0.1090 -0.0459 480 ILE A CG2 777 C CD1 . ILE A 114 ? 0.4544 0.4863 0.4933 -0.0126 0.1198 -0.0425 480 ILE A CD1 778 N N . LEU A 115 ? 0.5135 0.6067 0.6086 -0.0283 0.0929 -0.0627 481 LEU A N 779 C CA . LEU A 115 ? 0.4904 0.5902 0.5803 -0.0288 0.0898 -0.0692 481 LEU A CA 780 C C . LEU A 115 ? 0.5330 0.6295 0.5977 -0.0167 0.0922 -0.0639 481 LEU A C 781 O O . LEU A 115 ? 0.5674 0.6782 0.6341 -0.0052 0.0882 -0.0637 481 LEU A O 782 C CB . LEU A 115 ? 0.4702 0.5942 0.5884 -0.0304 0.0816 -0.0815 481 LEU A CB 783 C CG . LEU A 115 ? 0.5566 0.6810 0.6947 -0.0406 0.0808 -0.0874 481 LEU A CG 784 C CD1 . LEU A 115 ? 0.6351 0.7454 0.7764 -0.0455 0.0859 -0.0779 481 LEU A CD1 785 C CD2 . LEU A 115 ? 0.5478 0.6921 0.7196 -0.0421 0.0750 -0.1010 481 LEU A CD2 786 N N . ALA A 116 ? 0.4552 0.5338 0.4975 -0.0182 0.1001 -0.0587 482 ALA A N 787 C CA . ALA A 116 ? 0.4285 0.4966 0.4439 -0.0050 0.1068 -0.0485 482 ALA A CA 788 C C . ALA A 116 ? 0.5343 0.6035 0.5346 -0.0040 0.1115 -0.0474 482 ALA A C 789 O O . ALA A 116 ? 0.5870 0.6585 0.5962 -0.0167 0.1119 -0.0545 482 ALA A O 790 C CB . ALA A 116 ? 0.4436 0.4790 0.4446 -0.0059 0.1186 -0.0390 482 ALA A CB 791 N N . THR A 117 ? 0.5789 0.6483 0.5552 0.0132 0.1158 -0.0372 483 THR A N 792 C CA . THR A 117 ? 0.5657 0.6358 0.5218 0.0181 0.1236 -0.0317 483 THR A CA 793 C C . THR A 117 ? 0.6102 0.6434 0.5395 0.0242 0.1434 -0.0117 483 THR A C 794 O O . THR A 117 ? 0.5979 0.6179 0.5152 0.0384 0.1469 -0.0006 483 THR A O 795 C CB . THR A 117 ? 0.5796 0.6876 0.5277 0.0372 0.1125 -0.0365 483 THR A CB 796 O OG1 . THR A 117 ? 0.5790 0.7180 0.5582 0.0297 0.0958 -0.0579 483 THR A OG1 797 C CG2 . THR A 117 ? 0.6247 0.7371 0.5498 0.0431 0.1214 -0.0310 483 THR A CG2 798 N N . VAL A 118 ? 0.6302 0.6459 0.5535 0.0133 0.1580 -0.0076 484 VAL A N 799 C CA . VAL A 118 ? 0.6543 0.6307 0.5574 0.0159 0.1811 0.0109 484 VAL A CA 800 C C . VAL A 118 ? 0.6786 0.6588 0.5489 0.0429 0.1888 0.0305 484 VAL A C 801 O O . VAL A 118 ? 0.7217 0.7284 0.5818 0.0499 0.1863 0.0298 484 VAL A O 802 C CB . VAL A 118 ? 0.7066 0.6669 0.6191 -0.0062 0.1961 0.0076 484 VAL A CB 803 C CG1 . VAL A 118 ? 0.6988 0.6159 0.5950 -0.0050 0.2240 0.0268 484 VAL A CG1 804 C CG2 . VAL A 118 ? 0.6990 0.6597 0.6412 -0.0292 0.1878 -0.0114 484 VAL A CG2 805 N N . PRO A 119 ? 0.7264 0.6822 0.5785 0.0606 0.1981 0.0481 485 PRO A N 806 C CA . PRO A 119 ? 0.7850 0.7420 0.6017 0.0907 0.2079 0.0712 485 PRO A CA 807 C C . PRO A 119 ? 0.9117 0.8361 0.7114 0.0873 0.2366 0.0903 485 PRO A C 808 O O . PRO A 119 ? 0.9272 0.8210 0.7456 0.0610 0.2508 0.0854 485 PRO A O 809 C CB . PRO A 119 ? 0.7845 0.7197 0.5923 0.1088 0.2108 0.0838 485 PRO A CB 810 C CG . PRO A 119 ? 0.7486 0.6511 0.5821 0.0833 0.2154 0.0726 485 PRO A CG 811 C CD . PRO A 119 ? 0.6888 0.6185 0.5512 0.0572 0.1990 0.0471 485 PRO A CD 812 N N . HIS A 120 ? 1.0330 0.9668 0.7984 0.1142 0.2458 0.1114 486 HIS A N 813 C CA . HIS A 120 ? 1.1404 1.0470 0.8881 0.1132 0.2758 0.1325 486 HIS A CA 814 C C . HIS A 120 ? 1.2308 1.0718 0.9783 0.1074 0.3068 0.1528 486 HIS A C 815 O O . HIS A 120 ? 1.2840 1.0943 1.0349 0.0920 0.3340 0.1625 486 HIS A O 816 C CB . HIS A 120 ? 1.2205 1.1553 0.9260 0.1491 0.2787 0.1532 486 HIS A CB 817 C CG . HIS A 120 ? 1.2864 1.2787 0.9928 0.1487 0.2591 0.1329 486 HIS A CG 818 N ND1 . HIS A 120 ? 1.2755 1.3197 0.9919 0.1561 0.2258 0.1079 486 HIS A ND1 819 C CD2 . HIS A 120 ? 1.3293 1.3350 1.0305 0.1412 0.2695 0.1321 486 HIS A CD2 820 C CE1 . HIS A 120 ? 1.2819 1.3668 0.9990 0.1535 0.2161 0.0915 486 HIS A CE1 821 N NE2 . HIS A 120 ? 1.3107 1.3743 1.0172 0.1454 0.2417 0.1061 486 HIS A NE2 822 N N . ASN A 121 ? 1.2508 1.0703 0.9974 0.1190 0.3042 0.1577 487 ASN A N 823 C CA . ASN A 121 ? 1.2926 1.0469 1.0397 0.1158 0.3345 0.1754 487 ASN A CA 824 C C . ASN A 121 ? 1.1589 0.8869 0.9466 0.0768 0.3372 0.1501 487 ASN A C 825 O O . ASN A 121 ? 1.2015 0.8768 0.9978 0.0693 0.3599 0.1561 487 ASN A O 826 C CB . ASN A 121 ? 1.4219 1.1625 1.1488 0.1487 0.3332 0.1925 487 ASN A CB 827 C CG . ASN A 121 ? 1.4757 1.2461 1.2222 0.1463 0.3018 0.1673 487 ASN A CG 828 O OD1 . ASN A 121 ? 1.3756 1.1723 1.1504 0.1199 0.2822 0.1385 487 ASN A OD1 829 N ND2 . ASN A 121 ? 1.6889 1.4554 1.4206 0.1756 0.2986 0.1798 487 ASN A ND2 830 N N . LEU A 122 ? 1.0492 0.8153 0.8620 0.0535 0.3142 0.1210 488 LEU A N 831 C CA . LEU A 122 ? 0.9617 0.7139 0.8111 0.0184 0.3144 0.0956 488 LEU A CA 832 C C . LEU A 122 ? 1.0117 0.7739 0.8764 -0.0052 0.3239 0.0877 488 LEU A C 833 O O . LEU A 122 ? 1.0021 0.8027 0.8856 -0.0205 0.3035 0.0652 488 LEU A O 834 C CB . LEU A 122 ? 0.8557 0.6427 0.7233 0.0119 0.2821 0.0700 488 LEU A CB 835 C CG . LEU A 122 ? 0.8378 0.6137 0.7374 -0.0168 0.2794 0.0447 488 LEU A CG 836 C CD1 . LEU A 122 ? 0.8844 0.6061 0.7864 -0.0195 0.3026 0.0497 488 LEU A CD1 837 C CD2 . LEU A 122 ? 0.7905 0.6013 0.7012 -0.0162 0.2499 0.0267 488 LEU A CD2 838 N N . THR A 123 ? 1.0571 0.7839 0.9147 -0.0070 0.3570 0.1074 489 THR A N 839 C CA . THR A 123 ? 1.0605 0.7983 0.9298 -0.0255 0.3705 0.1047 489 THR A CA 840 C C . THR A 123 ? 1.0062 0.7404 0.9196 -0.0637 0.3723 0.0752 489 THR A C 841 O O . THR A 123 ? 0.9499 0.7068 0.8804 -0.0813 0.3754 0.0648 489 THR A O 842 C CB . THR A 123 ? 1.1265 0.8261 0.9748 -0.0147 0.4098 0.1384 489 THR A CB 843 O OG1 . THR A 123 ? 1.1310 0.7699 0.9918 -0.0233 0.4367 0.1455 489 THR A OG1 844 C CG2 . THR A 123 ? 1.1616 0.8747 0.9621 0.0272 0.4067 0.1679 489 THR A CG2 845 N N . THR A 124 ? 0.9713 0.6815 0.9032 -0.0748 0.3696 0.0601 490 THR A N 846 C CA . THR A 124 ? 0.9187 0.6294 0.8918 -0.1086 0.3700 0.0293 490 THR A CA 847 C C . THR A 124 ? 0.8555 0.6229 0.8447 -0.1189 0.3384 0.0039 490 THR A C 848 O O . THR A 124 ? 0.8466 0.6293 0.8675 -0.1443 0.3388 -0.0189 490 THR A O 849 C CB . THR A 124 ? 0.9157 0.5939 0.9014 -0.1145 0.3709 0.0159 490 THR A CB 850 O OG1 . THR A 124 ? 0.9132 0.6101 0.8808 -0.0939 0.3433 0.0154 490 THR A OG1 851 C CG2 . THR A 124 ? 1.0003 0.6154 0.9782 -0.1082 0.4070 0.0383 490 THR A CG2 852 N N . ILE A 125 ? 0.7826 0.5813 0.7521 -0.0986 0.3119 0.0073 491 ILE A N 853 C CA . ILE A 125 ? 0.7143 0.5625 0.6973 -0.1046 0.2844 -0.0124 491 ILE A CA 854 C C . ILE A 125 ? 0.7620 0.6371 0.7371 -0.1000 0.2866 -0.0048 491 ILE A C 855 O O . ILE A 125 ? 0.7997 0.6817 0.7463 -0.0771 0.2851 0.0132 491 ILE A O 856 C CB . ILE A 125 ? 0.7047 0.5730 0.6773 -0.0877 0.2566 -0.0151 491 ILE A CB 857 C CG1 . ILE A 125 ? 0.6879 0.5345 0.6684 -0.0918 0.2540 -0.0245 491 ILE A CG1 858 C CG2 . ILE A 125 ? 0.6175 0.5316 0.6046 -0.0923 0.2323 -0.0319 491 ILE A CG2 859 C CD1 . ILE A 125 ? 0.5905 0.4576 0.5650 -0.0775 0.2295 -0.0275 491 ILE A CD1 860 N N . THR A 126 ? 0.7791 0.6731 0.7798 -0.1207 0.2899 -0.0204 492 THR A N 861 C CA . THR A 126 ? 0.7683 0.6877 0.7644 -0.1181 0.2952 -0.0154 492 THR A CA 862 C C . THR A 126 ? 0.7071 0.6730 0.7089 -0.1129 0.2659 -0.0308 492 THR A C 863 O O . THR A 126 ? 0.6979 0.6776 0.7177 -0.1193 0.2455 -0.0485 492 THR A O 864 C CB . THR A 126 ? 0.7426 0.6589 0.7665 -0.1431 0.3183 -0.0233 492 THR A CB 865 O OG1 . THR A 126 ? 0.7376 0.6746 0.7970 -0.1637 0.3034 -0.0524 492 THR A OG1 866 C CG2 . THR A 126 ? 0.7396 0.6049 0.7622 -0.1498 0.3520 -0.0075 492 THR A CG2 867 N N . LYS A 127 ? 0.7332 0.7222 0.7193 -0.1000 0.2656 -0.0239 493 LYS A N 868 C CA . LYS A 127 ? 0.7158 0.7452 0.7078 -0.0933 0.2403 -0.0388 493 LYS A CA 869 C C . LYS A 127 ? 0.6403 0.6960 0.6619 -0.1104 0.2394 -0.0571 493 LYS A C 870 O O . LYS A 127 ? 0.6461 0.6999 0.6747 -0.1213 0.2609 -0.0543 493 LYS A O 871 C CB . LYS A 127 ? 0.7712 0.8177 0.7329 -0.0696 0.2384 -0.0276 493 LYS A CB 872 C CG . LYS A 127 ? 0.8488 0.8788 0.7812 -0.0484 0.2362 -0.0106 493 LYS A CG 873 C CD . LYS A 127 ? 0.8572 0.9047 0.7556 -0.0238 0.2409 0.0030 493 LYS A CD 874 C CE . LYS A 127 ? 0.8604 0.9535 0.7650 -0.0174 0.2194 -0.0172 493 LYS A CE 875 N NZ . LYS A 127 ? 0.9346 1.0515 0.8049 0.0075 0.2231 -0.0079 493 LYS A NZ 876 N N . PRO A 128 ? 0.5818 0.6625 0.6226 -0.1119 0.2157 -0.0750 494 PRO A N 877 C CA . PRO A 128 ? 0.5720 0.6831 0.6389 -0.1218 0.2120 -0.0917 494 PRO A CA 878 C C . PRO A 128 ? 0.6568 0.7922 0.7125 -0.1095 0.2130 -0.0913 494 PRO A C 879 O O . PRO A 128 ? 0.7384 0.8710 0.7663 -0.0923 0.2122 -0.0805 494 PRO A O 880 C CB . PRO A 128 ? 0.4972 0.6214 0.5822 -0.1215 0.1874 -0.1057 494 PRO A CB 881 C CG . PRO A 128 ? 0.5067 0.6174 0.5720 -0.1068 0.1763 -0.0968 494 PRO A CG 882 C CD . PRO A 128 ? 0.5334 0.6135 0.5746 -0.1042 0.1936 -0.0792 494 PRO A CD 883 N N . LEU A 129 ? 0.6585 0.8210 0.7357 -0.1166 0.2141 -0.1046 495 LEU A N 884 C CA . LEU A 129 ? 0.6807 0.8686 0.7490 -0.1053 0.2166 -0.1072 495 LEU A CA 885 C C . LEU A 129 ? 0.6228 0.8236 0.6826 -0.0876 0.1943 -0.1146 495 LEU A C 886 O O . LEU A 129 ? 0.6033 0.8178 0.6422 -0.0726 0.1953 -0.1134 495 LEU A O 887 C CB . LEU A 129 ? 0.7178 0.9343 0.8164 -0.1160 0.2199 -0.1229 495 LEU A CB 888 C CG . LEU A 129 ? 0.7599 0.9997 0.8502 -0.1096 0.2346 -0.1229 495 LEU A CG 889 C CD1 . LEU A 129 ? 0.8025 1.0231 0.8722 -0.1135 0.2645 -0.1019 495 LEU A CD1 890 C CD2 . LEU A 129 ? 0.7600 1.0316 0.8850 -0.1186 0.2342 -0.1412 495 LEU A CD2 891 N N . LYS A 130 ? 0.5767 0.7740 0.6537 -0.0895 0.1753 -0.1229 496 LYS A N 892 C CA . LYS A 130 ? 0.4546 0.6621 0.5341 -0.0769 0.1556 -0.1323 496 LYS A CA 893 C C . LYS A 130 ? 0.4511 0.6457 0.5474 -0.0814 0.1416 -0.1338 496 LYS A C 894 O O . LYS A 130 ? 0.5392 0.7224 0.6436 -0.0928 0.1455 -0.1301 496 LYS A O 895 C CB . LYS A 130 ? 0.4138 0.6499 0.5106 -0.0726 0.1504 -0.1499 496 LYS A CB 896 C CG . LYS A 130 ? 0.3856 0.6298 0.5148 -0.0821 0.1458 -0.1593 496 LYS A CG 897 C CD . LYS A 130 ? 0.4796 0.7514 0.6247 -0.0777 0.1462 -0.1746 496 LYS A CD 898 C CE . LYS A 130 ? 0.5176 0.8028 0.6515 -0.0811 0.1660 -0.1716 496 LYS A CE 899 N NZ . LYS A 130 ? 0.5484 0.8635 0.6980 -0.0753 0.1667 -0.1879 496 LYS A NZ 900 N N . TYR A 131 ? 0.3772 0.5736 0.5373 -0.0150 0.0721 -0.1132 497 TYR A N 901 C CA . TYR A 131 ? 0.3518 0.5548 0.5336 -0.0325 0.0752 -0.1176 497 TYR A CA 902 C C . TYR A 131 ? 0.3761 0.5790 0.5530 -0.0415 0.0732 -0.1173 497 TYR A C 903 O O . TYR A 131 ? 0.2899 0.4906 0.4540 -0.0320 0.0630 -0.1190 497 TYR A O 904 C CB . TYR A 131 ? 0.3452 0.5604 0.5557 -0.0311 0.0646 -0.1252 497 TYR A CB 905 C CG . TYR A 131 ? 0.2962 0.5144 0.5147 -0.0198 0.0646 -0.1264 497 TYR A CG 906 C CD1 . TYR A 131 ? 0.2944 0.5137 0.5199 -0.0238 0.0793 -0.1239 497 TYR A CD1 907 C CD2 . TYR A 131 ? 0.3104 0.5293 0.5269 -0.0022 0.0480 -0.1315 497 TYR A CD2 908 C CE1 . TYR A 131 ? 0.3300 0.5514 0.5631 -0.0116 0.0790 -0.1253 497 TYR A CE1 909 C CE2 . TYR A 131 ? 0.3845 0.6066 0.6086 0.0097 0.0468 -0.1323 497 TYR A CE2 910 C CZ . TYR A 131 ? 0.3150 0.5387 0.5490 0.0043 0.0631 -0.1286 497 TYR A CZ 911 O OH . TYR A 131 ? 0.3435 0.5695 0.5850 0.0179 0.0618 -0.1295 497 TYR A OH 912 N N . SER A 132 ? 0.3089 0.5131 0.4922 -0.0567 0.0822 -0.1155 498 SER A N 913 C CA . SER A 132 ? 0.3739 0.5779 0.5542 -0.0649 0.0797 -0.1146 498 SER A CA 914 C C . SER A 132 ? 0.3562 0.5646 0.5477 -0.0783 0.0881 -0.1126 498 SER A C 915 O O . SER A 132 ? 0.4072 0.6157 0.5973 -0.0804 0.0991 -0.1118 498 SER A O 916 C CB . SER A 132 ? 0.4003 0.5986 0.5596 -0.0638 0.0840 -0.1089 498 SER A CB 917 O OG . SER A 132 ? 0.5215 0.7150 0.6777 -0.0690 0.0947 -0.1047 498 SER A OG 918 N N . TYR A 133 ? 0.3161 0.5264 0.5164 -0.0846 0.0829 -0.1114 499 TYR A N 919 C CA . TYR A 133 ? 0.3295 0.5447 0.5381 -0.0948 0.0927 -0.1053 499 TYR A CA 920 C C . TYR A 133 ? 0.3238 0.5335 0.5251 -0.1005 0.0885 -0.1019 499 TYR A C 921 O O . TYR A 133 ? 0.2889 0.4925 0.4856 -0.0964 0.0760 -0.1056 499 TYR A O 922 C CB . TYR A 133 ? 0.2719 0.5001 0.5158 -0.0972 0.0935 -0.1018 499 TYR A CB 923 C CG . TYR A 133 ? 0.2910 0.5191 0.5620 -0.0981 0.0745 -0.1046 499 TYR A CG 924 C CD1 . TYR A 133 ? 0.3298 0.5552 0.6171 -0.1070 0.0696 -0.0984 499 TYR A CD1 925 C CD2 . TYR A 133 ? 0.2888 0.5168 0.5688 -0.0884 0.0589 -0.1142 499 TYR A CD2 926 C CE1 . TYR A 133 ? 0.3185 0.5388 0.6338 -0.1077 0.0477 -0.1033 499 TYR A CE1 927 C CE2 . TYR A 133 ? 0.3448 0.5691 0.6485 -0.0869 0.0360 -0.1207 499 TYR A CE2 928 C CZ . TYR A 133 ? 0.3474 0.5668 0.6705 -0.0974 0.0295 -0.1161 499 TYR A CZ 929 O OH . TYR A 133 ? 0.2868 0.4977 0.6362 -0.0958 0.0024 -0.1250 499 TYR A OH 930 N N . ILE A 134 ? 0.3261 0.5377 0.5231 -0.1069 0.0991 -0.0947 500 ILE A N 931 C CA . ILE A 134 ? 0.3003 0.5067 0.4914 -0.1117 0.0961 -0.0893 500 ILE A CA 932 C C . ILE A 134 ? 0.3668 0.5746 0.5897 -0.1168 0.0894 -0.0830 500 ILE A C 933 O O . ILE A 134 ? 0.4633 0.6816 0.7110 -0.1209 0.0987 -0.0736 500 ILE A O 934 C CB . ILE A 134 ? 0.3278 0.5345 0.4985 -0.1134 0.1089 -0.0832 500 ILE A CB 935 C CG1 . ILE A 134 ? 0.2940 0.4954 0.4392 -0.1098 0.1096 -0.0918 500 ILE A CG1 936 C CG2 . ILE A 134 ? 0.3044 0.5055 0.4693 -0.1169 0.1055 -0.0757 500 ILE A CG2 937 C CD1 . ILE A 134 ? 0.3806 0.5790 0.5012 -0.1079 0.1164 -0.0908 500 ILE A CD1 938 N N . ASN A 135 ? 0.3894 0.5866 0.6144 -0.1155 0.0731 -0.0874 501 ASN A N 939 C CA . ASN A 135 ? 0.4615 0.6538 0.7206 -0.1207 0.0606 -0.0837 501 ASN A CA 940 C C . ASN A 135 ? 0.4165 0.6021 0.6766 -0.1277 0.0648 -0.0704 501 ASN A C 941 O O . ASN A 135 ? 0.4140 0.6008 0.7092 -0.1363 0.0657 -0.0576 501 ASN A O 942 C CB . ASN A 135 ? 0.5841 0.7637 0.8422 -0.1112 0.0365 -0.0989 501 ASN A CB 943 C CG . ASN A 135 ? 0.6940 0.8628 0.9901 -0.1161 0.0168 -0.0993 501 ASN A CG 944 O OD1 . ASN A 135 ? 0.7994 0.9517 1.0912 -0.1152 0.0054 -0.1002 501 ASN A OD1 945 N ND2 . ASN A 135 ? 0.6734 0.8506 1.0111 -0.1214 0.0109 -0.0986 501 ASN A ND2 946 N N . LYS A 136 ? 0.4518 0.6314 0.6767 -0.1237 0.0673 -0.0716 502 LYS A N 947 C CA . LYS A 136 ? 0.4855 0.6578 0.7036 -0.1272 0.0708 -0.0594 502 LYS A CA 948 C C . LYS A 136 ? 0.4968 0.6745 0.6783 -0.1240 0.0840 -0.0572 502 LYS A C 949 O O . LYS A 136 ? 0.5495 0.7302 0.7107 -0.1191 0.0827 -0.0683 502 LYS A O 950 C CB . LYS A 136 ? 0.5175 0.6724 0.7324 -0.1226 0.0514 -0.0661 502 LYS A CB 951 C CG . LYS A 136 ? 0.5448 0.6873 0.7949 -0.1240 0.0316 -0.0711 502 LYS A CG 952 C CD . LYS A 136 ? 0.5452 0.6792 0.8289 -0.1354 0.0317 -0.0531 502 LYS A CD 953 C CE . LYS A 136 ? 0.5813 0.6950 0.9008 -0.1364 0.0041 -0.0613 502 LYS A CE 954 N NZ . LYS A 136 ? 0.6204 0.7197 0.9726 -0.1473 0.0018 -0.0420 502 LYS A NZ 955 N N . CYS A 137 ? 0.4737 0.6518 0.6481 -0.1257 0.0955 -0.0421 503 CYS A N 956 C CA . CYS A 137 ? 0.4105 0.5904 0.5469 -0.1199 0.1028 -0.0422 503 CYS A CA 957 C C . CYS A 137 ? 0.4089 0.5827 0.5347 -0.1183 0.1075 -0.0255 503 CYS A C 958 O O . CYS A 137 ? 0.3863 0.5645 0.5225 -0.1193 0.1222 -0.0073 503 CYS A O 959 C CB . CYS A 137 ? 0.4080 0.5986 0.5325 -0.1163 0.1171 -0.0442 503 CYS A CB 960 S SG . CYS A 137 ? 0.5068 0.6948 0.5830 -0.1063 0.1197 -0.0493 503 CYS A SG 961 N N . SER A 138 ? 0.4074 0.5727 0.5139 -0.1145 0.0962 -0.0293 504 SER A N 962 C CA . SER A 138 ? 0.4806 0.6371 0.5763 -0.1114 0.0979 -0.0132 504 SER A CA 963 C C . SER A 138 ? 0.5482 0.7028 0.6091 -0.1028 0.0894 -0.0199 504 SER A C 964 O O . SER A 138 ? 0.5121 0.6710 0.5680 -0.1017 0.0787 -0.0364 504 SER A O 965 C CB . SER A 138 ? 0.4639 0.6062 0.5902 -0.1168 0.0869 -0.0067 504 SER A CB 966 O OG . SER A 138 ? 0.5393 0.6833 0.7055 -0.1258 0.0911 0.0005 504 SER A OG 967 N N . ARG A 139 ? 0.6196 0.7688 0.6591 -0.0960 0.0943 -0.0050 505 ARG A N 968 C CA . ARG A 139 ? 0.6350 0.7810 0.6455 -0.0868 0.0825 -0.0094 505 ARG A CA 969 C C . ARG A 139 ? 0.6819 0.8146 0.7048 -0.0866 0.0723 -0.0013 505 ARG A C 970 O O . ARG A 139 ? 0.6852 0.8067 0.7206 -0.0887 0.0791 0.0181 505 ARG A O 971 C CB . ARG A 139 ? 0.6711 0.8174 0.6416 -0.0742 0.0914 0.0001 505 ARG A CB 972 C CG . ARG A 139 ? 0.6861 0.8402 0.6305 -0.0679 0.0876 -0.0186 505 ARG A CG 973 C CD . ARG A 139 ? 0.7645 0.9153 0.6605 -0.0496 0.0915 -0.0124 505 ARG A CD 974 N NE . ARG A 139 ? 0.9011 1.0534 0.7714 -0.0418 0.0770 -0.0357 505 ARG A NE 975 C CZ . ARG A 139 ? 1.0126 1.1600 0.8345 -0.0222 0.0740 -0.0390 505 ARG A CZ 976 N NH1 . ARG A 139 ? 1.1095 1.2533 0.9002 -0.0067 0.0890 -0.0170 505 ARG A NH1 977 N NH2 . ARG A 139 ? 0.9855 1.1306 0.7906 -0.0166 0.0552 -0.0638 505 ARG A NH2 978 N N . PHE A 140 ? 0.6758 0.8101 0.6990 -0.0836 0.0564 -0.0151 506 PHE A N 979 C CA . PHE A 140 ? 0.6605 0.7817 0.6899 -0.0788 0.0449 -0.0104 506 PHE A CA 980 C C . PHE A 140 ? 0.7073 0.8290 0.7070 -0.0672 0.0384 -0.0062 506 PHE A C 981 O O . PHE A 140 ? 0.6422 0.7778 0.6329 -0.0627 0.0288 -0.0195 506 PHE A O 982 C CB . PHE A 140 ? 0.6453 0.7699 0.6928 -0.0778 0.0329 -0.0267 506 PHE A CB 983 C CG . PHE A 140 ? 0.6637 0.7705 0.7194 -0.0707 0.0207 -0.0241 506 PHE A CG 984 C CD1 . PHE A 140 ? 0.6794 0.7635 0.7537 -0.0755 0.0197 -0.0136 506 PHE A CD1 985 C CD2 . PHE A 140 ? 0.6529 0.7655 0.7019 -0.0585 0.0093 -0.0321 506 PHE A CD2 986 C CE1 . PHE A 140 ? 0.6823 0.7445 0.7645 -0.0678 0.0051 -0.0135 506 PHE A CE1 987 C CE2 . PHE A 140 ? 0.6359 0.7300 0.6893 -0.0484 -0.0026 -0.0316 506 PHE A CE2 988 C CZ . PHE A 140 ? 0.6465 0.7126 0.7146 -0.0529 -0.0060 -0.0235 506 PHE A CZ 989 N N . LEU A 141 ? 0.7214 0.8284 0.7090 -0.0623 0.0432 0.0139 507 LEU A N 990 C CA . LEU A 141 ? 0.6846 0.7906 0.6375 -0.0483 0.0379 0.0203 507 LEU A CA 991 C C . LEU A 141 ? 0.6428 0.7497 0.5975 -0.0401 0.0185 0.0110 507 LEU A C 992 O O . LEU A 141 ? 0.6149 0.7192 0.5951 -0.0428 0.0115 0.0033 507 LEU A O 993 C CB . LEU A 141 ? 0.6797 0.7687 0.6206 -0.0433 0.0504 0.0490 507 LEU A CB 994 C CG . LEU A 141 ? 0.6499 0.7454 0.5627 -0.0378 0.0698 0.0621 507 LEU A CG 995 C CD1 . LEU A 141 ? 0.5833 0.6901 0.5181 -0.0504 0.0831 0.0556 507 LEU A CD1 996 C CD2 . LEU A 141 ? 0.7232 0.8038 0.6278 -0.0310 0.0850 0.0966 507 LEU A CD2 997 N N . SER A 142 ? 0.6504 0.7617 0.5762 -0.0271 0.0092 0.0114 508 SER A N 998 C CA . SER A 142 ? 0.6664 0.7852 0.5959 -0.0176 -0.0094 0.0026 508 SER A CA 999 C C . SER A 142 ? 0.7133 0.8114 0.6478 -0.0097 -0.0144 0.0157 508 SER A C 1000 O O . SER A 142 ? 0.6979 0.8014 0.6359 0.0011 -0.0289 0.0100 508 SER A O 1001 C CB . SER A 142 ? 0.6319 0.7620 0.5315 -0.0056 -0.0217 -0.0025 508 SER A CB 1002 O OG . SER A 142 ? 0.6639 0.7783 0.5249 0.0052 -0.0147 0.0151 508 SER A OG 1003 N N . ASP A 143 ? 0.7774 0.8518 0.7160 -0.0146 -0.0029 0.0340 509 ASP A N 1004 C CA . ASP A 143 ? 0.8381 0.8863 0.7867 -0.0087 -0.0094 0.0465 509 ASP A CA 1005 C C . ASP A 143 ? 0.8744 0.9144 0.8575 -0.0147 -0.0160 0.0333 509 ASP A C 1006 O O . ASP A 143 ? 0.9313 0.9457 0.9259 -0.0092 -0.0254 0.0384 509 ASP A O 1007 C CB . ASP A 143 ? 0.9205 0.9453 0.8640 -0.0112 0.0048 0.0763 509 ASP A CB 1008 C CG . ASP A 143 ? 0.9548 0.9826 0.9177 -0.0281 0.0232 0.0824 509 ASP A CG 1009 O OD1 . ASP A 143 ? 1.0139 1.0354 0.9685 -0.0286 0.0406 0.1083 509 ASP A OD1 1010 O OD2 . ASP A 143 ? 0.9232 0.9613 0.9098 -0.0390 0.0214 0.0632 509 ASP A OD2 1011 N N . ASP A 144 ? 0.8554 0.9149 0.8519 -0.0237 -0.0126 0.0158 510 ASP A N 1012 C CA . ASP A 144 ? 0.8668 0.9213 0.8887 -0.0258 -0.0187 0.0010 510 ASP A CA 1013 C C . ASP A 144 ? 0.8884 0.9108 0.9330 -0.0337 -0.0198 0.0103 510 ASP A C 1014 O O . ASP A 144 ? 0.9548 0.9599 1.0146 -0.0281 -0.0333 -0.0008 510 ASP A O 1015 C CB . ASP A 144 ? 0.8895 0.9480 0.9101 -0.0078 -0.0333 -0.0110 510 ASP A CB 1016 C CG . ASP A 144 ? 0.8911 0.9872 0.9112 -0.0042 -0.0321 -0.0247 510 ASP A CG 1017 O OD1 . ASP A 144 ? 0.9301 1.0405 0.9459 0.0098 -0.0403 -0.0268 510 ASP A OD1 1018 O OD2 . ASP A 144 ? 0.8665 0.9783 0.8948 -0.0154 -0.0232 -0.0320 510 ASP A OD2 1019 N N . ARG A 145 ? 0.8857 0.9008 0.9343 -0.0454 -0.0064 0.0307 511 ARG A N 1020 C CA . ARG A 145 ? 0.8968 0.8847 0.9787 -0.0565 -0.0069 0.0437 511 ARG A CA 1021 C C . ARG A 145 ? 0.8680 0.8684 0.9661 -0.0729 0.0121 0.0549 511 ARG A C 1022 O O . ARG A 145 ? 0.8656 0.8668 0.9926 -0.0831 0.0096 0.0444 511 ARG A O 1023 C CB . ARG A 145 ? 0.9501 0.9096 1.0319 -0.0516 -0.0094 0.0690 511 ARG A CB 1024 C CG . ARG A 145 ? 1.0223 0.9594 1.0994 -0.0355 -0.0315 0.0589 511 ARG A CG 1025 C CD . ARG A 145 ? 1.1230 1.0272 1.2040 -0.0320 -0.0339 0.0866 511 ARG A CD 1026 N NE . ARG A 145 ? 1.2054 1.1230 1.2511 -0.0248 -0.0188 0.1081 511 ARG A NE 1027 C CZ . ARG A 145 ? 1.2682 1.1882 1.3127 -0.0326 0.0027 0.1372 511 ARG A CZ 1028 N NH1 . ARG A 145 ? 1.3102 1.2233 1.3954 -0.0510 0.0128 0.1506 511 ARG A NH1 1029 N NH2 . ARG A 145 ? 1.2731 1.2040 1.2759 -0.0199 0.0137 0.1535 511 ARG A NH2 1030 N N . THR A 146 ? 0.8103 0.8210 0.8876 -0.0723 0.0309 0.0761 512 THR A N 1031 C CA . THR A 146 ? 0.8270 0.8498 0.9183 -0.0838 0.0525 0.0923 512 THR A CA 1032 C C . THR A 146 ? 0.7668 0.8162 0.8534 -0.0883 0.0581 0.0708 512 THR A C 1033 O O . THR A 146 ? 0.7237 0.7897 0.7771 -0.0800 0.0564 0.0549 512 THR A O 1034 C CB . THR A 146 ? 0.8933 0.9207 0.9528 -0.0749 0.0725 0.1207 512 THR A CB 1035 O OG1 . THR A 146 ? 0.9371 0.9789 0.9464 -0.0598 0.0683 0.1060 512 THR A OG1 1036 C CG2 . THR A 146 ? 0.9285 0.9279 0.9985 -0.0717 0.0707 0.1490 512 THR A CG2 1037 N N . GLU A 147 ? 0.7399 0.7924 0.8642 -0.1017 0.0632 0.0712 513 GLU A N 1038 C CA . GLU A 147 ? 0.6526 0.7280 0.7763 -0.1060 0.0695 0.0540 513 GLU A CA 1039 C C . GLU A 147 ? 0.6477 0.7390 0.7745 -0.1099 0.0950 0.0738 513 GLU A C 1040 O O . GLU A 147 ? 0.7010 0.7877 0.8634 -0.1181 0.1052 0.0981 513 GLU A O 1041 C CB . GLU A 147 ? 0.5934 0.6631 0.7537 -0.1142 0.0543 0.0357 513 GLU A CB 1042 C CG . GLU A 147 ? 0.5693 0.6606 0.7338 -0.1189 0.0617 0.0219 513 GLU A CG 1043 C CD . GLU A 147 ? 0.6215 0.7063 0.8253 -0.1260 0.0475 0.0092 513 GLU A CD 1044 O OE1 . GLU A 147 ? 0.5852 0.6860 0.7998 -0.1305 0.0539 0.0021 513 GLU A OE1 1045 O OE2 . GLU A 147 ? 0.7101 0.7718 0.9322 -0.1251 0.0278 0.0050 513 GLU A OE2 1046 N N . VAL A 148 ? 0.6171 0.7275 0.7097 -0.1029 0.1049 0.0639 514 VAL A N 1047 C CA . VAL A 148 ? 0.5889 0.7155 0.6754 -0.1005 0.1298 0.0801 514 VAL A CA 1048 C C . VAL A 148 ? 0.5637 0.7069 0.6610 -0.1056 0.1330 0.0617 514 VAL A C 1049 O O . VAL A 148 ? 0.6217 0.7713 0.6893 -0.0997 0.1270 0.0396 514 VAL A O 1050 C CB . VAL A 148 ? 0.5729 0.7037 0.6012 -0.0820 0.1390 0.0857 514 VAL A CB 1051 C CG1 . VAL A 148 ? 0.5534 0.7006 0.5694 -0.0739 0.1664 0.1025 514 VAL A CG1 1052 C CG2 . VAL A 148 ? 0.5702 0.6841 0.5845 -0.0746 0.1355 0.1053 514 VAL A CG2 1053 N N . PRO A 149 ? 0.5352 0.6849 0.6798 -0.1169 0.1408 0.0713 515 PRO A N 1054 C CA . PRO A 149 ? 0.5059 0.6721 0.6639 -0.1204 0.1451 0.0570 515 PRO A CA 1055 C C . PRO A 149 ? 0.4985 0.6807 0.6186 -0.1072 0.1657 0.0591 515 PRO A C 1056 O O . PRO A 149 ? 0.4812 0.6698 0.5889 -0.0983 0.1865 0.0839 515 PRO A O 1057 C CB . PRO A 149 ? 0.4929 0.6633 0.7141 -0.1338 0.1496 0.0740 515 PRO A CB 1058 C CG . PRO A 149 ? 0.4986 0.6467 0.7433 -0.1406 0.1355 0.0853 515 PRO A CG 1059 C CD . PRO A 149 ? 0.5204 0.6604 0.7156 -0.1280 0.1415 0.0953 515 PRO A CD 1060 N N . GLN A 150 ? 0.4945 0.6818 0.5951 -0.1039 0.1595 0.0339 516 GLN A N 1061 C CA . GLN A 150 ? 0.5008 0.6975 0.5617 -0.0892 0.1730 0.0293 516 GLN A CA 1062 C C . GLN A 150 ? 0.5322 0.7455 0.6186 -0.0905 0.1871 0.0296 516 GLN A C 1063 O O . GLN A 150 ? 0.6071 0.8212 0.6992 -0.0940 0.1774 0.0083 516 GLN A O 1064 C CB . GLN A 150 ? 0.5097 0.6979 0.5341 -0.0840 0.1546 0.0016 516 GLN A CB 1065 C CG . GLN A 150 ? 0.4860 0.6620 0.4872 -0.0809 0.1396 0.0003 516 GLN A CG 1066 C CD . GLN A 150 ? 0.5854 0.7592 0.5481 -0.0648 0.1511 0.0182 516 GLN A CD 1067 O OE1 . GLN A 150 ? 0.5864 0.7527 0.5504 -0.0647 0.1503 0.0351 516 GLN A OE1 1068 N NE2 . GLN A 150 ? 0.6725 0.8510 0.5972 -0.0482 0.1612 0.0143 516 GLN A NE2 1069 N N . LEU A 151 ? 0.5769 0.8050 0.6813 -0.0867 0.2111 0.0565 517 LEU A N 1070 C CA . LEU A 151 ? 0.6313 0.8799 0.7662 -0.0865 0.2266 0.0606 517 LEU A CA 1071 C C . LEU A 151 ? 0.6304 0.8836 0.7176 -0.0669 0.2352 0.0449 517 LEU A C 1072 O O . LEU A 151 ? 0.6654 0.9152 0.7004 -0.0477 0.2443 0.0481 517 LEU A O 1073 C CB . LEU A 151 ? 0.6825 0.9500 0.8571 -0.0874 0.2523 0.0985 517 LEU A CB 1074 C CG . LEU A 151 ? 0.6822 0.9417 0.9131 -0.1077 0.2418 0.1156 517 LEU A CG 1075 C CD1 . LEU A 151 ? 0.6342 0.9149 0.9149 -0.1102 0.2687 0.1569 517 LEU A CD1 1076 C CD2 . LEU A 151 ? 0.6811 0.9337 0.9543 -0.1250 0.2149 0.0924 517 LEU A CD2 1077 N N . VAL A 152 ? 0.6043 0.8626 0.7076 -0.0699 0.2301 0.0268 518 VAL A N 1078 C CA . VAL A 152 ? 0.6464 0.9044 0.7093 -0.0518 0.2348 0.0092 518 VAL A CA 1079 C C . VAL A 152 ? 0.6728 0.9515 0.7234 -0.0307 0.2663 0.0303 518 VAL A C 1080 O O . VAL A 152 ? 0.6519 0.9532 0.7488 -0.0355 0.2859 0.0577 518 VAL A O 1081 C CB . VAL A 152 ? 0.5214 0.7795 0.6091 -0.0595 0.2231 -0.0116 518 VAL A CB 1082 C CG1 . VAL A 152 ? 0.4149 0.6976 0.5578 -0.0643 0.2379 0.0042 518 VAL A CG1 1083 C CG2 . VAL A 152 ? 0.4469 0.6941 0.4897 -0.0427 0.2199 -0.0346 518 VAL A CG2 1084 N N . ASN A 153 ? 0.7041 0.9751 0.6932 -0.0057 0.2705 0.0181 519 ASN A N 1085 C CA . ASN A 153 ? 0.6908 0.9808 0.6559 0.0219 0.3014 0.0354 519 ASN A CA 1086 C C . ASN A 153 ? 0.6451 0.9436 0.6149 0.0328 0.3071 0.0200 519 ASN A C 1087 O O . ASN A 153 ? 0.6503 0.9340 0.6297 0.0212 0.2845 -0.0067 519 ASN A O 1088 C CB . ASN A 153 ? 0.7709 1.0457 0.6573 0.0501 0.3019 0.0300 519 ASN A CB 1089 C CG . ASN A 153 ? 0.8487 1.1158 0.7264 0.0433 0.2979 0.0475 519 ASN A CG 1090 O OD1 . ASN A 153 ? 0.8933 1.1772 0.7786 0.0503 0.3239 0.0831 519 ASN A OD1 1091 N ND2 . ASN A 153 ? 0.9101 1.1526 0.7745 0.0306 0.2661 0.0247 519 ASN A ND2 1092 N N . ALA A 154 ? 0.7043 1.0277 0.6677 0.0570 0.3388 0.0391 520 ALA A N 1093 C CA . ALA A 154 ? 0.7009 1.0310 0.6641 0.0719 0.3443 0.0247 520 ALA A CA 1094 C C . ALA A 154 ? 0.7407 1.0395 0.6359 0.0922 0.3246 -0.0133 520 ALA A C 1095 O O . ALA A 154 ? 0.8233 1.1026 0.6573 0.1091 0.3172 -0.0218 520 ALA A O 1096 C CB . ALA A 154 ? 0.6967 1.0457 0.6640 0.0891 0.3670 0.0479 520 ALA A CB 1097 N N . ASN A 155 ? 0.7318 1.0219 0.6408 0.0893 0.3118 -0.0367 521 ASN A N 1098 C CA . ASN A 155 ? 0.8160 1.0717 0.6724 0.1054 0.2888 -0.0736 521 ASN A CA 1099 C C . ASN A 155 ? 0.8777 1.1002 0.7103 0.0905 0.2555 -0.0936 521 ASN A C 1100 O O . ASN A 155 ? 1.0116 1.2054 0.7912 0.1083 0.2367 -0.1195 521 ASN A O 1101 C CB . ASN A 155 ? 0.8852 1.1408 0.6759 0.1503 0.3064 -0.0774 521 ASN A CB 1102 C CG . ASN A 155 ? 0.9265 1.2086 0.7487 0.1598 0.3324 -0.0563 521 ASN A CG 1103 O OD1 . ASN A 155 ? 0.9403 1.2411 0.8200 0.1445 0.3374 -0.0517 521 ASN A OD1 1104 N ND2 . ASN A 155 ? 0.9716 1.2568 0.7574 0.1860 0.3467 -0.0435 521 ASN A ND2 1105 N N . GLN A 156 ? 0.8046 1.0313 0.6786 0.0592 0.2467 -0.0821 522 GLN A N 1106 C CA . GLN A 156 ? 0.7916 0.9937 0.6510 0.0447 0.2181 -0.0965 522 GLN A CA 1107 C C . GLN A 156 ? 0.7489 0.9500 0.6626 0.0114 0.2023 -0.0976 522 GLN A C 1108 O O . GLN A 156 ? 0.7383 0.9588 0.6998 -0.0016 0.2135 -0.0831 522 GLN A O 1109 C CB . GLN A 156 ? 0.8655 1.0725 0.6995 0.0504 0.2253 -0.0783 522 GLN A CB 1110 C CG . GLN A 156 ? 0.9648 1.1695 0.7318 0.0885 0.2384 -0.0780 522 GLN A CG 1111 C CD . GLN A 156 ? 1.0021 1.2080 0.7399 0.0949 0.2423 -0.0600 522 GLN A CD 1112 O OE1 . GLN A 156 ? 0.9784 1.1840 0.7464 0.0699 0.2326 -0.0504 522 GLN A OE1 1113 N NE2 . GLN A 156 ? 1.0610 1.2673 0.7362 0.1317 0.2566 -0.0553 522 GLN A NE2 1114 N N . TYR A 157 ? 0.6910 0.8704 0.5975 -0.0003 0.1755 -0.1147 523 TYR A N 1115 C CA . TYR A 157 ? 0.5787 0.7579 0.5288 -0.0271 0.1620 -0.1142 523 TYR A CA 1116 C C . TYR A 157 ? 0.5426 0.7295 0.5035 -0.0393 0.1616 -0.0978 523 TYR A C 1117 O O . TYR A 157 ? 0.5687 0.7556 0.4993 -0.0285 0.1664 -0.0900 523 TYR A O 1118 C CB . TYR A 157 ? 0.5415 0.6973 0.4873 -0.0335 0.1360 -0.1369 523 TYR A CB 1119 C CG . TYR A 157 ? 0.5386 0.6813 0.4808 -0.0242 0.1330 -0.1532 523 TYR A CG 1120 C CD1 . TYR A 157 ? 0.5063 0.6546 0.4847 -0.0335 0.1369 -0.1506 523 TYR A CD1 1121 C CD2 . TYR A 157 ? 0.6526 0.7749 0.5528 -0.0035 0.1241 -0.1722 523 TYR A CD2 1122 C CE1 . TYR A 157 ? 0.6109 0.7453 0.5863 -0.0239 0.1339 -0.1644 523 TYR A CE1 1123 C CE2 . TYR A 157 ? 0.7463 0.8525 0.6432 0.0064 0.1195 -0.1883 523 TYR A CE2 1124 C CZ . TYR A 157 ? 0.7349 0.8474 0.6708 -0.0046 0.1253 -0.1831 523 TYR A CZ 1125 O OH . TYR A 157 ? 0.8422 0.9367 0.7753 0.0062 0.1205 -0.1980 523 TYR A OH 1126 N N . SER A 158 ? 0.5205 0.7124 0.5216 -0.0590 0.1554 -0.0928 524 SER A N 1127 C CA . SER A 158 ? 0.5299 0.7242 0.5424 -0.0702 0.1504 -0.0812 524 SER A CA 1128 C C . SER A 158 ? 0.6069 0.7871 0.5920 -0.0691 0.1322 -0.0921 524 SER A C 1129 O O . SER A 158 ? 0.6626 0.8313 0.6406 -0.0693 0.1175 -0.1098 524 SER A O 1130 C CB . SER A 158 ? 0.5578 0.7565 0.6126 -0.0865 0.1435 -0.0793 524 SER A CB 1131 O OG . SER A 158 ? 0.6400 0.8369 0.7023 -0.0947 0.1354 -0.0718 524 SER A OG 1132 N N . PRO A 159 ? 0.5798 0.7606 0.5534 -0.0682 0.1319 -0.0806 525 PRO A N 1133 C CA . PRO A 159 ? 0.5411 0.7117 0.4958 -0.0681 0.1121 -0.0903 525 PRO A CA 1134 C C . PRO A 159 ? 0.5320 0.7027 0.5187 -0.0837 0.0970 -0.0972 525 PRO A C 1135 O O . PRO A 159 ? 0.5506 0.7161 0.5329 -0.0852 0.0796 -0.1078 525 PRO A O 1136 C CB . PRO A 159 ? 0.5305 0.7036 0.4728 -0.0639 0.1182 -0.0720 525 PRO A CB 1137 C CG . PRO A 159 ? 0.5783 0.7610 0.5199 -0.0561 0.1434 -0.0535 525 PRO A CG 1138 C CD . PRO A 159 ? 0.5794 0.7701 0.5575 -0.0657 0.1497 -0.0568 525 PRO A CD 1139 N N . CYS A 160 ? 0.4538 0.6318 0.4733 -0.0934 0.1033 -0.0908 526 CYS A N 1140 C CA . CYS A 160 ? 0.4090 0.5890 0.4538 -0.1031 0.0927 -0.0942 526 CYS A CA 1141 C C . CYS A 160 ? 0.4544 0.6327 0.5115 -0.1059 0.0893 -0.1048 526 CYS A C 1142 O O . CYS A 160 ? 0.4932 0.6754 0.5707 -0.1112 0.0846 -0.1044 526 CYS A O 1143 C CB . CYS A 160 ? 0.3675 0.5526 0.4364 -0.1080 0.0972 -0.0838 526 CYS A CB 1144 S SG . CYS A 160 ? 0.5514 0.7341 0.6158 -0.1071 0.0984 -0.0687 526 CYS A SG 1145 N N . VAL A 161 ? 0.4402 0.6118 0.4835 -0.1001 0.0920 -0.1132 527 VAL A N 1146 C CA . VAL A 161 ? 0.4528 0.6184 0.5088 -0.1026 0.0876 -0.1223 527 VAL A CA 1147 C C . VAL A 161 ? 0.5237 0.6844 0.5881 -0.1085 0.0708 -0.1284 527 VAL A C 1148 O O . VAL A 161 ? 0.5644 0.7217 0.6492 -0.1135 0.0667 -0.1306 527 VAL A O 1149 C CB . VAL A 161 ? 0.4179 0.5739 0.4559 -0.0925 0.0924 -0.1319 527 VAL A CB 1150 C CG1 . VAL A 161 ? 0.4329 0.5997 0.4716 -0.0866 0.1111 -0.1227 527 VAL A CG1 1151 C CG2 . VAL A 161 ? 0.4461 0.5899 0.4504 -0.0826 0.0825 -0.1428 527 VAL A CG2 1152 N N . SER A 162 ? 0.5188 0.6802 0.5714 -0.1077 0.0612 -0.1290 528 SER A N 1153 C CA . SER A 162 ? 0.5494 0.7104 0.6179 -0.1138 0.0436 -0.1336 528 SER A CA 1154 C C . SER A 162 ? 0.5295 0.7070 0.6278 -0.1211 0.0457 -0.1210 528 SER A C 1155 O O . SER A 162 ? 0.5496 0.7327 0.6747 -0.1275 0.0366 -0.1194 528 SER A O 1156 C CB . SER A 162 ? 0.5245 0.6807 0.5679 -0.1073 0.0294 -0.1408 528 SER A CB 1157 O OG . SER A 162 ? 0.5581 0.7237 0.5902 -0.1042 0.0359 -0.1296 528 SER A OG 1158 N N . ILE A 163 ? 0.4869 0.6722 0.5823 -0.1187 0.0573 -0.1116 529 ILE A N 1159 C CA . ILE A 163 ? 0.4603 0.6592 0.5755 -0.1196 0.0589 -0.1019 529 ILE A CA 1160 C C . ILE A 163 ? 0.4855 0.6869 0.6102 -0.1175 0.0696 -0.0973 529 ILE A C 1161 O O . ILE A 163 ? 0.5020 0.7136 0.6394 -0.1141 0.0718 -0.0902 529 ILE A O 1162 C CB . ILE A 163 ? 0.4181 0.6206 0.5219 -0.1152 0.0573 -0.0970 529 ILE A CB 1163 C CG1 . ILE A 163 ? 0.3551 0.5505 0.4458 -0.1125 0.0663 -0.0945 529 ILE A CG1 1164 C CG2 . ILE A 163 ? 0.5107 0.7110 0.6014 -0.1144 0.0455 -0.1011 529 ILE A CG2 1165 C CD1 . ILE A 163 ? 0.3598 0.5539 0.4429 -0.1090 0.0639 -0.0879 529 ILE A CD1 1166 N N . VAL A 164 ? 0.5476 0.7407 0.6644 -0.1167 0.0761 -0.1014 530 VAL A N 1167 C CA . VAL A 164 ? 0.4732 0.6679 0.5988 -0.1134 0.0832 -0.0990 530 VAL A CA 1168 C C . VAL A 164 ? 0.4509 0.6416 0.5875 -0.1152 0.0844 -0.0999 530 VAL A C 1169 O O . VAL A 164 ? 0.4951 0.6752 0.6268 -0.1177 0.0822 -0.1074 530 VAL A O 1170 C CB . VAL A 164 ? 0.5056 0.6971 0.6254 -0.1114 0.0890 -0.1009 530 VAL A CB 1171 C CG1 . VAL A 164 ? 0.5159 0.7088 0.6463 -0.1071 0.0925 -0.1009 530 VAL A CG1 1172 C CG2 . VAL A 164 ? 0.4615 0.6547 0.5786 -0.1110 0.0872 -0.0965 530 VAL A CG2 1173 N N . PRO A 165 ? 0.4409 0.6383 0.5907 -0.1116 0.0879 -0.0917 531 PRO A N 1174 C CA . PRO A 165 ? 0.3918 0.5844 0.5560 -0.1130 0.0905 -0.0878 531 PRO A CA 1175 C C . PRO A 165 ? 0.3668 0.5486 0.5241 -0.1095 0.0944 -0.0941 531 PRO A C 1176 O O . PRO A 165 ? 0.3497 0.5332 0.4965 -0.1051 0.0966 -0.0986 531 PRO A O 1177 C CB . PRO A 165 ? 0.3456 0.5516 0.5195 -0.1050 0.0969 -0.0734 531 PRO A CB 1178 C CG . PRO A 165 ? 0.3588 0.5706 0.5159 -0.0955 0.0964 -0.0762 531 PRO A CG 1179 C CD . PRO A 165 ? 0.3998 0.6082 0.5489 -0.1028 0.0896 -0.0848 531 PRO A CD 1180 N N . SER A 166 ? 0.4209 0.5917 0.5884 -0.1114 0.0945 -0.0936 532 SER A N 1181 C CA . SER A 166 ? 0.4434 0.6032 0.6046 -0.1063 0.0976 -0.1005 532 SER A CA 1182 C C . SER A 166 ? 0.4594 0.6271 0.6189 -0.0959 0.1038 -0.0949 532 SER A C 1183 O O . SER A 166 ? 0.4945 0.6602 0.6496 -0.0903 0.1059 -0.1010 532 SER A O 1184 C CB . SER A 166 ? 0.4261 0.5680 0.6000 -0.1097 0.0939 -0.1011 532 SER A CB 1185 O OG . SER A 166 ? 0.4657 0.6104 0.6586 -0.1089 0.0986 -0.0846 532 SER A OG 1186 N N . THR A 167 ? 0.4564 0.6344 0.6191 -0.0910 0.1060 -0.0835 533 THR A N 1187 C CA . THR A 167 ? 0.4907 0.6751 0.6456 -0.0769 0.1077 -0.0806 533 THR A CA 1188 C C . THR A 167 ? 0.4313 0.6277 0.5789 -0.0704 0.1059 -0.0764 533 THR A C 1189 O O . THR A 167 ? 0.3862 0.5898 0.5387 -0.0694 0.1104 -0.0646 533 THR A O 1190 C CB . THR A 167 ? 0.5603 0.7400 0.7185 -0.0675 0.1136 -0.0693 533 THR A CB 1191 O OG1 . THR A 167 ? 0.6736 0.8393 0.8370 -0.0707 0.1135 -0.0754 533 THR A OG1 1192 C CG2 . THR A 167 ? 0.5041 0.6904 0.6475 -0.0484 0.1125 -0.0676 533 THR A CG2 1193 N N . VAL A 168 ? 0.4019 0.6005 0.5413 -0.0656 0.0988 -0.0856 534 VAL A N 1194 C CA . VAL A 168 ? 0.3838 0.5887 0.5137 -0.0571 0.0937 -0.0855 534 VAL A CA 1195 C C . VAL A 168 ? 0.4250 0.6347 0.5413 -0.0358 0.0961 -0.0776 534 VAL A C 1196 O O . VAL A 168 ? 0.4314 0.6374 0.5413 -0.0245 0.0946 -0.0789 534 VAL A O 1197 C CB . VAL A 168 ? 0.3547 0.5561 0.4848 -0.0577 0.0821 -0.0976 534 VAL A CB 1198 C CG1 . VAL A 168 ? 0.3243 0.5265 0.4431 -0.0464 0.0733 -0.1000 534 VAL A CG1 1199 C CG2 . VAL A 168 ? 0.2799 0.4793 0.4201 -0.0752 0.0840 -0.1004 534 VAL A CG2 1200 N N . TRP A 169 ? 0.4288 0.6480 0.5393 -0.0279 0.1007 -0.0684 535 TRP A N 1201 C CA . TRP A 169 ? 0.4078 0.6351 0.5014 -0.0034 0.1076 -0.0567 535 TRP A CA 1202 C C . TRP A 169 ? 0.4592 0.6806 0.5256 0.0200 0.0936 -0.0702 535 TRP A C 1203 O O . TRP A 169 ? 0.5105 0.7290 0.5601 0.0390 0.0923 -0.0697 535 TRP A O 1204 C CB . TRP A 169 ? 0.3822 0.6259 0.4819 -0.0006 0.1185 -0.0413 535 TRP A CB 1205 C CG . TRP A 169 ? 0.3968 0.6540 0.4813 0.0263 0.1321 -0.0228 535 TRP A CG 1206 C CD1 . TRP A 169 ? 0.4359 0.7017 0.4937 0.0539 0.1325 -0.0222 535 TRP A CD1 1207 C CD2 . TRP A 169 ? 0.4709 0.7339 0.5641 0.0313 0.1487 -0.0005 535 TRP A CD2 1208 N NE1 . TRP A 169 ? 0.4725 0.7522 0.5187 0.0778 0.1505 0.0003 535 TRP A NE1 1209 C CE2 . TRP A 169 ? 0.5215 0.7998 0.5913 0.0632 0.1613 0.0157 535 TRP A CE2 1210 C CE3 . TRP A 169 ? 0.5711 0.8262 0.6887 0.0137 0.1540 0.0079 535 TRP A CE3 1211 C CZ2 . TRP A 169 ? 0.5672 0.8555 0.6394 0.0770 0.1816 0.0439 535 TRP A CZ2 1212 C CZ3 . TRP A 169 ? 0.5684 0.8298 0.6915 0.0253 0.1713 0.0342 535 TRP A CZ3 1213 C CH2 . TRP A 169 ? 0.5647 0.8438 0.6662 0.0562 0.1862 0.0537 535 TRP A CH2 1214 N N . GLU A 170 ? 0.4821 0.6994 0.5442 0.0199 0.0808 -0.0830 536 GLU A N 1215 C CA . GLU A 170 ? 0.5041 0.7105 0.5451 0.0405 0.0611 -0.1000 536 GLU A CA 1216 C C . GLU A 170 ? 0.4852 0.6789 0.5457 0.0223 0.0435 -0.1163 536 GLU A C 1217 O O . GLU A 170 ? 0.4841 0.6790 0.5632 0.0002 0.0479 -0.1135 536 GLU A O 1218 C CB . GLU A 170 ? 0.5619 0.7723 0.5769 0.0658 0.0601 -0.0992 536 GLU A CB 1219 C CG . GLU A 170 ? 0.6491 0.8762 0.6443 0.0898 0.0802 -0.0791 536 GLU A CG 1220 C CD . GLU A 170 ? 0.8095 1.0304 0.7676 0.1246 0.0726 -0.0846 536 GLU A CD 1221 O OE1 . GLU A 170 ? 0.9021 1.1085 0.8607 0.1226 0.0551 -0.1002 536 GLU A OE1 1222 O OE2 . GLU A 170 ? 0.8517 1.0838 0.7797 0.1563 0.0842 -0.0728 536 GLU A OE2 1223 N N . ASP A 171 ? 0.4586 0.6408 0.5164 0.0327 0.0229 -0.1320 537 ASP A N 1224 C CA . ASP A 171 ? 0.4184 0.5901 0.5036 0.0157 0.0058 -0.1440 537 ASP A CA 1225 C C . ASP A 171 ? 0.3728 0.5362 0.4590 0.0122 -0.0020 -0.1477 537 ASP A C 1226 O O . ASP A 171 ? 0.3768 0.5339 0.4370 0.0347 -0.0105 -0.1537 537 ASP A O 1227 C CB . ASP A 171 ? 0.4395 0.6008 0.5270 0.0297 -0.0194 -0.1608 537 ASP A CB 1228 C CG . ASP A 171 ? 0.4741 0.6279 0.6029 0.0097 -0.0364 -0.1692 537 ASP A CG 1229 O OD1 . ASP A 171 ? 0.5038 0.6664 0.6608 -0.0154 -0.0215 -0.1585 537 ASP A OD1 1230 O OD2 . ASP A 171 ? 0.5575 0.6962 0.6917 0.0204 -0.0650 -0.1858 537 ASP A OD2 1231 N N . GLY A 172 ? 0.3335 0.4963 0.4470 -0.0133 0.0018 -0.1431 538 GLY A N 1232 C CA . GLY A 172 ? 0.3379 0.4910 0.4551 -0.0183 -0.0052 -0.1442 538 GLY A CA 1233 C C . GLY A 172 ? 0.5031 0.6663 0.6041 -0.0180 0.0114 -0.1330 538 GLY A C 1234 O O . GLY A 172 ? 0.4557 0.6114 0.5516 -0.0145 0.0050 -0.1344 538 GLY A O 1235 N N . ASP A 173 ? 0.3633 0.6787 0.4131 0.0238 0.0045 -0.1145 539 ASP A N 1236 C CA . ASP A 173 ? 0.3247 0.6459 0.3692 0.0191 0.0112 -0.0982 539 ASP A CA 1237 C C . ASP A 173 ? 0.4381 0.7219 0.4855 -0.0002 0.0088 -0.1010 539 ASP A C 1238 O O . ASP A 173 ? 0.5110 0.7618 0.5643 -0.0157 0.0091 -0.1048 539 ASP A O 1239 C CB . ASP A 173 ? 0.3296 0.6617 0.3761 0.0114 0.0271 -0.0714 539 ASP A CB 1240 C CG . ASP A 173 ? 0.3443 0.7248 0.3861 0.0350 0.0328 -0.0587 539 ASP A CG 1241 O OD1 . ASP A 173 ? 0.3723 0.7793 0.4049 0.0596 0.0232 -0.0740 539 ASP A OD1 1242 O OD2 . ASP A 173 ? 0.3485 0.7416 0.3977 0.0304 0.0466 -0.0333 539 ASP A OD2 1243 N N . TYR A 174 ? 0.5084 0.8007 0.5513 0.0029 0.0072 -0.0975 540 TYR A N 1244 C CA . TYR A 174 ? 0.4713 0.7338 0.5141 -0.0099 0.0035 -0.1006 540 TYR A CA 1245 C C . TYR A 174 ? 0.4411 0.6994 0.4835 -0.0245 0.0125 -0.0824 540 TYR A C 1246 O O . TYR A 174 ? 0.4105 0.6973 0.4554 -0.0193 0.0181 -0.0692 540 TYR A O 1247 C CB . TYR A 174 ? 0.5078 0.7814 0.5473 0.0064 -0.0084 -0.1148 540 TYR A CB 1248 C CG . TYR A 174 ? 0.4875 0.7323 0.5265 -0.0033 -0.0126 -0.1175 540 TYR A CG 1249 C CD1 . TYR A 174 ? 0.4429 0.6497 0.4876 -0.0175 -0.0126 -0.1204 540 TYR A CD1 1250 C CD2 . TYR A 174 ? 0.4677 0.7262 0.5009 0.0039 -0.0158 -0.1157 540 TYR A CD2 1251 C CE1 . TYR A 174 ? 0.4437 0.6266 0.4864 -0.0233 -0.0151 -0.1200 540 TYR A CE1 1252 C CE2 . TYR A 174 ? 0.4436 0.6774 0.4749 -0.0026 -0.0198 -0.1176 540 TYR A CE2 1253 C CZ . TYR A 174 ? 0.4635 0.6595 0.4987 -0.0156 -0.0193 -0.1191 540 TYR A CZ 1254 O OH . TYR A 174 ? 0.5206 0.6941 0.5524 -0.0192 -0.0219 -0.1181 540 TYR A OH 1255 N N . TYR A 175 ? 0.3849 0.6094 0.4266 -0.0412 0.0137 -0.0816 541 TYR A N 1256 C CA . TYR A 175 ? 0.4050 0.6239 0.4477 -0.0538 0.0186 -0.0696 541 TYR A CA 1257 C C . TYR A 175 ? 0.4264 0.6236 0.4614 -0.0579 0.0127 -0.0751 541 TYR A C 1258 O O . TYR A 175 ? 0.4395 0.6109 0.4701 -0.0602 0.0104 -0.0824 541 TYR A O 1259 C CB . TYR A 175 ? 0.3934 0.5963 0.4408 -0.0679 0.0266 -0.0620 541 TYR A CB 1260 C CG . TYR A 175 ? 0.4168 0.6373 0.4709 -0.0629 0.0326 -0.0564 541 TYR A CG 1261 C CD1 . TYR A 175 ? 0.3368 0.5900 0.3996 -0.0555 0.0379 -0.0430 541 TYR A CD1 1262 C CD2 . TYR A 175 ? 0.3823 0.5888 0.4356 -0.0644 0.0338 -0.0626 541 TYR A CD2 1263 C CE1 . TYR A 175 ? 0.3694 0.6406 0.4367 -0.0481 0.0444 -0.0354 541 TYR A CE1 1264 C CE2 . TYR A 175 ? 0.3633 0.5873 0.4214 -0.0579 0.0387 -0.0578 541 TYR A CE2 1265 C CZ . TYR A 175 ? 0.3878 0.6441 0.4512 -0.0490 0.0441 -0.0439 541 TYR A CZ 1266 O OH . TYR A 175 ? 0.4073 0.6829 0.4739 -0.0399 0.0499 -0.0368 541 TYR A OH 1267 N N . ARG A 176 ? 0.4675 0.6767 0.5032 -0.0579 0.0109 -0.0702 542 ARG A N 1268 C CA . ARG A 176 ? 0.5354 0.7303 0.5621 -0.0575 0.0044 -0.0752 542 ARG A CA 1269 C C . ARG A 176 ? 0.4988 0.6988 0.5294 -0.0649 0.0040 -0.0689 542 ARG A C 1270 O O . ARG A 176 ? 0.5215 0.7487 0.5658 -0.0638 0.0055 -0.0614 542 ARG A O 1271 C CB . ARG A 176 ? 0.6317 0.8417 0.6558 -0.0417 -0.0032 -0.0831 542 ARG A CB 1272 C CG . ARG A 176 ? 0.7361 0.9436 0.7537 -0.0384 -0.0096 -0.0850 542 ARG A CG 1273 C CD . ARG A 176 ? 0.7313 0.9754 0.7555 -0.0300 -0.0110 -0.0806 542 ARG A CD 1274 N NE . ARG A 176 ? 0.6247 0.8929 0.6493 -0.0127 -0.0138 -0.0865 542 ARG A NE 1275 C CZ . ARG A 176 ? 0.6260 0.9317 0.6553 -0.0006 -0.0135 -0.0818 542 ARG A CZ 1276 N NH1 . ARG A 176 ? 0.5987 0.9207 0.6380 -0.0067 -0.0102 -0.0701 542 ARG A NH1 1277 N NH2 . ARG A 176 ? 0.7250 1.0542 0.7510 0.0189 -0.0169 -0.0894 542 ARG A NH2 1278 N N . LYS A 177 ? 0.4899 0.6655 0.5106 -0.0711 0.0018 -0.0716 543 LYS A N 1279 C CA . LYS A 177 ? 0.4790 0.6579 0.5039 -0.0766 -0.0020 -0.0704 543 LYS A CA 1280 C C . LYS A 177 ? 0.4950 0.6595 0.5022 -0.0712 -0.0088 -0.0763 543 LYS A C 1281 O O . LYS A 177 ? 0.5377 0.6781 0.5293 -0.0696 -0.0069 -0.0778 543 LYS A O 1282 C CB . LYS A 177 ? 0.5440 0.7107 0.5751 -0.0882 0.0018 -0.0687 543 LYS A CB 1283 C CG . LYS A 177 ? 0.5898 0.7544 0.6250 -0.0926 -0.0054 -0.0732 543 LYS A CG 1284 C CD . LYS A 177 ? 0.6589 0.8075 0.6978 -0.1013 -0.0032 -0.0752 543 LYS A CD 1285 C CE . LYS A 177 ? 0.7460 0.8917 0.7886 -0.1030 -0.0136 -0.0848 543 LYS A CE 1286 N NZ . LYS A 177 ? 0.7781 0.9081 0.8241 -0.1090 -0.0129 -0.0897 543 LYS A NZ 1287 N N . GLN A 178 ? 0.5377 0.7190 0.5491 -0.0673 -0.0160 -0.0777 544 GLN A N 1288 C CA . GLN A 178 ? 0.5728 0.7441 0.5667 -0.0595 -0.0231 -0.0826 544 GLN A CA 1289 C C . GLN A 178 ? 0.5504 0.7088 0.5359 -0.0632 -0.0266 -0.0867 544 GLN A C 1290 O O . GLN A 178 ? 0.5478 0.7160 0.5502 -0.0710 -0.0296 -0.0891 544 GLN A O 1291 C CB . GLN A 178 ? 0.6153 0.8122 0.6172 -0.0522 -0.0305 -0.0839 544 GLN A CB 1292 C CG . GLN A 178 ? 0.7148 0.9030 0.6976 -0.0412 -0.0379 -0.0882 544 GLN A CG 1293 C CD . GLN A 178 ? 0.8581 1.0726 0.8489 -0.0325 -0.0447 -0.0897 544 GLN A CD 1294 O OE1 . GLN A 178 ? 0.9031 1.1425 0.9114 -0.0323 -0.0423 -0.0864 544 GLN A OE1 1295 N NE2 . GLN A 178 ? 0.9347 1.1462 0.9118 -0.0231 -0.0526 -0.0936 544 GLN A NE2 1296 N N . LEU A 179 ? 0.5657 0.7031 0.5271 -0.0559 -0.0262 -0.0873 545 LEU A N 1297 C CA . LEU A 179 ? 0.6104 0.7370 0.5577 -0.0545 -0.0291 -0.0919 545 LEU A CA 1298 C C . LEU A 179 ? 0.5884 0.7237 0.5241 -0.0433 -0.0406 -0.0985 545 LEU A C 1299 O O . LEU A 179 ? 0.5850 0.7224 0.5119 -0.0336 -0.0426 -0.0956 545 LEU A O 1300 C CB . LEU A 179 ? 0.6587 0.7605 0.5858 -0.0508 -0.0192 -0.0856 545 LEU A CB 1301 C CG . LEU A 179 ? 0.5761 0.6686 0.5142 -0.0609 -0.0086 -0.0805 545 LEU A CG 1302 C CD1 . LEU A 179 ? 0.5584 0.6287 0.4803 -0.0567 0.0013 -0.0730 545 LEU A CD1 1303 C CD2 . LEU A 179 ? 0.5330 0.6336 0.4878 -0.0721 -0.0094 -0.0851 545 LEU A CD2 1304 N N . SER A 180 ? 0.4876 0.6284 0.4252 -0.0435 -0.0494 -0.1089 546 SER A N 1305 C CA . SER A 180 ? 0.4980 0.6490 0.4243 -0.0311 -0.0626 -0.1184 546 SER A CA 1306 C C . SER A 180 ? 0.5820 0.7167 0.4697 -0.0140 -0.0589 -0.1137 546 SER A C 1307 O O . SER A 180 ? 0.6387 0.7549 0.5132 -0.0140 -0.0470 -0.1053 546 SER A O 1308 C CB . SER A 180 ? 0.5089 0.6707 0.4529 -0.0353 -0.0756 -0.1344 546 SER A CB 1309 O OG . SER A 180 ? 0.5566 0.7026 0.4864 -0.0339 -0.0731 -0.1391 546 SER A OG 1310 N N . PRO A 181 ? 0.5837 0.7270 0.4551 0.0018 -0.0681 -0.1172 547 PRO A N 1311 C CA . PRO A 181 ? 0.6624 0.7939 0.4968 0.0216 -0.0639 -0.1098 547 PRO A CA 1312 C C . PRO A 181 ? 0.7332 0.8569 0.5485 0.0277 -0.0613 -0.1136 547 PRO A C 1313 O O . PRO A 181 ? 0.7562 0.8652 0.5477 0.0378 -0.0483 -0.0992 547 PRO A O 1314 C CB . PRO A 181 ? 0.6656 0.8153 0.4906 0.0371 -0.0791 -0.1189 547 PRO A CB 1315 C CG . PRO A 181 ? 0.6207 0.7863 0.4778 0.0248 -0.0851 -0.1227 547 PRO A CG 1316 C CD . PRO A 181 ? 0.5758 0.7421 0.4636 0.0032 -0.0812 -0.1253 547 PRO A CD 1317 N N . LEU A 182 ? 0.7625 0.8969 0.5916 0.0221 -0.0735 -0.1325 548 LEU A N 1318 C CA . LEU A 182 ? 0.7078 0.8368 0.5212 0.0288 -0.0739 -0.1408 548 LEU A CA 1319 C C . LEU A 182 ? 0.6538 0.7636 0.4696 0.0171 -0.0556 -0.1270 548 LEU A C 1320 O O . LEU A 182 ? 0.6546 0.7561 0.4461 0.0281 -0.0476 -0.1229 548 LEU A O 1321 C CB . LEU A 182 ? 0.6841 0.8269 0.5233 0.0223 -0.0931 -0.1662 548 LEU A CB 1322 C CG . LEU A 182 ? 0.6944 0.8372 0.5196 0.0341 -0.1021 -0.1846 548 LEU A CG 1323 C CD1 . LEU A 182 ? 0.7329 0.8613 0.5750 0.0178 -0.0928 -0.1831 548 LEU A CD1 1324 C CD2 . LEU A 182 ? 0.7013 0.8432 0.4751 0.0631 -0.0970 -0.1788 548 LEU A CD2 1325 N N . GLU A 183 ? 0.6077 0.7135 0.4527 -0.0032 -0.0489 -0.1198 549 GLU A N 1326 C CA . GLU A 183 ? 0.6273 0.7171 0.4781 -0.0145 -0.0330 -0.1082 549 GLU A CA 1327 C C . GLU A 183 ? 0.6749 0.7522 0.5182 -0.0120 -0.0187 -0.0883 549 GLU A C 1328 O O . GLU A 183 ? 0.7349 0.8033 0.5949 -0.0245 -0.0088 -0.0802 549 GLU A O 1329 C CB . GLU A 183 ? 0.6211 0.7155 0.5084 -0.0355 -0.0342 -0.1123 549 GLU A CB 1330 C CG . GLU A 183 ? 0.6829 0.7836 0.5863 -0.0408 -0.0454 -0.1293 549 GLU A CG 1331 C CD . GLU A 183 ? 0.6851 0.7894 0.6262 -0.0606 -0.0430 -0.1276 549 GLU A CD 1332 O OE1 . GLU A 183 ? 0.6469 0.7500 0.6050 -0.0669 -0.0482 -0.1376 549 GLU A OE1 1333 O OE2 . GLU A 183 ? 0.7117 0.8207 0.6656 -0.0680 -0.0361 -0.1162 549 GLU A OE2 1334 N N . GLY A 184 ? 0.6944 0.7714 0.5153 0.0051 -0.0187 -0.0811 550 GLY A N 1335 C CA . GLY A 184 ? 0.7135 0.7762 0.5311 0.0093 -0.0057 -0.0614 550 GLY A CA 1336 C C . GLY A 184 ? 0.7727 0.8372 0.6095 0.0034 -0.0094 -0.0600 550 GLY A C 1337 O O . GLY A 184 ? 0.8963 0.9481 0.7359 0.0072 -0.0015 -0.0462 550 GLY A O 1338 N N . GLY A 185 ? 0.7442 0.8255 0.5974 -0.0050 -0.0215 -0.0739 551 GLY A N 1339 C CA . GLY A 185 ? 0.6625 0.7509 0.5324 -0.0079 -0.0257 -0.0740 551 GLY A CA 1340 C C . GLY A 185 ? 0.6700 0.7481 0.5593 -0.0182 -0.0169 -0.0680 551 GLY A C 1341 O O . GLY A 185 ? 0.6651 0.7318 0.5585 -0.0259 -0.0076 -0.0639 551 GLY A O 1342 N N . GLY A 186 ? 0.6325 0.7164 0.5343 -0.0168 -0.0208 -0.0690 552 GLY A N 1343 C CA . GLY A 186 ? 0.5492 0.6268 0.4702 -0.0230 -0.0161 -0.0677 552 GLY A CA 1344 C C . GLY A 186 ? 0.5547 0.6469 0.4922 -0.0355 -0.0158 -0.0741 552 GLY A C 1345 O O . GLY A 186 ? 0.5541 0.6676 0.4973 -0.0386 -0.0217 -0.0797 552 GLY A O 1346 N N . TRP A 187 ? 0.5387 0.6203 0.4870 -0.0422 -0.0084 -0.0720 553 TRP A N 1347 C CA . TRP A 187 ? 0.5337 0.6293 0.4970 -0.0516 -0.0069 -0.0760 553 TRP A CA 1348 C C . TRP A 187 ? 0.5491 0.6304 0.5144 -0.0603 0.0024 -0.0724 553 TRP A C 1349 O O . TRP A 187 ? 0.4676 0.5285 0.4296 -0.0590 0.0086 -0.0667 553 TRP A O 1350 C CB . TRP A 187 ? 0.5503 0.6567 0.5280 -0.0470 -0.0102 -0.0811 553 TRP A CB 1351 C CG . TRP A 187 ? 0.5486 0.6702 0.5252 -0.0363 -0.0190 -0.0852 553 TRP A CG 1352 C CD1 . TRP A 187 ? 0.5723 0.6819 0.5433 -0.0263 -0.0234 -0.0855 553 TRP A CD1 1353 C CD2 . TRP A 187 ? 0.5260 0.6789 0.5093 -0.0336 -0.0235 -0.0881 553 TRP A CD2 1354 N NE1 . TRP A 187 ? 0.5810 0.7122 0.5526 -0.0173 -0.0316 -0.0906 553 TRP A NE1 1355 C CE2 . TRP A 187 ? 0.5696 0.7289 0.5490 -0.0214 -0.0313 -0.0918 553 TRP A CE2 1356 C CE3 . TRP A 187 ? 0.5651 0.7421 0.5598 -0.0395 -0.0207 -0.0857 553 TRP A CE3 1357 C CZ2 . TRP A 187 ? 0.6375 0.8285 0.6229 -0.0148 -0.0361 -0.0939 553 TRP A CZ2 1358 C CZ3 . TRP A 187 ? 0.6214 0.8300 0.6246 -0.0333 -0.0243 -0.0853 553 TRP A CZ3 1359 C CH2 . TRP A 187 ? 0.6187 0.8350 0.6166 -0.0210 -0.0319 -0.0898 553 TRP A CH2 1360 N N . LEU A 188 ? 0.5813 0.6744 0.5546 -0.0687 0.0040 -0.0741 554 LEU A N 1361 C CA . LEU A 188 ? 0.5534 0.6372 0.5324 -0.0763 0.0121 -0.0720 554 LEU A CA 1362 C C . LEU A 188 ? 0.6002 0.6981 0.5957 -0.0767 0.0121 -0.0747 554 LEU A C 1363 O O . LEU A 188 ? 0.6173 0.7381 0.6207 -0.0763 0.0093 -0.0754 554 LEU A O 1364 C CB . LEU A 188 ? 0.5197 0.6050 0.4970 -0.0836 0.0137 -0.0721 554 LEU A CB 1365 C CG . LEU A 188 ? 0.5078 0.5828 0.4891 -0.0904 0.0223 -0.0698 554 LEU A CG 1366 C CD1 . LEU A 188 ? 0.5041 0.5581 0.4755 -0.0873 0.0294 -0.0651 554 LEU A CD1 1367 C CD2 . LEU A 188 ? 0.5046 0.5811 0.4872 -0.0964 0.0217 -0.0721 554 LEU A CD2 1368 N N . VAL A 189 ? 0.5678 0.6542 0.5704 -0.0760 0.0151 -0.0759 555 VAL A N 1369 C CA . VAL A 189 ? 0.5681 0.6689 0.5847 -0.0716 0.0120 -0.0825 555 VAL A CA 1370 C C . VAL A 189 ? 0.5405 0.6355 0.5667 -0.0771 0.0181 -0.0827 555 VAL A C 1371 O O . VAL A 189 ? 0.5738 0.6477 0.6018 -0.0818 0.0235 -0.0794 555 VAL A O 1372 C CB . VAL A 189 ? 0.6623 0.7577 0.6852 -0.0618 0.0046 -0.0896 555 VAL A CB 1373 C CG1 . VAL A 189 ? 0.7387 0.8465 0.7769 -0.0551 -0.0005 -0.1006 555 VAL A CG1 1374 C CG2 . VAL A 189 ? 0.6230 0.7306 0.6371 -0.0540 -0.0023 -0.0907 555 VAL A CG2 1375 N N . ALA A 190 ? 0.4873 0.6034 0.5202 -0.0751 0.0179 -0.0850 556 ALA A N 1376 C CA . ALA A 190 ? 0.4424 0.5566 0.4842 -0.0785 0.0227 -0.0859 556 ALA A CA 1377 C C . ALA A 190 ? 0.4522 0.5918 0.5025 -0.0676 0.0179 -0.0935 556 ALA A C 1378 O O . ALA A 190 ? 0.4568 0.6202 0.5039 -0.0579 0.0135 -0.0945 556 ALA A O 1379 C CB . ALA A 190 ? 0.3671 0.4787 0.4042 -0.0882 0.0309 -0.0767 556 ALA A CB 1380 N N . SER A 191 ? 0.5014 0.6385 0.5623 -0.0674 0.0186 -0.0990 557 SER A N 1381 C CA . SER A 191 ? 0.4447 0.6082 0.5117 -0.0543 0.0133 -0.1079 557 SER A CA 1382 C C . SER A 191 ? 0.4371 0.6034 0.5079 -0.0585 0.0206 -0.1033 557 SER A C 1383 O O . SER A 191 ? 0.3902 0.5338 0.4661 -0.0701 0.0262 -0.1005 557 SER A O 1384 C CB . SER A 191 ? 0.3939 0.5549 0.4757 -0.0444 0.0009 -0.1266 557 SER A CB 1385 O OG . SER A 191 ? 0.4291 0.6189 0.5146 -0.0279 -0.0064 -0.1387 557 SER A OG 1386 N N . GLY A 192 ? 0.4019 0.5978 0.4699 -0.0473 0.0213 -0.1011 558 GLY A N 1387 C CA . GLY A 192 ? 0.3654 0.5664 0.4362 -0.0492 0.0285 -0.0949 558 GLY A CA 1388 C C . GLY A 192 ? 0.3677 0.5945 0.4432 -0.0313 0.0217 -0.1067 558 GLY A C 1389 O O . GLY A 192 ? 0.3935 0.6464 0.4650 -0.0132 0.0136 -0.1150 558 GLY A O 1390 N N . SER A 193 ? 0.3501 0.5714 0.4334 -0.0345 0.0244 -0.1087 559 SER A N 1391 C CA . SER A 193 ? 0.4009 0.6483 0.4887 -0.0164 0.0174 -0.1208 559 SER A CA 1392 C C . SER A 193 ? 0.4102 0.6757 0.4906 -0.0121 0.0283 -0.1040 559 SER A C 1393 O O . SER A 193 ? 0.4377 0.6867 0.5166 -0.0274 0.0402 -0.0867 559 SER A O 1394 C CB . SER A 193 ? 0.4096 0.6399 0.5181 -0.0213 0.0100 -0.1384 559 SER A CB 1395 O OG . SER A 193 ? 0.4261 0.6378 0.5478 -0.0256 0.0007 -0.1515 559 SER A OG 1396 N N . THR A 194 ? 0.4374 0.7373 0.5141 0.0106 0.0236 -0.1097 560 THR A N 1397 C CA . THR A 194 ? 0.4175 0.7362 0.4889 0.0177 0.0343 -0.0924 560 THR A CA 1398 C C . THR A 194 ? 0.3799 0.7103 0.4575 0.0297 0.0273 -0.1075 560 THR A C 1399 O O . THR A 194 ? 0.3879 0.7270 0.4726 0.0416 0.0115 -0.1331 560 THR A O 1400 C CB . THR A 194 ? 0.4338 0.7925 0.4921 0.0387 0.0396 -0.0763 560 THR A CB 1401 O OG1 . THR A 194 ? 0.4950 0.8877 0.5459 0.0670 0.0261 -0.0959 560 THR A OG1 1402 C CG2 . THR A 194 ? 0.5200 0.8715 0.5765 0.0282 0.0448 -0.0633 560 THR A CG2 1403 N N . VAL A 195 ? 0.3649 0.6949 0.4427 0.0266 0.0380 -0.0927 561 VAL A N 1404 C CA . VAL A 195 ? 0.4076 0.7545 0.4894 0.0409 0.0328 -0.1036 561 VAL A CA 1405 C C . VAL A 195 ? 0.4012 0.7782 0.4705 0.0580 0.0443 -0.0803 561 VAL A C 1406 O O . VAL A 195 ? 0.3926 0.7573 0.4618 0.0453 0.0597 -0.0544 561 VAL A O 1407 C CB . VAL A 195 ? 0.4423 0.7567 0.5403 0.0203 0.0349 -0.1087 561 VAL A CB 1408 C CG1 . VAL A 195 ? 0.2921 0.6272 0.3966 0.0362 0.0282 -0.1213 561 VAL A CG1 1409 C CG2 . VAL A 195 ? 0.2834 0.5681 0.3968 0.0033 0.0270 -0.1254 561 VAL A CG2 1410 N N . ALA A 196 ? 0.3105 0.7279 0.3712 0.0883 0.0365 -0.0895 562 ALA A N 1411 C CA . ALA A 196 ? 0.4346 0.8864 0.4824 0.1097 0.0485 -0.0647 562 ALA A CA 1412 C C . ALA A 196 ? 0.4199 0.8519 0.4759 0.0956 0.0615 -0.0466 562 ALA A C 1413 O O . ALA A 196 ? 0.4514 0.8595 0.5190 0.0821 0.0561 -0.0623 562 ALA A O 1414 C CB . ALA A 196 ? 0.3358 0.8350 0.3712 0.1476 0.0355 -0.0823 562 ALA A CB 1415 N N . MET A 197 ? 0.4264 0.8686 0.4797 0.0991 0.0788 -0.0129 563 MET A N 1416 C CA . MET A 197 ? 0.4165 0.8385 0.4799 0.0865 0.0913 0.0057 563 MET A CA 1417 C C . MET A 197 ? 0.4224 0.8671 0.4808 0.1079 0.0876 -0.0010 563 MET A C 1418 O O . MET A 197 ? 0.4639 0.9530 0.5080 0.1403 0.0846 -0.0002 563 MET A O 1419 C CB . MET A 197 ? 0.3562 0.7830 0.4257 0.0849 0.1100 0.0444 563 MET A CB 1420 C CG . MET A 197 ? 0.3358 0.7413 0.4196 0.0734 0.1225 0.0646 563 MET A CG 1421 S SD . MET A 197 ? 0.4033 0.7518 0.4990 0.0386 0.1174 0.0446 563 MET A SD 1422 C CE . MET A 197 ? 0.4461 0.7691 0.5475 0.0149 0.1158 0.0424 563 MET A CE 1423 N N . THR A 198 ? 0.4182 0.8344 0.4876 0.0916 0.0875 -0.0083 564 THR A N 1424 C CA . THR A 198 ? 0.4721 0.9065 0.5399 0.1092 0.0843 -0.0146 564 THR A CA 1425 C C . THR A 198 ? 0.5287 0.9806 0.5928 0.1238 0.1012 0.0206 564 THR A C 1426 O O . THR A 198 ? 0.5951 1.0356 0.6654 0.1133 0.1158 0.0491 564 THR A O 1427 C CB . THR A 198 ? 0.4439 0.8430 0.5272 0.0866 0.0805 -0.0313 564 THR A CB 1428 O OG1 . THR A 198 ? 0.4114 0.7704 0.5035 0.0588 0.0932 -0.0141 564 THR A OG1 1429 C CG2 . THR A 198 ? 0.4234 0.8131 0.5155 0.0781 0.0634 -0.0651 564 THR A CG2 1430 N N . GLU A 199 ? 0.4981 0.9782 0.5552 0.1486 0.0988 0.0188 565 GLU A N 1431 C CA . GLU A 199 ? 0.5510 1.0504 0.6050 0.1663 0.1153 0.0539 565 GLU A CA 1432 C C . GLU A 199 ? 0.5791 1.0350 0.6528 0.1385 0.1293 0.0745 565 GLU A C 1433 O O . GLU A 199 ? 0.5932 1.0480 0.6757 0.1382 0.1458 0.1095 565 GLU A O 1434 C CB . GLU A 199 ? 0.6304 1.1664 0.6726 0.1983 0.1079 0.0437 565 GLU A CB 1435 C CG . GLU A 199 ? 0.7498 1.3033 0.7899 0.2171 0.1256 0.0812 565 GLU A CG 1436 C CD . GLU A 199 ? 0.8614 1.4529 0.8811 0.2532 0.1142 0.0719 565 GLU A CD 1437 O OE1 . GLU A 199 ? 0.9265 1.5163 0.9498 0.2593 0.1207 0.0842 565 GLU A OE1 1438 O OE2 . GLU A 199 ? 0.8781 1.4966 0.8765 0.2745 0.0961 0.0515 565 GLU A OE2 1439 N N . GLN A 200 ? 0.5450 0.9663 0.6284 0.1163 0.1223 0.0525 566 GLN A N 1440 C CA . GLN A 200 ? 0.5348 0.9122 0.6353 0.0894 0.1323 0.0647 566 GLN A CA 1441 C C . GLN A 200 ? 0.4662 0.8071 0.5732 0.0594 0.1272 0.0485 566 GLN A C 1442 O O . GLN A 200 ? 0.4363 0.7771 0.5389 0.0556 0.1144 0.0211 566 GLN A O 1443 C CB . GLN A 200 ? 0.5824 0.9504 0.6876 0.0901 0.1309 0.0558 566 GLN A CB 1444 C CG . GLN A 200 ? 0.6370 1.0429 0.7337 0.1223 0.1343 0.0691 566 GLN A CG 1445 C CD . GLN A 200 ? 0.6830 1.0780 0.7862 0.1219 0.1335 0.0615 566 GLN A CD 1446 O OE1 . GLN A 200 ? 0.6493 1.0063 0.7646 0.0970 0.1338 0.0522 566 GLN A OE1 1447 N NE2 . GLN A 200 ? 0.7991 1.2301 0.8931 0.1518 0.1324 0.0655 566 GLN A NE2 1448 N N . LEU A 201 ? 0.4784 0.7892 0.5983 0.0395 0.1365 0.0652 567 LEU A N 1449 C CA . LEU A 201 ? 0.3943 0.6727 0.5181 0.0139 0.1320 0.0516 567 LEU A CA 1450 C C . LEU A 201 ? 0.4866 0.7402 0.6107 0.0002 0.1252 0.0268 567 LEU A C 1451 O O . LEU A 201 ? 0.4794 0.7214 0.6091 -0.0009 0.1288 0.0279 567 LEU A O 1452 C CB . LEU A 201 ? 0.3622 0.6149 0.5028 -0.0024 0.1413 0.0721 567 LEU A CB 1453 C CG . LEU A 201 ? 0.4519 0.6727 0.5948 -0.0263 0.1359 0.0578 567 LEU A CG 1454 C CD1 . LEU A 201 ? 0.3693 0.6058 0.5010 -0.0245 0.1290 0.0485 567 LEU A CD1 1455 C CD2 . LEU A 201 ? 0.5464 0.7428 0.7103 -0.0405 0.1423 0.0744 567 LEU A CD2 1456 N N . GLN A 202 ? 0.4783 0.7250 0.5981 -0.0092 0.1161 0.0062 568 GLN A N 1457 C CA . GLN A 202 ? 0.3924 0.6185 0.5159 -0.0218 0.1113 -0.0143 568 GLN A CA 1458 C C . GLN A 202 ? 0.4233 0.6166 0.5473 -0.0435 0.1127 -0.0167 568 GLN A C 1459 O O . GLN A 202 ? 0.4284 0.6215 0.5486 -0.0476 0.1107 -0.0141 568 GLN A O 1460 C CB . GLN A 202 ? 0.3428 0.5899 0.4667 -0.0124 0.0991 -0.0365 568 GLN A CB 1461 C CG . GLN A 202 ? 0.3872 0.6685 0.5100 0.0117 0.0952 -0.0388 568 GLN A CG 1462 C CD . GLN A 202 ? 0.4273 0.7351 0.5520 0.0255 0.0797 -0.0625 568 GLN A CD 1463 O OE1 . GLN A 202 ? 0.4884 0.7873 0.6174 0.0161 0.0723 -0.0762 568 GLN A OE1 1464 N NE2 . GLN A 202 ? 0.4152 0.7565 0.5380 0.0495 0.0736 -0.0684 568 GLN A NE2 1465 N N . MET A 203 ? 0.4260 0.5943 0.5536 -0.0551 0.1160 -0.0215 569 MET A N 1466 C CA . MET A 203 ? 0.4301 0.5694 0.5554 -0.0717 0.1175 -0.0235 569 MET A CA 1467 C C . MET A 203 ? 0.5104 0.6358 0.6359 -0.0796 0.1170 -0.0377 569 MET A C 1468 O O . MET A 203 ? 0.5129 0.6479 0.6456 -0.0747 0.1165 -0.0450 569 MET A O 1469 C CB . MET A 203 ? 0.4406 0.5610 0.5704 -0.0762 0.1237 -0.0115 569 MET A CB 1470 C CG . MET A 203 ? 0.4820 0.6143 0.6197 -0.0696 0.1269 0.0078 569 MET A CG 1471 S SD . MET A 203 ? 0.5908 0.6970 0.7447 -0.0761 0.1322 0.0196 569 MET A SD 1472 C CE . MET A 203 ? 0.4778 0.5548 0.6265 -0.0926 0.1264 0.0044 569 MET A CE 1473 N N . GLY A 204 ? 0.4501 0.5549 0.5695 -0.0908 0.1175 -0.0403 570 GLY A N 1474 C CA . GLY A 204 ? 0.3869 0.4785 0.5057 -0.0971 0.1202 -0.0485 570 GLY A CA 1475 C C . GLY A 204 ? 0.4282 0.4970 0.5381 -0.1021 0.1247 -0.0464 570 GLY A C 1476 O O . GLY A 204 ? 0.4942 0.5539 0.5998 -0.1050 0.1224 -0.0424 570 GLY A O 1477 N N . PHE A 205 ? 0.4079 0.4693 0.5174 -0.1019 0.1305 -0.0500 571 PHE A N 1478 C CA . PHE A 205 ? 0.3972 0.4396 0.4958 -0.1027 0.1336 -0.0515 571 PHE A CA 1479 C C . PHE A 205 ? 0.4494 0.4869 0.5402 -0.1037 0.1391 -0.0546 571 PHE A C 1480 O O . PHE A 205 ? 0.5163 0.5629 0.6169 -0.1024 0.1448 -0.0542 571 PHE A O 1481 C CB . PHE A 205 ? 0.4476 0.4871 0.5511 -0.0968 0.1371 -0.0506 571 PHE A CB 1482 C CG . PHE A 205 ? 0.5389 0.5839 0.6526 -0.0940 0.1342 -0.0431 571 PHE A CG 1483 C CD1 . PHE A 205 ? 0.5704 0.6021 0.6869 -0.0962 0.1307 -0.0394 571 PHE A CD1 1484 C CD2 . PHE A 205 ? 0.5777 0.6428 0.7008 -0.0878 0.1349 -0.0390 571 PHE A CD2 1485 C CE1 . PHE A 205 ? 0.5542 0.5921 0.6847 -0.0930 0.1306 -0.0276 571 PHE A CE1 1486 C CE2 . PHE A 205 ? 0.5336 0.6069 0.6644 -0.0820 0.1343 -0.0284 571 PHE A CE2 1487 C CZ . PHE A 205 ? 0.5038 0.5632 0.6392 -0.0849 0.1334 -0.0206 571 PHE A CZ 1488 N N . GLY A 206 ? 0.4516 0.4767 0.5270 -0.1049 0.1374 -0.0567 572 GLY A N 1489 C CA . GLY A 206 ? 0.4442 0.4662 0.5088 -0.1025 0.1442 -0.0564 572 GLY A CA 1490 C C . GLY A 206 ? 0.5261 0.5377 0.5741 -0.0941 0.1465 -0.0615 572 GLY A C 1491 O O . GLY A 206 ? 0.5275 0.5280 0.5654 -0.0928 0.1385 -0.0682 572 GLY A O 1492 N N . ILE A 207 ? 0.4781 0.4948 0.5260 -0.0874 0.1566 -0.0595 573 ILE A N 1493 C CA . ILE A 207 ? 0.4882 0.4984 0.5181 -0.0755 0.1592 -0.0658 573 ILE A CA 1494 C C . ILE A 207 ? 0.5559 0.5714 0.5690 -0.0669 0.1689 -0.0605 573 ILE A C 1495 O O . ILE A 207 ? 0.5665 0.5932 0.5914 -0.0691 0.1798 -0.0486 573 ILE A O 1496 C CB . ILE A 207 ? 0.5307 0.5450 0.5699 -0.0699 0.1646 -0.0669 573 ILE A CB 1497 C CG1 . ILE A 207 ? 0.5516 0.5625 0.6077 -0.0759 0.1567 -0.0685 573 ILE A CG1 1498 C CG2 . ILE A 207 ? 0.5119 0.5197 0.5314 -0.0551 0.1654 -0.0762 573 ILE A CG2 1499 C CD1 . ILE A 207 ? 0.5900 0.6049 0.6555 -0.0695 0.1613 -0.0692 573 ILE A CD1 1500 N N . THR A 208 ? 0.6047 0.6133 0.5926 -0.0559 0.1646 -0.0690 574 THR A N 1501 C CA . THR A 208 ? 0.5749 0.5917 0.5413 -0.0420 0.1748 -0.0630 574 THR A CA 1502 C C . THR A 208 ? 0.5739 0.5896 0.5167 -0.0225 0.1731 -0.0760 574 THR A C 1503 O O . THR A 208 ? 0.5955 0.5985 0.5309 -0.0197 0.1577 -0.0939 574 THR A O 1504 C CB . THR A 208 ? 0.5716 0.5856 0.5245 -0.0432 0.1700 -0.0610 574 THR A CB 1505 O OG1 . THR A 208 ? 0.5991 0.6130 0.5746 -0.0603 0.1689 -0.0522 574 THR A OG1 1506 C CG2 . THR A 208 ? 0.5115 0.5371 0.4433 -0.0269 0.1835 -0.0494 574 THR A CG2 1507 N N . VAL A 209 ? 0.5065 0.5366 0.4408 -0.0082 0.1885 -0.0675 575 VAL A N 1508 C CA . VAL A 209 ? 0.5374 0.5708 0.4461 0.0148 0.1878 -0.0803 575 VAL A CA 1509 C C . VAL A 209 ? 0.5651 0.6138 0.4433 0.0357 0.1982 -0.0721 575 VAL A C 1510 O O . VAL A 209 ? 0.5930 0.6526 0.4770 0.0322 0.2127 -0.0499 575 VAL A O 1511 C CB . VAL A 209 ? 0.7009 0.7425 0.6210 0.0202 0.1979 -0.0782 575 VAL A CB 1512 C CG1 . VAL A 209 ? 0.5159 0.5432 0.4623 0.0041 0.1871 -0.0865 575 VAL A CG1 1513 C CG2 . VAL A 209 ? 0.5297 0.5914 0.4652 0.0183 0.2200 -0.0530 575 VAL A CG2 1514 N N . GLN A 210 ? 0.6572 0.7075 0.5045 0.0592 0.1903 -0.0902 576 GLN A N 1515 C CA . GLN A 210 ? 0.7305 0.7993 0.5428 0.0854 0.1994 -0.0839 576 GLN A CA 1516 C C . GLN A 210 ? 0.7536 0.8350 0.5404 0.1152 0.2011 -0.0974 576 GLN A C 1517 O O . GLN A 210 ? 0.8936 0.9625 0.6737 0.1226 0.1814 -0.1266 576 GLN A O 1518 C CB . GLN A 210 ? 0.8361 0.8970 0.6287 0.0886 0.1827 -0.0968 576 GLN A CB 1519 C CG . GLN A 210 ? 0.9697 1.0517 0.7244 0.1167 0.1921 -0.0876 576 GLN A CG 1520 C CD . GLN A 210 ? 1.0431 1.1180 0.7832 0.1166 0.1759 -0.0977 576 GLN A CD 1521 O OE1 . GLN A 210 ? 0.9777 1.0333 0.7411 0.0916 0.1619 -0.1048 576 GLN A OE1 1522 N NE2 . GLN A 210 ? 1.1204 1.2135 0.8212 0.1467 0.1781 -0.0978 576 GLN A NE2 1523 N N . TYR A 211 ? 0.6981 0.8052 0.4745 0.1329 0.2248 -0.0758 577 TYR A N 1524 C CA . TYR A 211 ? 0.7666 0.8912 0.5158 0.1653 0.2291 -0.0862 577 TYR A CA 1525 C C . TYR A 211 ? 0.8078 0.9464 0.5093 0.1995 0.2225 -0.0988 577 TYR A C 1526 O O . TYR A 211 ? 0.8187 0.9630 0.5075 0.2012 0.2262 -0.0855 577 TYR A O 1527 C CB . TYR A 211 ? 0.7153 0.8661 0.4756 0.1720 0.2590 -0.0556 577 TYR A CB 1528 C CG . TYR A 211 ? 0.6803 0.8226 0.4847 0.1458 0.2638 -0.0490 577 TYR A CG 1529 C CD1 . TYR A 211 ? 0.6439 0.7796 0.4873 0.1151 0.2706 -0.0285 577 TYR A CD1 1530 C CD2 . TYR A 211 ? 0.6859 0.8282 0.4931 0.1540 0.2604 -0.0645 577 TYR A CD2 1531 C CE1 . TYR A 211 ? 0.6482 0.7796 0.5306 0.0944 0.2732 -0.0247 577 TYR A CE1 1532 C CE2 . TYR A 211 ? 0.6558 0.7927 0.5017 0.1325 0.2644 -0.0584 577 TYR A CE2 1533 C CZ . TYR A 211 ? 0.7051 0.8376 0.5878 0.1032 0.2705 -0.0389 577 TYR A CZ 1534 O OH . TYR A 211 ? 0.6847 0.8149 0.6047 0.0848 0.2726 -0.0352 577 TYR A OH 1535 N N . GLY A 212 ? 0.8698 1.0148 0.5448 0.2285 0.2118 -0.1257 578 GLY A N 1536 C CA . GLY A 212 ? 0.9637 1.1232 0.5973 0.2616 0.2003 -0.1399 578 GLY A CA 1537 C C . GLY A 212 ? 1.0926 1.2770 0.7113 0.2885 0.2082 -0.1310 578 GLY A C 1538 O O . GLY A 212 ? 1.0803 1.2809 0.7140 0.2848 0.2330 -0.0999 578 GLY A O 1539 N N . THR A 213 ? 1.2097 1.3982 0.8022 0.3157 0.1855 -0.1588 579 THR A N 1540 C CA . THR A 213 ? 1.2920 1.5060 0.8661 0.3459 0.1897 -0.1540 579 THR A CA 1541 C C . THR A 213 ? 1.3559 1.5573 0.9317 0.3560 0.1678 -0.1923 579 THR A C 1542 O O . THR A 213 ? 1.3866 1.5950 0.9712 0.3598 0.1787 -0.1868 579 THR A O 1543 C CB . THR A 213 ? 1.3520 1.5902 0.8910 0.3774 0.1832 -0.1490 579 THR A CB 1544 O OG1 . THR A 213 ? 1.3282 1.5720 0.8681 0.3665 0.1993 -0.1173 579 THR A OG1 1545 C CG2 . THR A 213 ? 1.4197 1.6901 0.9411 0.4089 0.1945 -0.1333 579 THR A CG2 1546 N N . ASP A 214 ? 1.3977 1.5802 0.9692 0.3599 0.1360 -0.2306 580 ASP A N 1547 C CA . ASP A 214 ? 1.4326 1.5989 1.0128 0.3681 0.1111 -0.2689 580 ASP A CA 1548 C C . ASP A 214 ? 1.3833 1.5105 0.9970 0.3389 0.0934 -0.2943 580 ASP A C 1549 O O . ASP A 214 ? 1.3943 1.5019 1.0286 0.3363 0.0787 -0.3188 580 ASP A O 1550 C CB . ASP A 214 ? 1.5208 1.7006 1.0755 0.4017 0.0838 -0.2951 580 ASP A CB 1551 C CG . ASP A 214 ? 1.5916 1.8114 1.1138 0.4363 0.0980 -0.2739 580 ASP A CG 1552 O OD1 . ASP A 214 ? 1.5743 1.8137 1.0901 0.4335 0.1284 -0.2330 580 ASP A OD1 1553 O OD2 . ASP A 214 ? 1.6582 1.8907 1.1645 0.4669 0.0781 -0.2976 580 ASP A OD2 1554 N N . THR A 215 ? 1.3355 1.4516 0.9567 0.3175 0.0946 -0.2872 581 THR A N 1555 C CA . THR A 215 ? 1.3002 1.3814 0.9538 0.2915 0.0750 -0.3112 581 THR A CA 1556 C C . THR A 215 ? 1.2224 1.2885 0.9060 0.2631 0.0930 -0.2967 581 THR A C 1557 O O . THR A 215 ? 1.1695 1.2097 0.8885 0.2294 0.0826 -0.2952 581 THR A O 1558 C CB . THR A 215 ? 1.3025 1.3797 0.9516 0.2826 0.0640 -0.3136 581 THR A CB 1559 O OG1 . THR A 215 ? 1.2775 1.3740 0.9098 0.2778 0.0928 -0.2757 581 THR A OG1 1560 C CG2 . THR A 215 ? 1.3687 1.4576 0.9970 0.3094 0.0388 -0.3351 581 THR A CG2 1561 N N . ASN A 216 ? 1.1580 1.2393 0.8406 0.2671 0.1173 -0.2748 582 ASN A N 1562 C CA . ASN A 216 ? 1.0049 1.0722 0.7286 0.2318 0.1309 -0.2503 582 ASN A CA 1563 C C . ASN A 216 ? 0.9028 0.9407 0.6598 0.2206 0.1118 -0.2739 582 ASN A C 1564 O O . ASN A 216 ? 0.9002 0.9420 0.6611 0.2304 0.1187 -0.2755 582 ASN A O 1565 C CB . ASN A 216 ? 0.9058 1.0017 0.6217 0.2401 0.1630 -0.2188 582 ASN A CB 1566 C CG . ASN A 216 ? 0.8534 0.9746 0.5514 0.2427 0.1858 -0.1859 582 ASN A CG 1567 O OD1 . ASN A 216 ? 0.8414 0.9531 0.5447 0.2247 0.1812 -0.1786 582 ASN A OD1 1568 N ND2 . ASN A 216 ? 0.8812 1.0343 0.5631 0.2634 0.2100 -0.1634 582 ASN A ND2 1569 N N . SER A 217 ? 0.8228 0.8320 0.6066 0.2001 0.0888 -0.2901 583 SER A N 1570 C CA . SER A 217 ? 0.8401 0.8199 0.6591 0.1920 0.0684 -0.3135 583 SER A CA 1571 C C . SER A 217 ? 0.7992 0.7579 0.6638 0.1532 0.0726 -0.2924 583 SER A C 1572 O O . SER A 217 ? 0.8374 0.7716 0.7361 0.1441 0.0588 -0.3048 583 SER A O 1573 C CB . SER A 217 ? 0.9145 0.8779 0.7372 0.2024 0.0360 -0.3520 583 SER A CB 1574 O OG . SER A 217 ? 1.0129 0.9967 0.7929 0.2437 0.0284 -0.3776 583 SER A OG 1575 N N . VAL A 218 ? 0.7222 0.6912 0.5884 0.1323 0.0912 -0.2604 584 VAL A N 1576 C CA . VAL A 218 ? 0.6820 0.6371 0.5862 0.0999 0.0964 -0.2397 584 VAL A CA 1577 C C . VAL A 218 ? 0.6680 0.6353 0.5777 0.0992 0.1168 -0.2206 584 VAL A C 1578 O O . VAL A 218 ? 0.6479 0.6345 0.5519 0.0924 0.1370 -0.1955 584 VAL A O 1579 C CB . VAL A 218 ? 0.6524 0.6119 0.5594 0.0780 0.1028 -0.2187 584 VAL A CB 1580 C CG1 . VAL A 218 ? 0.6167 0.5619 0.5627 0.0486 0.1031 -0.2032 584 VAL A CG1 1581 C CG2 . VAL A 218 ? 0.6696 0.6237 0.5647 0.0834 0.0847 -0.2371 584 VAL A CG2 1582 N N . CYS A 219 ? 0.7480 0.7034 0.6724 0.1064 0.1103 -0.2336 585 CYS A N 1583 C CA . CYS A 219 ? 0.6748 0.6436 0.6013 0.1122 0.1274 -0.2210 585 CYS A CA 1584 C C . CYS A 219 ? 0.6474 0.6018 0.6119 0.0905 0.1280 -0.2087 585 CYS A C 1585 O O . CYS A 219 ? 0.7725 0.7025 0.7626 0.0776 0.1125 -0.2156 585 CYS A O 1586 C CB . CYS A 219 ? 0.7151 0.6871 0.6231 0.1440 0.1216 -0.2453 585 CYS A CB 1587 S SG . CYS A 219 ? 0.8199 0.8196 0.6762 0.1776 0.1257 -0.2558 585 CYS A SG 1588 N N . PRO A 220 ? 0.7044 0.6760 0.6745 0.0876 0.1463 -0.1893 586 PRO A N 1589 C CA . PRO A 220 ? 0.7050 0.6674 0.7074 0.0717 0.1472 -0.1778 586 PRO A CA 1590 C C . PRO A 220 ? 0.7544 0.6958 0.7714 0.0827 0.1345 -0.1953 586 PRO A C 1591 O O . PRO A 220 ? 0.8061 0.7510 0.8068 0.1061 0.1331 -0.2121 586 PRO A O 1592 C CB . PRO A 220 ? 0.6451 0.6355 0.6470 0.0720 0.1682 -0.1582 586 PRO A CB 1593 C CG . PRO A 220 ? 0.6342 0.6442 0.6062 0.0952 0.1775 -0.1639 586 PRO A CG 1594 C CD . PRO A 220 ? 0.6955 0.6982 0.6455 0.0998 0.1672 -0.1760 586 PRO A CD 1595 N N . LYS A 221 ? 0.7777 0.6985 0.8263 0.0674 0.1259 -0.1905 587 LYS A N 1596 C CA . LYS A 221 ? 0.7887 0.6865 0.8595 0.0755 0.1143 -0.2032 587 LYS A CA 1597 C C . LYS A 221 ? 0.7601 0.6708 0.8300 0.0879 0.1262 -0.1978 587 LYS A C 1598 O O . LYS A 221 ? 0.7191 0.6425 0.8005 0.0775 0.1381 -0.1764 587 LYS A O 1599 C CB . LYS A 221 ? 0.8323 0.7090 0.9405 0.0557 0.1065 -0.1913 587 LYS A CB 1600 C CG . LYS A 221 ? 0.9914 0.8398 1.1310 0.0622 0.0932 -0.2025 587 LYS A CG 1601 C CD . LYS A 221 ? 1.0591 0.8917 1.2382 0.0429 0.0902 -0.1830 587 LYS A CD 1602 C CE . LYS A 221 ? 1.1479 0.9516 1.3651 0.0492 0.0790 -0.1894 587 LYS A CE 1603 N NZ . LYS A 221 ? 1.1868 0.9791 1.4448 0.0323 0.0800 -0.1640 587 LYS A NZ 1604 N N . LEU A 222 ? 0.7728 0.6825 0.8286 0.1121 0.1220 -0.2188 588 LEU A N 1605 C CA . LEU A 222 ? 0.8303 0.7532 0.8850 0.1266 0.1326 -0.2160 588 LEU A CA 1606 C C . LEU A 222 ? 0.9071 0.8050 0.9954 0.1252 0.1238 -0.2163 588 LEU A C 1607 O O . LEU A 222 ? 0.9480 0.8161 1.0598 0.1189 0.1074 -0.2250 588 LEU A O 1608 C CB . LEU A 222 ? 0.8523 0.7871 0.8768 0.1564 0.1324 -0.2380 588 LEU A CB 1609 C CG . LEU A 222 ? 0.8439 0.8056 0.8333 0.1635 0.1427 -0.2360 588 LEU A CG 1610 C CD1 . LEU A 222 ? 0.8236 0.8002 0.7823 0.1981 0.1429 -0.2570 588 LEU A CD1 1611 C CD2 . LEU A 222 ? 0.8293 0.8200 0.8195 0.1488 0.1654 -0.2056 588 LEU A CD2 1612 N N . GLU A 223 ? 0.9298 0.8408 1.0236 0.1316 0.1350 -0.2056 589 GLU A N 1613 C CA . GLU A 223 ? 0.9672 0.8578 1.0926 0.1310 0.1296 -0.2005 589 GLU A CA 1614 C C . GLU A 223 ? 0.9345 0.8168 1.0587 0.1568 0.1240 -0.2210 589 GLU A C 1615 O O . GLU A 223 ? 0.9380 0.8452 1.0381 0.1740 0.1341 -0.2266 589 GLU A O 1616 C CB . GLU A 223 ? 1.0589 0.9701 1.1950 0.1194 0.1443 -0.1725 589 GLU A CB 1617 C CG . GLU A 223 ? 1.1864 1.0776 1.3559 0.1147 0.1396 -0.1594 589 GLU A CG 1618 C CD . GLU A 223 ? 1.2041 1.1146 1.3824 0.0993 0.1499 -0.1318 589 GLU A CD 1619 O OE1 . GLU A 223 ? 1.1766 1.1151 1.3381 0.0922 0.1597 -0.1253 589 GLU A OE1 1620 O OE2 . GLU A 223 ? 1.2333 1.1317 1.4369 0.0959 0.1478 -0.1164 589 GLU A OE2 1621 N N . PHE A 224 ? 0.9085 0.7564 1.0620 0.1599 0.1082 -0.2314 590 PHE A N 1622 C CA . PHE A 224 ? 0.9103 0.7445 1.0668 0.1853 0.0988 -0.2550 590 PHE A CA 1623 C C . PHE A 224 ? 0.9384 0.7542 1.1306 0.1855 0.0981 -0.2420 590 PHE A C 1624 O O . PHE A 224 ? 0.9963 0.8086 1.2113 0.1667 0.1036 -0.2151 590 PHE A O 1625 C CB . PHE A 224 ? 0.9033 0.7096 1.0648 0.1948 0.0755 -0.2883 590 PHE A CB 1626 C CG . PHE A 224 ? 0.8718 0.6975 0.9944 0.2012 0.0748 -0.3038 590 PHE A CG 1627 C CD1 . PHE A 224 ? 0.8474 0.6916 0.9348 0.2309 0.0750 -0.3270 590 PHE A CD1 1628 C CD2 . PHE A 224 ? 0.8725 0.6999 0.9926 0.1799 0.0746 -0.2940 590 PHE A CD2 1629 C CE1 . PHE A 224 ? 0.8539 0.7187 0.9041 0.2399 0.0759 -0.3383 590 PHE A CE1 1630 C CE2 . PHE A 224 ? 0.8021 0.6477 0.8861 0.1874 0.0745 -0.3064 590 PHE A CE2 1631 C CZ . PHE A 224 ? 0.8313 0.6960 0.8800 0.2179 0.0755 -0.3278 590 PHE A CZ 1632 N N . ALA A 225 ? 0.9611 0.7665 1.1572 0.2091 0.0914 -0.2609 591 ALA A N 1633 C CA . ALA A 225 ? 0.9787 0.7654 1.2086 0.2131 0.0904 -0.2496 591 ALA A CA 1634 C C . ALA A 225 ? 1.0425 0.7863 1.3200 0.2007 0.0742 -0.2478 591 ALA A C 1635 O O . ALA A 225 ? 1.0944 0.8104 1.4057 0.2105 0.0652 -0.2515 591 ALA A O 1636 C CB . ALA A 225 ? 0.9933 0.7796 1.2147 0.2433 0.0865 -0.2728 591 ALA A CB 1637 N N . GLN B 1 ? 1.3714 1.5237 1.4086 0.2642 -0.2819 -0.3202 1 GLN H N 1638 C CA . GLN B 1 ? 1.2864 1.4236 1.3683 0.2123 -0.2532 -0.2733 1 GLN H CA 1639 C C . GLN B 1 ? 1.1800 1.3254 1.2188 0.2066 -0.1968 -0.2295 1 GLN H C 1640 O O . GLN B 1 ? 1.1616 1.3158 1.1808 0.1997 -0.1714 -0.1971 1 GLN H O 1641 C CB . GLN B 1 ? 1.3259 1.4818 1.4354 0.1994 -0.2638 -0.2658 1 GLN H CB 1642 C CG . GLN B 1 ? 1.4372 1.5892 1.6135 0.1857 -0.3188 -0.3010 1 GLN H CG 1643 C CD . GLN B 1 ? 1.4814 1.6729 1.6907 0.1754 -0.3280 -0.2971 1 GLN H CD 1644 O OE1 . GLN B 1 ? 1.5104 1.7263 1.6788 0.1937 -0.3010 -0.2771 1 GLN H OE1 1645 N NE2 . GLN B 1 ? 1.4799 1.6787 1.7661 0.1457 -0.3696 -0.3165 1 GLN H NE2 1646 N N . VAL B 2 ? 1.0876 1.2293 1.1145 0.2110 -0.1823 -0.2316 2 VAL H N 1647 C CA . VAL B 2 ? 0.8834 1.0353 0.8822 0.1986 -0.1325 -0.1919 2 VAL H CA 1648 C C . VAL B 2 ? 0.7150 0.8393 0.7625 0.1523 -0.1157 -0.1580 2 VAL H C 1649 O O . VAL B 2 ? 0.6433 0.7435 0.7458 0.1293 -0.1392 -0.1658 2 VAL H O 1650 C CB . VAL B 2 ? 0.8714 1.0441 0.8519 0.2189 -0.1241 -0.2100 2 VAL H CB 1651 C CG1 . VAL B 2 ? 0.8334 1.0324 0.7822 0.2058 -0.0727 -0.1689 2 VAL H CG1 1652 C CG2 . VAL B 2 ? 0.9629 1.1716 0.9011 0.2714 -0.1493 -0.2560 2 VAL H CG2 1653 N N . GLN B 3 ? 0.6657 0.7932 0.6908 0.1383 -0.0780 -0.1193 3 GLN H N 1654 C CA . GLN B 3 ? 0.5768 0.6860 0.6392 0.1022 -0.0611 -0.0910 3 GLN H CA 1655 C C . GLN B 3 ? 0.4905 0.5980 0.5461 0.0902 -0.0318 -0.0732 3 GLN H C 1656 O O . GLN B 3 ? 0.5025 0.6317 0.5197 0.1055 -0.0152 -0.0720 3 GLN H O 1657 C CB . GLN B 3 ? 0.6117 0.7206 0.6615 0.0987 -0.0506 -0.0680 3 GLN H CB 1658 C CG . GLN B 3 ? 0.7517 0.8743 0.8048 0.1164 -0.0789 -0.0870 3 GLN H CG 1659 C CD . GLN B 3 ? 0.8721 0.9941 0.9058 0.1236 -0.0722 -0.0686 3 GLN H CD 1660 O OE1 . GLN B 3 ? 0.9656 1.0922 0.9632 0.1520 -0.0868 -0.0756 3 GLN H OE1 1661 N NE2 . GLN B 3 ? 0.8670 0.9819 0.9213 0.1031 -0.0544 -0.0481 3 GLN H NE2 1662 N N . LEU B 4 ? 0.4348 0.5260 0.5287 0.0623 -0.0254 -0.0589 4 LEU H N 1663 C CA . LEU B 4 ? 0.4415 0.5322 0.5360 0.0501 -0.0017 -0.0445 4 LEU H CA 1664 C C . LEU B 4 ? 0.4803 0.5612 0.5758 0.0295 0.0198 -0.0145 4 LEU H C 1665 O O . LEU B 4 ? 0.5469 0.6207 0.6716 0.0141 0.0147 -0.0079 4 LEU H O 1666 C CB . LEU B 4 ? 0.3964 0.4713 0.5284 0.0416 -0.0190 -0.0573 4 LEU H CB 1667 C CG . LEU B 4 ? 0.4419 0.5270 0.5674 0.0668 -0.0313 -0.0871 4 LEU H CG 1668 C CD1 . LEU B 4 ? 0.4685 0.5788 0.5614 0.1007 -0.0428 -0.1140 4 LEU H CD1 1669 C CD2 . LEU B 4 ? 0.4257 0.4723 0.5876 0.0617 -0.0656 -0.1020 4 LEU H CD2 1670 N N . VAL B 5 ? 0.4504 0.5337 0.5138 0.0291 0.0415 0.0036 5 VAL H N 1671 C CA . VAL B 5 ? 0.5109 0.5735 0.5717 0.0143 0.0534 0.0268 5 VAL H CA 1672 C C . VAL B 5 ? 0.5214 0.5845 0.5957 -0.0045 0.0702 0.0369 5 VAL H C 1673 O O . VAL B 5 ? 0.5915 0.6737 0.6529 -0.0077 0.0841 0.0421 5 VAL H O 1674 C CB . VAL B 5 ? 0.5321 0.5787 0.5472 0.0229 0.0564 0.0446 5 VAL H CB 1675 C CG1 . VAL B 5 ? 0.5793 0.5908 0.5918 0.0112 0.0593 0.0633 5 VAL H CG1 1676 C CG2 . VAL B 5 ? 0.4455 0.4947 0.4474 0.0461 0.0361 0.0312 5 VAL H CG2 1677 N N . GLN B 6 ? 0.5020 0.5544 0.6028 -0.0161 0.0687 0.0388 6 GLN H N 1678 C CA . GLN B 6 ? 0.4956 0.5493 0.6123 -0.0311 0.0792 0.0437 6 GLN H CA 1679 C C . GLN B 6 ? 0.4959 0.5248 0.6024 -0.0411 0.0841 0.0587 6 GLN H C 1680 O O . GLN B 6 ? 0.4902 0.4965 0.5809 -0.0326 0.0756 0.0626 6 GLN H O 1681 C CB . GLN B 6 ? 0.3984 0.4557 0.5455 -0.0355 0.0707 0.0361 6 GLN H CB 1682 C CG . GLN B 6 ? 0.3629 0.4255 0.5231 -0.0287 0.0552 0.0223 6 GLN H CG 1683 C CD . GLN B 6 ? 0.3785 0.4341 0.5634 -0.0388 0.0442 0.0246 6 GLN H CD 1684 O OE1 . GLN B 6 ? 0.3707 0.4176 0.5699 -0.0423 0.0256 0.0225 6 GLN H OE1 1685 N NE2 . GLN B 6 ? 0.4081 0.4651 0.5973 -0.0455 0.0526 0.0311 6 GLN H NE2 1686 N N . SER B 7 ? 0.4704 0.5027 0.5886 -0.0569 0.0927 0.0635 7 SER H N 1687 C CA . SER B 7 ? 0.4685 0.4689 0.5828 -0.0695 0.0900 0.0744 7 SER H CA 1688 C C . SER B 7 ? 0.4273 0.4142 0.5518 -0.0592 0.0773 0.0622 7 SER H C 1689 O O . SER B 7 ? 0.3652 0.3767 0.5042 -0.0513 0.0764 0.0521 7 SER H O 1690 C CB . SER B 7 ? 0.4547 0.4733 0.5881 -0.0926 0.1003 0.0799 7 SER H CB 1691 O OG . SER B 7 ? 0.4596 0.5065 0.6221 -0.0892 0.1000 0.0624 7 SER H OG 1692 N N . GLY B 8 ? 0.5103 0.4590 0.6255 -0.0593 0.0653 0.0639 8 GLY H N 1693 C CA . GLY B 8 ? 0.4773 0.4219 0.5953 -0.0405 0.0512 0.0466 8 GLY H CA 1694 C C . GLY B 8 ? 0.4586 0.4305 0.5987 -0.0432 0.0530 0.0347 8 GLY H C 1695 O O . GLY B 8 ? 0.4816 0.4705 0.6386 -0.0595 0.0626 0.0384 8 GLY H O 1696 N N . ALA B 9 ? 0.4743 0.4572 0.6118 -0.0226 0.0424 0.0184 9 ALA H N 1697 C CA . ALA B 9 ? 0.4465 0.4608 0.5954 -0.0197 0.0427 0.0083 9 ALA H CA 1698 C C . ALA B 9 ? 0.5190 0.5093 0.6795 -0.0330 0.0339 0.0019 9 ALA H C 1699 O O . ALA B 9 ? 0.5648 0.5097 0.7243 -0.0436 0.0228 0.0034 9 ALA H O 1700 C CB . ALA B 9 ? 0.3827 0.4261 0.5203 0.0096 0.0336 -0.0095 9 ALA H CB 1701 N N . GLU B 10 ? 0.5002 0.5203 0.6723 -0.0343 0.0360 -0.0034 10 GLU H N 1702 C CA . GLU B 10 ? 0.5118 0.5228 0.7027 -0.0471 0.0267 -0.0127 10 GLU H CA 1703 C C . GLU B 10 ? 0.5234 0.5550 0.7102 -0.0273 0.0124 -0.0336 10 GLU H C 1704 O O . GLU B 10 ? 0.5275 0.5968 0.7021 -0.0141 0.0193 -0.0296 10 GLU H O 1705 C CB . GLU B 10 ? 0.4315 0.4654 0.6438 -0.0664 0.0409 -0.0014 10 GLU H CB 1706 C CG . GLU B 10 ? 0.4361 0.4615 0.6508 -0.0843 0.0547 0.0156 10 GLU H CG 1707 C CD . GLU B 10 ? 0.4807 0.4839 0.7090 -0.1100 0.0501 0.0211 10 GLU H CD 1708 O OE1 . GLU B 10 ? 0.6066 0.5931 0.8476 -0.1144 0.0317 0.0077 10 GLU H OE1 1709 O OE2 . GLU B 10 ? 0.5022 0.5062 0.7281 -0.1275 0.0632 0.0401 10 GLU H OE2 1710 N N . VAL B 11 ? 0.4734 0.4793 0.6688 -0.0269 -0.0101 -0.0544 11 VAL H N 1711 C CA . VAL B 11 ? 0.4828 0.5096 0.6724 -0.0043 -0.0283 -0.0804 11 VAL H CA 1712 C C . VAL B 11 ? 0.5244 0.5501 0.7471 -0.0241 -0.0401 -0.0901 11 VAL H C 1713 O O . VAL B 11 ? 0.6063 0.5949 0.8537 -0.0473 -0.0548 -0.0948 11 VAL H O 1714 C CB . VAL B 11 ? 0.4936 0.4959 0.6636 0.0256 -0.0554 -0.1102 11 VAL H CB 1715 C CG1 . VAL B 11 ? 0.4669 0.5126 0.6183 0.0600 -0.0693 -0.1379 11 VAL H CG1 1716 C CG2 . VAL B 11 ? 0.5271 0.5305 0.6744 0.0424 -0.0458 -0.1026 11 VAL H CG2 1717 N N . LYS B 12 ? 0.4860 0.5533 0.7105 -0.0168 -0.0363 -0.0911 12 LYS H N 1718 C CA . LYS B 12 ? 0.5041 0.5856 0.7654 -0.0332 -0.0459 -0.1015 12 LYS H CA 1719 C C . LYS B 12 ? 0.5158 0.6234 0.7684 -0.0067 -0.0683 -0.1274 12 LYS H C 1720 O O . LYS B 12 ? 0.5302 0.6589 0.7426 0.0222 -0.0666 -0.1251 12 LYS H O 1721 C CB . LYS B 12 ? 0.4664 0.5750 0.7441 -0.0479 -0.0235 -0.0802 12 LYS H CB 1722 C CG . LYS B 12 ? 0.4371 0.5312 0.7252 -0.0736 -0.0027 -0.0583 12 LYS H CG 1723 C CD . LYS B 12 ? 0.4745 0.5590 0.7998 -0.1072 -0.0088 -0.0605 12 LYS H CD 1724 C CE . LYS B 12 ? 0.5011 0.5797 0.8281 -0.1322 0.0139 -0.0332 12 LYS H CE 1725 N NZ . LYS B 12 ? 0.5206 0.5910 0.8807 -0.1735 0.0091 -0.0243 12 LYS H NZ 1726 N N . LYS B 13 ? 0.5166 0.6289 0.8071 -0.0186 -0.0899 -0.1502 13 LYS H N 1727 C CA . LYS B 13 ? 0.5122 0.6530 0.7978 0.0075 -0.1151 -0.1782 13 LYS H CA 1728 C C . LYS B 13 ? 0.4545 0.6353 0.7438 0.0129 -0.1054 -0.1660 13 LYS H C 1729 O O . LYS B 13 ? 0.4527 0.6427 0.7687 -0.0089 -0.0863 -0.1482 13 LYS H O 1730 C CB . LYS B 13 ? 0.6169 0.7466 0.9484 -0.0085 -0.1485 -0.2118 13 LYS H CB 1731 C CG . LYS B 13 ? 0.7120 0.7834 1.0402 -0.0118 -0.1707 -0.2278 13 LYS H CG 1732 C CD . LYS B 13 ? 0.7511 0.8207 1.0203 0.0396 -0.1831 -0.2485 13 LYS H CD 1733 C CE . LYS B 13 ? 0.8067 0.8134 1.0715 0.0457 -0.2124 -0.2718 13 LYS H CE 1734 N NZ . LYS B 13 ? 0.8669 0.8897 1.0736 0.1018 -0.2195 -0.2941 13 LYS H NZ 1735 N N . PRO B 14 ? 0.4570 0.6614 0.7148 0.0465 -0.1217 -0.1767 14 PRO H N 1736 C CA . PRO B 14 ? 0.4826 0.7124 0.7382 0.0576 -0.1226 -0.1664 14 PRO H CA 1737 C C . PRO B 14 ? 0.5041 0.7623 0.8241 0.0407 -0.1325 -0.1871 14 PRO H C 1738 O O . PRO B 14 ? 0.4302 0.7030 0.7850 0.0354 -0.1559 -0.2193 14 PRO H O 1739 C CB . PRO B 14 ? 0.4654 0.7124 0.6727 0.0966 -0.1458 -0.1778 14 PRO H CB 1740 C CG . PRO B 14 ? 0.4846 0.7236 0.6546 0.1084 -0.1427 -0.1817 14 PRO H CG 1741 C CD . PRO B 14 ? 0.4733 0.6827 0.6879 0.0808 -0.1419 -0.1979 14 PRO H CD 1742 N N . GLY B 15 ? 0.4760 0.7477 0.8143 0.0331 -0.1172 -0.1719 15 GLY H N 1743 C CA . GLY B 15 ? 0.4152 0.7365 0.8159 0.0219 -0.1231 -0.1929 15 GLY H CA 1744 C C . GLY B 15 ? 0.4010 0.7369 0.8474 -0.0194 -0.0968 -0.1833 15 GLY H C 1745 O O . GLY B 15 ? 0.3511 0.7457 0.8493 -0.0312 -0.0927 -0.1949 15 GLY H O 1746 N N . SER B 16 ? 0.4164 0.7063 0.8415 -0.0393 -0.0794 -0.1618 16 SER H N 1747 C CA . SER B 16 ? 0.4336 0.7285 0.8890 -0.0787 -0.0553 -0.1452 16 SER H CA 1748 C C . SER B 16 ? 0.4489 0.7474 0.8849 -0.0721 -0.0291 -0.1230 16 SER H C 1749 O O . SER B 16 ? 0.3005 0.5958 0.7095 -0.0405 -0.0342 -0.1227 16 SER H O 1750 C CB . SER B 16 ? 0.3541 0.5895 0.7932 -0.0986 -0.0566 -0.1349 16 SER H CB 1751 O OG . SER B 16 ? 0.5060 0.6975 0.8866 -0.0742 -0.0495 -0.1203 16 SER H OG 1752 N N . SER B 17 ? 0.2987 0.5994 0.7462 -0.1019 -0.0054 -0.1040 17 SER H N 1753 C CA . SER B 17 ? 0.3181 0.6260 0.7481 -0.0940 0.0165 -0.0884 17 SER H CA 1754 C C . SER B 17 ? 0.4199 0.6766 0.8179 -0.1097 0.0332 -0.0612 17 SER H C 1755 O O . SER B 17 ? 0.4862 0.7101 0.8852 -0.1333 0.0302 -0.0530 17 SER H O 1756 C CB . SER B 17 ? 0.2817 0.6728 0.7574 -0.1057 0.0309 -0.0967 17 SER H CB 1757 O OG . SER B 17 ? 0.3542 0.7666 0.8601 -0.1521 0.0454 -0.0814 17 SER H OG 1758 N N . VAL B 18 ? 0.4124 0.6580 0.7822 -0.0940 0.0450 -0.0501 18 VAL H N 1759 C CA . VAL B 18 ? 0.4106 0.6150 0.7499 -0.1030 0.0587 -0.0275 18 VAL H CA 1760 C C . VAL B 18 ? 0.4113 0.6457 0.7479 -0.0998 0.0763 -0.0219 18 VAL H C 1761 O O . VAL B 18 ? 0.4133 0.6809 0.7584 -0.0776 0.0720 -0.0380 18 VAL H O 1762 C CB . VAL B 18 ? 0.4013 0.5563 0.7015 -0.0827 0.0497 -0.0217 18 VAL H CB 1763 C CG1 . VAL B 18 ? 0.2610 0.4196 0.5494 -0.0588 0.0433 -0.0236 18 VAL H CG1 1764 C CG2 . VAL B 18 ? 0.3229 0.4422 0.5977 -0.0898 0.0598 -0.0039 18 VAL H CG2 1765 N N . LYS B 19 ? 0.4033 0.6249 0.7249 -0.1175 0.0919 -0.0017 19 LYS H N 1766 C CA . LYS B 19 ? 0.3722 0.6257 0.6833 -0.1105 0.1078 0.0021 19 LYS H CA 1767 C C . LYS B 19 ? 0.3820 0.5849 0.6537 -0.1079 0.1113 0.0200 19 LYS H C 1768 O O . LYS B 19 ? 0.4243 0.5980 0.6827 -0.1287 0.1161 0.0406 19 LYS H O 1769 C CB . LYS B 19 ? 0.3642 0.6864 0.7002 -0.1370 0.1276 0.0102 19 LYS H CB 1770 C CG . LYS B 19 ? 0.3420 0.7244 0.6676 -0.1214 0.1445 0.0059 19 LYS H CG 1771 C CD . LYS B 19 ? 0.3849 0.8583 0.7376 -0.1509 0.1683 0.0175 19 LYS H CD 1772 C CE . LYS B 19 ? 0.4068 0.9507 0.7427 -0.1239 0.1830 0.0068 19 LYS H CE 1773 N NZ . LYS B 19 ? 0.4642 1.0712 0.8100 -0.1439 0.2005 0.0222 19 LYS H NZ 1774 N N . VAL B 20 ? 0.4142 0.6033 0.6690 -0.0822 0.1039 0.0113 20 VAL H N 1775 C CA . VAL B 20 ? 0.3914 0.5415 0.6155 -0.0766 0.1033 0.0228 20 VAL H CA 1776 C C . VAL B 20 ? 0.4300 0.6092 0.6389 -0.0678 0.1134 0.0218 20 VAL H C 1777 O O . VAL B 20 ? 0.4626 0.6827 0.6813 -0.0499 0.1115 0.0017 20 VAL H O 1778 C CB . VAL B 20 ? 0.4147 0.5341 0.6337 -0.0604 0.0861 0.0169 20 VAL H CB 1779 C CG1 . VAL B 20 ? 0.4436 0.5365 0.6405 -0.0571 0.0848 0.0264 20 VAL H CG1 1780 C CG2 . VAL B 20 ? 0.4156 0.5198 0.6419 -0.0644 0.0778 0.0181 20 VAL H CG2 1781 N N . SER B 21 ? 0.4680 0.6273 0.6493 -0.0748 0.1205 0.0402 21 SER H N 1782 C CA . SER B 21 ? 0.4754 0.6644 0.6331 -0.0629 0.1289 0.0400 21 SER H CA 1783 C C . SER B 21 ? 0.4954 0.6537 0.6355 -0.0402 0.1126 0.0292 21 SER H C 1784 O O . SER B 21 ? 0.4853 0.6012 0.6277 -0.0419 0.1007 0.0327 21 SER H O 1785 C CB . SER B 21 ? 0.5358 0.7254 0.6684 -0.0855 0.1450 0.0714 21 SER H CB 1786 O OG . SER B 21 ? 0.6254 0.7476 0.7385 -0.0909 0.1339 0.0875 21 SER H OG 1787 N N . CYS B 22 ? 0.5094 0.6990 0.6346 -0.0184 0.1109 0.0137 22 CYS H N 1788 C CA . CYS B 22 ? 0.4767 0.6425 0.5904 0.0028 0.0903 -0.0017 22 CYS H CA 1789 C C . CYS B 22 ? 0.5335 0.7342 0.6114 0.0213 0.0961 -0.0061 22 CYS H C 1790 O O . CYS B 22 ? 0.5661 0.8160 0.6410 0.0441 0.0953 -0.0305 22 CYS H O 1791 C CB . CYS B 22 ? 0.5258 0.6834 0.6655 0.0194 0.0655 -0.0302 22 CYS H CB 1792 S SG . CYS B 22 ? 0.4111 0.5396 0.5470 0.0412 0.0311 -0.0538 22 CYS H SG 1793 N N . LYS B 23 ? 0.5364 0.7155 0.5831 0.0162 0.0999 0.0154 23 LYS H N 1794 C CA . LYS B 23 ? 0.6093 0.8223 0.6113 0.0327 0.1070 0.0189 23 LYS H CA 1795 C C . LYS B 23 ? 0.6159 0.8120 0.6026 0.0610 0.0809 -0.0040 23 LYS H C 1796 O O . LYS B 23 ? 0.5382 0.6892 0.5383 0.0565 0.0642 -0.0031 23 LYS H O 1797 C CB . LYS B 23 ? 0.6508 0.8485 0.6195 0.0086 0.1251 0.0631 23 LYS H CB 1798 C CG . LYS B 23 ? 0.7333 0.9734 0.6473 0.0205 0.1370 0.0779 23 LYS H CG 1799 C CD . LYS B 23 ? 0.7700 0.9887 0.6523 -0.0128 0.1534 0.1312 23 LYS H CD 1800 C CE . LYS B 23 ? 0.7727 1.0424 0.5941 -0.0049 0.1684 0.1545 23 LYS H CE 1801 N NZ . LYS B 23 ? 0.8303 1.0699 0.6192 -0.0452 0.1810 0.2158 23 LYS H NZ 1802 N N . ALA B 24 ? 0.6507 0.8928 0.6115 0.0917 0.0762 -0.0278 24 ALA H N 1803 C CA . ALA B 24 ? 0.6374 0.8686 0.5810 0.1209 0.0477 -0.0533 24 ALA H CA 1804 C C . ALA B 24 ? 0.7395 0.9542 0.6374 0.1196 0.0526 -0.0237 24 ALA H C 1805 O O . ALA B 24 ? 0.7985 1.0405 0.6511 0.1157 0.0761 0.0058 24 ALA H O 1806 C CB . ALA B 24 ? 0.5792 0.8671 0.5033 0.1615 0.0373 -0.0936 24 ALA H CB 1807 N N . SER B 25 ? 0.7937 0.9662 0.7042 0.1217 0.0288 -0.0294 25 SER H N 1808 C CA . SER B 25 ? 0.8438 0.9951 0.7129 0.1281 0.0250 -0.0074 25 SER H CA 1809 C C . SER B 25 ? 0.8675 1.0296 0.7209 0.1631 -0.0065 -0.0399 25 SER H C 1810 O O . SER B 25 ? 0.8375 0.9949 0.7366 0.1674 -0.0331 -0.0737 25 SER H O 1811 C CB . SER B 25 ? 0.8700 0.9737 0.7668 0.1063 0.0224 0.0111 25 SER H CB 1812 O OG . SER B 25 ? 0.9811 1.0600 0.8376 0.1200 0.0117 0.0271 25 SER H OG 1813 N N . GLY B 26 ? 0.7672 1.0631 0.8999 0.1908 0.1669 0.2667 26 GLY H N 1814 C CA . GLY B 26 ? 0.7701 1.1290 0.8618 0.2219 0.1354 0.2751 26 GLY H CA 1815 C C . GLY B 26 ? 0.7675 1.1513 0.8268 0.2086 0.1003 0.2423 26 GLY H C 1816 O O . GLY B 26 ? 0.7549 1.1911 0.7975 0.2074 0.0601 0.2213 26 GLY H O 1817 N N . GLY B 27 ? 0.7307 1.0766 0.7845 0.1972 0.1186 0.2359 27 GLY H N 1818 C CA . GLY B 27 ? 0.7209 1.0802 0.7442 0.1854 0.0939 0.2075 27 GLY H CA 1819 C C . GLY B 27 ? 0.7332 1.0452 0.7685 0.1674 0.1185 0.2008 27 GLY H C 1820 O O . GLY B 27 ? 0.7627 1.0372 0.8203 0.1725 0.1591 0.2228 27 GLY H O 1821 N N . THR B 28 ? 0.6943 1.0089 0.7183 0.1459 0.0969 0.1693 28 THR H N 1822 C CA . THR B 28 ? 0.6973 0.9772 0.7337 0.1308 0.1167 0.1622 28 THR H CA 1823 C C . THR B 28 ? 0.6121 0.8912 0.6624 0.0976 0.0918 0.1250 28 THR H C 1824 O O . THR B 28 ? 0.5221 0.8236 0.5649 0.0877 0.0618 0.1038 28 THR H O 1825 C CB . THR B 28 ? 0.7726 1.0508 0.7630 0.1568 0.1319 0.1769 28 THR H CB 1826 O OG1 . THR B 28 ? 0.8175 1.0667 0.8251 0.1401 0.1488 0.1672 28 THR H OG1 1827 C CG2 . THR B 28 ? 0.7793 1.0967 0.7174 0.1657 0.0981 0.1596 28 THR H CG2 1828 N N . PHE B 29 ? 0.6073 0.8622 0.6803 0.0822 0.1072 0.1180 29 PHE H N 1829 C CA . PHE B 29 ? 0.5377 0.7917 0.6207 0.0583 0.0894 0.0890 29 PHE H CA 1830 C C . PHE B 29 ? 0.5235 0.7867 0.5611 0.0642 0.0761 0.0756 29 PHE H C 1831 O O . PHE B 29 ? 0.4691 0.7338 0.5049 0.0486 0.0595 0.0511 29 PHE H O 1832 C CB . PHE B 29 ? 0.5126 0.7498 0.6332 0.0448 0.1094 0.0870 29 PHE H CB 1833 C CG . PHE B 29 ? 0.4951 0.7279 0.6642 0.0265 0.1143 0.0826 29 PHE H CG 1834 C CD1 . PHE B 29 ? 0.4893 0.7264 0.6643 0.0207 0.0988 0.0785 29 PHE H CD1 1835 C CD2 . PHE B 29 ? 0.4995 0.7266 0.7098 0.0140 0.1351 0.0797 29 PHE H CD2 1836 C CE1 . PHE B 29 ? 0.4459 0.6756 0.6610 0.0035 0.1054 0.0726 29 PHE H CE1 1837 C CE2 . PHE B 29 ? 0.4867 0.7132 0.7395 -0.0055 0.1396 0.0697 29 PHE H CE2 1838 C CZ . PHE B 29 ? 0.4533 0.6781 0.7054 -0.0103 0.1254 0.0666 29 PHE H CZ 1839 N N . SER B 30 ? 0.6778 0.9441 0.6771 0.0880 0.0876 0.0918 30 SER H N 1840 C CA . SER B 30 ? 0.7267 0.9996 0.6774 0.0945 0.0798 0.0782 30 SER H CA 1841 C C . SER B 30 ? 0.6904 0.9413 0.6511 0.0782 0.0870 0.0620 30 SER H C 1842 O O . SER B 30 ? 0.6891 0.9223 0.6763 0.0778 0.1092 0.0744 30 SER H O 1843 C CB . SER B 30 ? 0.7440 1.0492 0.6711 0.0898 0.0485 0.0547 30 SER H CB 1844 O OG . SER B 30 ? 0.8391 1.1538 0.7159 0.0956 0.0436 0.0381 30 SER H OG 1845 N N . SER B 31 ? 0.6256 0.8797 0.5691 0.0653 0.0712 0.0341 31 SER H N 1846 C CA . SER B 31 ? 0.6200 0.8521 0.5698 0.0544 0.0816 0.0215 31 SER H CA 1847 C C . SER B 31 ? 0.5021 0.7313 0.4869 0.0348 0.0708 0.0056 31 SER H C 1848 O O . SER B 31 ? 0.4907 0.7050 0.4719 0.0276 0.0761 -0.0095 31 SER H O 1849 C CB . SER B 31 ? 0.7471 0.9736 0.6468 0.0568 0.0838 0.0026 31 SER H CB 1850 O OG . SER B 31 ? 0.8067 1.0510 0.6914 0.0447 0.0623 -0.0254 31 SER H OG 1851 N N . TYR B 32 ? 0.4202 0.6602 0.4367 0.0289 0.0599 0.0109 32 TYR H N 1852 C CA . TYR B 32 ? 0.4079 0.6452 0.4521 0.0132 0.0495 -0.0030 32 TYR H CA 1853 C C . TYR B 32 ? 0.3787 0.6133 0.4632 0.0092 0.0572 0.0065 32 TYR H C 1854 O O . TYR B 32 ? 0.3985 0.6380 0.5036 0.0125 0.0667 0.0222 32 TYR H O 1855 C CB . TYR B 32 ? 0.4256 0.6783 0.4768 0.0080 0.0311 -0.0077 32 TYR H CB 1856 C CG . TYR B 32 ? 0.4461 0.7161 0.4647 0.0089 0.0181 -0.0245 32 TYR H CG 1857 C CD1 . TYR B 32 ? 0.4537 0.7201 0.4694 -0.0062 0.0116 -0.0534 32 TYR H CD1 1858 C CD2 . TYR B 32 ? 0.4933 0.7861 0.4847 0.0256 0.0145 -0.0128 32 TYR H CD2 1859 C CE1 . TYR B 32 ? 0.4891 0.7791 0.4810 -0.0100 -0.0006 -0.0762 32 TYR H CE1 1860 C CE2 . TYR B 32 ? 0.4922 0.8139 0.4534 0.0267 -0.0013 -0.0322 32 TYR H CE2 1861 C CZ . TYR B 32 ? 0.5450 0.8676 0.5092 0.0062 -0.0100 -0.0669 32 TYR H CZ 1862 O OH . TYR B 32 ? 0.6931 1.0519 0.6331 0.0027 -0.0259 -0.0934 32 TYR H OH 1863 N N . ALA B 33 ? 0.3668 0.5954 0.4628 0.0026 0.0552 -0.0046 33 ALA H N 1864 C CA . ALA B 33 ? 0.3447 0.5824 0.4759 -0.0001 0.0576 -0.0001 33 ALA H CA 1865 C C . ALA B 33 ? 0.4188 0.6624 0.5735 -0.0105 0.0455 -0.0030 33 ALA H C 1866 O O . ALA B 33 ? 0.4275 0.6647 0.5723 -0.0150 0.0353 -0.0095 33 ALA H O 1867 C CB . ALA B 33 ? 0.2695 0.5015 0.3970 0.0049 0.0632 -0.0060 33 ALA H CB 1868 N N . ILE B 34 ? 0.4442 0.7025 0.6318 -0.0155 0.0478 -0.0004 34 ILE H N 1869 C CA . ILE B 34 ? 0.4140 0.6751 0.6235 -0.0267 0.0403 -0.0048 34 ILE H CA 1870 C C . ILE B 34 ? 0.4100 0.6861 0.6355 -0.0294 0.0345 -0.0144 34 ILE H C 1871 O O . ILE B 34 ? 0.3872 0.6879 0.6327 -0.0283 0.0388 -0.0154 34 ILE H O 1872 C CB . ILE B 34 ? 0.3281 0.5929 0.5632 -0.0330 0.0524 0.0035 34 ILE H CB 1873 C CG1 . ILE B 34 ? 0.3813 0.6339 0.5946 -0.0230 0.0591 0.0182 34 ILE H CG1 1874 C CG2 . ILE B 34 ? 0.2870 0.5513 0.5459 -0.0465 0.0494 -0.0036 34 ILE H CG2 1875 C CD1 . ILE B 34 ? 0.3980 0.6445 0.5919 -0.0213 0.0447 0.0168 34 ILE H CD1 1876 N N . SER B 35 ? 0.3606 0.6257 0.5774 -0.0309 0.0253 -0.0215 35 SER H N 1877 C CA . SER B 35 ? 0.3268 0.6064 0.5504 -0.0282 0.0201 -0.0286 35 SER H CA 1878 C C . SER B 35 ? 0.2783 0.5640 0.5226 -0.0422 0.0151 -0.0366 35 SER H C 1879 O O . SER B 35 ? 0.2606 0.5312 0.5133 -0.0528 0.0181 -0.0346 35 SER H O 1880 C CB . SER B 35 ? 0.3276 0.5853 0.5248 -0.0168 0.0206 -0.0300 35 SER H CB 1881 O OG . SER B 35 ? 0.4344 0.6909 0.6160 -0.0019 0.0305 -0.0245 35 SER H OG 1882 N N . TRP B 36 ? 0.2674 0.5769 0.5180 -0.0400 0.0091 -0.0454 36 TRP H N 1883 C CA . TRP B 36 ? 0.2405 0.5554 0.5055 -0.0538 0.0051 -0.0578 36 TRP H CA 1884 C C . TRP B 36 ? 0.2420 0.5519 0.4841 -0.0419 -0.0019 -0.0611 36 TRP H C 1885 O O . TRP B 36 ? 0.2482 0.5742 0.4740 -0.0219 -0.0040 -0.0570 36 TRP H O 1886 C CB . TRP B 36 ? 0.2296 0.5880 0.5283 -0.0664 0.0056 -0.0718 36 TRP H CB 1887 C CG . TRP B 36 ? 0.3251 0.6685 0.6427 -0.0783 0.0199 -0.0659 36 TRP H CG 1888 C CD1 . TRP B 36 ? 0.3531 0.7097 0.6821 -0.0735 0.0284 -0.0579 36 TRP H CD1 1889 C CD2 . TRP B 36 ? 0.3644 0.6775 0.6918 -0.0936 0.0326 -0.0658 36 TRP H CD2 1890 N NE1 . TRP B 36 ? 0.3871 0.7245 0.7332 -0.0847 0.0461 -0.0529 36 TRP H NE1 1891 C CE2 . TRP B 36 ? 0.3765 0.6870 0.7212 -0.0962 0.0496 -0.0568 36 TRP H CE2 1892 C CE3 . TRP B 36 ? 0.3362 0.6235 0.6590 -0.1034 0.0349 -0.0713 36 TRP H CE3 1893 C CZ2 . TRP B 36 ? 0.3998 0.6828 0.7563 -0.1060 0.0702 -0.0521 36 TRP H CZ2 1894 C CZ3 . TRP B 36 ? 0.3993 0.6592 0.7339 -0.1138 0.0544 -0.0669 36 TRP H CZ3 1895 C CH2 . TRP B 36 ? 0.4562 0.7141 0.8071 -0.1142 0.0724 -0.0570 36 TRP H CH2 1896 N N . VAL B 37 ? 0.2294 0.5142 0.4692 -0.0513 -0.0015 -0.0658 37 VAL H N 1897 C CA . VAL B 37 ? 0.2527 0.5244 0.4692 -0.0396 -0.0037 -0.0677 37 VAL H CA 1898 C C . VAL B 37 ? 0.2890 0.5637 0.5150 -0.0552 -0.0054 -0.0824 37 VAL H C 1899 O O . VAL B 37 ? 0.3526 0.6124 0.5997 -0.0750 0.0012 -0.0854 37 VAL H O 1900 C CB . VAL B 37 ? 0.2888 0.5135 0.4892 -0.0339 0.0040 -0.0581 37 VAL H CB 1901 C CG1 . VAL B 37 ? 0.2883 0.4910 0.4683 -0.0230 0.0083 -0.0592 37 VAL H CG1 1902 C CG2 . VAL B 37 ? 0.3711 0.5907 0.5595 -0.0207 0.0093 -0.0493 37 VAL H CG2 1903 N N . ARG B 38 ? 0.2122 0.5064 0.4207 -0.0445 -0.0115 -0.0910 38 ARG H N 1904 C CA . ARG B 38 ? 0.2617 0.5551 0.4728 -0.0595 -0.0117 -0.1083 38 ARG H CA 1905 C C . ARG B 38 ? 0.2799 0.5389 0.4577 -0.0435 -0.0073 -0.1027 38 ARG H C 1906 O O . ARG B 38 ? 0.2579 0.5041 0.4107 -0.0181 -0.0041 -0.0879 38 ARG H O 1907 C CB . ARG B 38 ? 0.2973 0.6541 0.5189 -0.0655 -0.0233 -0.1316 38 ARG H CB 1908 C CG . ARG B 38 ? 0.2531 0.6481 0.4414 -0.0356 -0.0356 -0.1315 38 ARG H CG 1909 C CD . ARG B 38 ? 0.2496 0.7203 0.4521 -0.0446 -0.0508 -0.1604 38 ARG H CD 1910 N NE . ARG B 38 ? 0.2767 0.7922 0.4420 -0.0100 -0.0641 -0.1582 38 ARG H NE 1911 C CZ . ARG B 38 ? 0.2939 0.8913 0.4636 -0.0085 -0.0825 -0.1828 38 ARG H CZ 1912 N NH1 . ARG B 38 ? 0.2994 0.9110 0.5021 -0.0420 -0.0807 -0.2080 38 ARG H NH1 1913 N NH2 . ARG B 38 ? 0.3740 1.0134 0.5033 0.0309 -0.0937 -0.1748 38 ARG H NH2 1914 N N . GLN B 39 ? 0.3081 0.5470 0.4866 -0.0584 -0.0020 -0.1142 39 GLN H N 1915 C CA . GLN B 39 ? 0.3196 0.5222 0.4676 -0.0444 0.0056 -0.1096 39 GLN H CA 1916 C C . GLN B 39 ? 0.3677 0.5789 0.5082 -0.0573 0.0054 -0.1320 39 GLN H C 1917 O O . GLN B 39 ? 0.3884 0.5845 0.5540 -0.0847 0.0139 -0.1433 39 GLN H O 1918 C CB . GLN B 39 ? 0.3053 0.4504 0.4634 -0.0490 0.0200 -0.0942 39 GLN H CB 1919 C CG . GLN B 39 ? 0.3306 0.4327 0.4632 -0.0339 0.0330 -0.0875 39 GLN H CG 1920 C CD . GLN B 39 ? 0.3813 0.4384 0.5332 -0.0395 0.0459 -0.0750 39 GLN H CD 1921 O OE1 . GLN B 39 ? 0.3987 0.4554 0.5813 -0.0577 0.0449 -0.0732 39 GLN H OE1 1922 N NE2 . GLN B 39 ? 0.4478 0.4701 0.5835 -0.0222 0.0601 -0.0664 39 GLN H NE2 1923 N N . ALA B 40 ? 0.4116 0.6475 0.5151 -0.0358 -0.0018 -0.1384 40 ALA H N 1924 C CA . ALA B 40 ? 0.4590 0.7066 0.5463 -0.0457 -0.0030 -0.1633 40 ALA H CA 1925 C C . ALA B 40 ? 0.4765 0.6542 0.5467 -0.0446 0.0170 -0.1542 40 ALA H C 1926 O O . ALA B 40 ? 0.4976 0.6315 0.5587 -0.0259 0.0285 -0.1292 40 ALA H O 1927 C CB . ALA B 40 ? 0.3718 0.6801 0.4207 -0.0175 -0.0200 -0.1720 40 ALA H CB 1928 N N . PRO B 41 ? 0.5445 0.7105 0.6139 -0.0664 0.0246 -0.1765 41 PRO H N 1929 C CA . PRO B 41 ? 0.5420 0.6402 0.5990 -0.0670 0.0468 -0.1680 41 PRO H CA 1930 C C . PRO B 41 ? 0.5577 0.6298 0.5670 -0.0292 0.0532 -0.1496 41 PRO H C 1931 O O . PRO B 41 ? 0.6694 0.7715 0.6346 -0.0090 0.0452 -0.1601 41 PRO H O 1932 C CB . PRO B 41 ? 0.5794 0.6848 0.6326 -0.0930 0.0519 -0.2016 41 PRO H CB 1933 C CG . PRO B 41 ? 0.5685 0.7295 0.6583 -0.1193 0.0401 -0.2253 41 PRO H CG 1934 C CD . PRO B 41 ? 0.5452 0.7589 0.6311 -0.0954 0.0170 -0.2134 41 PRO H CD 1935 N N . GLY B 42 ? 0.5165 0.5362 0.5358 -0.0189 0.0693 -0.1234 42 GLY H N 1936 C CA . GLY B 42 ? 0.5243 0.5076 0.5063 0.0153 0.0850 -0.1046 42 GLY H CA 1937 C C . GLY B 42 ? 0.6292 0.6344 0.5965 0.0459 0.0804 -0.0880 42 GLY H C 1938 O O . GLY B 42 ? 0.7419 0.7092 0.6856 0.0750 0.1011 -0.0688 42 GLY H O 1939 N N . GLN B 43 ? 0.5771 0.6395 0.5600 0.0397 0.0583 -0.0947 43 GLN H N 1940 C CA . GLN B 43 ? 0.5856 0.6726 0.5561 0.0686 0.0553 -0.0788 43 GLN H CA 1941 C C . GLN B 43 ? 0.5036 0.5644 0.5115 0.0582 0.0630 -0.0658 43 GLN H C 1942 O O . GLN B 43 ? 0.4705 0.5029 0.5134 0.0309 0.0670 -0.0686 43 GLN H O 1943 C CB . GLN B 43 ? 0.6592 0.8281 0.6275 0.0700 0.0280 -0.0934 43 GLN H CB 1944 C CG . GLN B 43 ? 0.7702 0.9825 0.7028 0.0781 0.0154 -0.1137 43 GLN H CG 1945 C CD . GLN B 43 ? 0.9051 1.1130 0.7778 0.1285 0.0265 -0.0949 43 GLN H CD 1946 O OE1 . GLN B 43 ? 0.9878 1.2464 0.8384 0.1627 0.0180 -0.0839 43 GLN H OE1 1947 N NE2 . GLN B 43 ? 0.9361 1.0823 0.7818 0.1369 0.0489 -0.0884 43 GLN H NE2 1948 N N . GLY B 44 ? 0.4213 0.4951 0.4201 0.0817 0.0661 -0.0520 44 GLY H N 1949 C CA . GLY B 44 ? 0.4005 0.4536 0.4291 0.0725 0.0740 -0.0439 44 GLY H CA 1950 C C . GLY B 44 ? 0.4214 0.5209 0.4790 0.0524 0.0518 -0.0517 44 GLY H C 1951 O O . GLY B 44 ? 0.4068 0.5481 0.4738 0.0368 0.0325 -0.0661 44 GLY H O 1952 N N . LEU B 45 ? 0.4077 0.4977 0.4799 0.0522 0.0582 -0.0441 45 LEU H N 1953 C CA . LEU B 45 ? 0.3961 0.5220 0.4934 0.0355 0.0419 -0.0486 45 LEU H CA 1954 C C . LEU B 45 ? 0.4251 0.5948 0.5076 0.0587 0.0365 -0.0421 45 LEU H C 1955 O O . LEU B 45 ? 0.4708 0.6303 0.5253 0.0906 0.0524 -0.0283 45 LEU H O 1956 C CB . LEU B 45 ? 0.3595 0.4557 0.4786 0.0216 0.0504 -0.0466 45 LEU H CB 1957 C CG . LEU B 45 ? 0.3508 0.4161 0.4923 -0.0001 0.0536 -0.0517 45 LEU H CG 1958 C CD1 . LEU B 45 ? 0.2626 0.3061 0.4203 -0.0075 0.0634 -0.0526 45 LEU H CD1 1959 C CD2 . LEU B 45 ? 0.3134 0.4029 0.4778 -0.0231 0.0371 -0.0580 45 LEU H CD2 1960 N N . GLU B 46 ? 0.3658 0.5833 0.4694 0.0445 0.0180 -0.0502 46 GLU H N 1961 C CA . GLU B 46 ? 0.3726 0.6411 0.4701 0.0650 0.0113 -0.0449 46 GLU H CA 1962 C C . GLU B 46 ? 0.3713 0.6653 0.5004 0.0462 0.0027 -0.0486 46 GLU H C 1963 O O . GLU B 46 ? 0.4003 0.7087 0.5568 0.0182 -0.0077 -0.0625 46 GLU H O 1964 C CB . GLU B 46 ? 0.3319 0.6564 0.4180 0.0749 -0.0049 -0.0557 46 GLU H CB 1965 C CG . GLU B 46 ? 0.3743 0.7604 0.4498 0.1061 -0.0115 -0.0469 46 GLU H CG 1966 C CD . GLU B 46 ? 0.4727 0.9262 0.5356 0.1166 -0.0311 -0.0618 46 GLU H CD 1967 O OE1 . GLU B 46 ? 0.4418 0.9007 0.5155 0.0881 -0.0419 -0.0863 46 GLU H OE1 1968 O OE2 . GLU B 46 ? 0.5658 1.0696 0.6075 0.1545 -0.0345 -0.0496 46 GLU H OE2 1969 N N . TRP B 47 ? 0.3150 0.6094 0.4390 0.0631 0.0122 -0.0350 47 TRP H N 1970 C CA . TRP B 47 ? 0.2961 0.6123 0.4447 0.0505 0.0077 -0.0358 47 TRP H CA 1971 C C . TRP B 47 ? 0.3166 0.7049 0.4830 0.0538 -0.0077 -0.0426 47 TRP H C 1972 O O . TRP B 47 ? 0.2437 0.6700 0.3942 0.0817 -0.0108 -0.0369 47 TRP H O 1973 C CB . TRP B 47 ? 0.2839 0.5720 0.4186 0.0673 0.0269 -0.0206 47 TRP H CB 1974 C CG . TRP B 47 ? 0.2267 0.5296 0.3798 0.0575 0.0261 -0.0195 47 TRP H CG 1975 C CD1 . TRP B 47 ? 0.2403 0.5242 0.4075 0.0331 0.0244 -0.0254 47 TRP H CD1 1976 C CD2 . TRP B 47 ? 0.2337 0.5734 0.3909 0.0760 0.0297 -0.0094 47 TRP H CD2 1977 N NE1 . TRP B 47 ? 0.2338 0.5360 0.4105 0.0346 0.0276 -0.0203 47 TRP H NE1 1978 C CE2 . TRP B 47 ? 0.2207 0.5561 0.3941 0.0592 0.0314 -0.0110 47 TRP H CE2 1979 C CE3 . TRP B 47 ? 0.2530 0.6319 0.4011 0.1083 0.0327 0.0029 47 TRP H CE3 1980 C CZ2 . TRP B 47 ? 0.2879 0.6516 0.4710 0.0708 0.0374 -0.0019 47 TRP H CZ2 1981 C CZ3 . TRP B 47 ? 0.3337 0.7465 0.4946 0.1205 0.0371 0.0126 47 TRP H CZ3 1982 C CH2 . TRP B 47 ? 0.2892 0.6917 0.4687 0.1003 0.0402 0.0094 47 TRP H CH2 1983 N N . MET B 48 ? 0.2201 0.6302 0.4212 0.0269 -0.0155 -0.0550 48 MET H N 1984 C CA . MET B 48 ? 0.2713 0.7528 0.5009 0.0233 -0.0278 -0.0674 48 MET H CA 1985 C C . MET B 48 ? 0.2709 0.7704 0.5183 0.0290 -0.0212 -0.0568 48 MET H C 1986 O O . MET B 48 ? 0.3005 0.8572 0.5572 0.0473 -0.0261 -0.0541 48 MET H O 1987 C CB . MET B 48 ? 0.2071 0.7002 0.4697 -0.0126 -0.0335 -0.0920 48 MET H CB 1988 C CG . MET B 48 ? 0.2579 0.7264 0.5039 -0.0212 -0.0364 -0.1031 48 MET H CG 1989 S SD . MET B 48 ? 0.3939 0.8567 0.6678 -0.0603 -0.0340 -0.1294 48 MET H SD 1990 C CE . MET B 48 ? 0.2268 0.7557 0.5090 -0.0575 -0.0459 -0.1470 48 MET H CE 1991 N N . GLY B 49 ? 0.2500 0.7035 0.5013 0.0152 -0.0096 -0.0502 49 GLY H N 1992 C CA . GLY B 49 ? 0.2512 0.7112 0.5144 0.0198 0.0001 -0.0398 49 GLY H CA 1993 C C . GLY B 49 ? 0.3324 0.7409 0.5921 0.0042 0.0108 -0.0350 49 GLY H C 1994 O O . GLY B 49 ? 0.3674 0.7400 0.6186 -0.0089 0.0096 -0.0389 49 GLY H O 1995 N N . GLY B 50 ? 0.3553 0.7637 0.6206 0.0082 0.0217 -0.0257 50 GLY H N 1996 C CA . GLY B 50 ? 0.1795 0.5471 0.4358 -0.0016 0.0313 -0.0203 50 GLY H CA 1997 C C . GLY B 50 ? 0.2813 0.6641 0.5573 -0.0019 0.0434 -0.0142 50 GLY H C 1998 O O . GLY B 50 ? 0.2614 0.6879 0.5630 0.0042 0.0443 -0.0150 50 GLY H O 1999 N N . ILE B 51 ? 0.2896 0.6400 0.5539 -0.0069 0.0532 -0.0075 51 ILE H N 2000 C CA . ILE B 51 ? 0.2560 0.6122 0.5346 -0.0054 0.0694 0.0007 51 ILE H CA 2001 C C . ILE B 51 ? 0.2960 0.6119 0.5374 0.0008 0.0793 0.0112 51 ILE H C 2002 O O . ILE B 51 ? 0.2910 0.5825 0.5087 -0.0029 0.0723 0.0096 51 ILE H O 2003 C CB . ILE B 51 ? 0.2457 0.6215 0.5698 -0.0235 0.0767 -0.0062 51 ILE H CB 2004 C CG1 . ILE B 51 ? 0.2507 0.6357 0.5978 -0.0208 0.0984 0.0019 51 ILE H CG1 2005 C CG2 . ILE B 51 ? 0.2042 0.5478 0.5199 -0.0345 0.0786 -0.0052 51 ILE H CG2 2006 C CD1 . ILE B 51 ? 0.3410 0.7457 0.7420 -0.0405 0.1133 -0.0084 51 ILE H CD1 2007 N N . ILE B 52 ? 0.3335 0.6476 0.5698 0.0115 0.0952 0.0208 52 ILE H N 2008 C CA . ILE B 52 ? 0.3532 0.6356 0.5531 0.0186 0.1067 0.0296 52 ILE H CA 2009 C C . ILE B 52 ? 0.3505 0.6333 0.5710 0.0161 0.1235 0.0394 52 ILE H C 2010 O O . ILE B 52 ? 0.4260 0.7211 0.6713 0.0197 0.1409 0.0455 52 ILE H O 2011 C CB . ILE B 52 ? 0.4340 0.7058 0.6102 0.0337 0.1203 0.0350 52 ILE H CB 2012 C CG1 . ILE B 52 ? 0.4296 0.7005 0.5947 0.0396 0.1140 0.0285 52 ILE H CG1 2013 C CG2 . ILE B 52 ? 0.4384 0.6779 0.5676 0.0397 0.1293 0.0382 52 ILE H CG2 2014 C CD1 . ILE B 52 ? 0.4618 0.7281 0.6174 0.0568 0.1338 0.0372 52 ILE H CD1 2015 N N . PRO B 53 A 0.3437 0.6125 0.5563 0.0118 0.1221 0.0428 52 PRO H N 2016 C CA . PRO B 53 A 0.3621 0.6243 0.5946 0.0121 0.1453 0.0553 52 PRO H CA 2017 C C . PRO B 53 A 0.4334 0.6827 0.6513 0.0276 0.1701 0.0703 52 PRO H C 2018 O O . PRO B 53 A 0.5068 0.7606 0.7635 0.0251 0.1951 0.0760 52 PRO H O 2019 C CB . PRO B 53 A 0.3676 0.6131 0.5728 0.0158 0.1387 0.0619 52 PRO H CB 2020 C CG . PRO B 53 A 0.3098 0.5629 0.5104 0.0057 0.1107 0.0460 52 PRO H CG 2021 C CD . PRO B 53 A 0.3660 0.6248 0.5536 0.0083 0.1022 0.0363 52 PRO H CD 2022 N N . ILE B 54 ? 0.4391 0.6722 0.6033 0.0418 0.1657 0.0738 53 ILE H N 2023 C CA . ILE B 54 ? 0.4278 0.6438 0.5667 0.0586 0.1896 0.0878 53 ILE H CA 2024 C C . ILE B 54 ? 0.4054 0.6337 0.5831 0.0574 0.2065 0.0885 53 ILE H C 2025 O O . ILE B 54 ? 0.4375 0.6565 0.6258 0.0661 0.2355 0.1023 53 ILE H O 2026 C CB . ILE B 54 ? 0.5886 0.7887 0.6616 0.0698 0.1796 0.0830 53 ILE H CB 2027 C CG1 . ILE B 54 ? 0.7062 0.9077 0.7456 0.0709 0.1588 0.0788 53 ILE H CG1 2028 C CG2 . ILE B 54 ? 0.6159 0.7955 0.6559 0.0885 0.2060 0.0973 53 ILE H CG2 2029 C CD1 . ILE B 54 ? 0.7556 0.9681 0.8019 0.0547 0.1307 0.0580 53 ILE H CD1 2030 N N . PHE B 55 ? 0.3599 0.6119 0.5601 0.0491 0.1904 0.0754 54 PHE H N 2031 C CA . PHE B 55 ? 0.3846 0.6589 0.6205 0.0525 0.2031 0.0773 54 PHE H CA 2032 C C . PHE B 55 ? 0.3444 0.6652 0.6500 0.0369 0.1977 0.0667 54 PHE H C 2033 O O . PHE B 55 ? 0.3792 0.7308 0.7282 0.0382 0.2103 0.0676 54 PHE H O 2034 C CB . PHE B 55 ? 0.3494 0.6203 0.5557 0.0623 0.1950 0.0739 54 PHE H CB 2035 C CG . PHE B 55 ? 0.4176 0.6468 0.5623 0.0751 0.2075 0.0791 54 PHE H CG 2036 C CD1 . PHE B 55 ? 0.4690 0.6769 0.5966 0.0847 0.2312 0.0922 54 PHE H CD1 2037 C CD2 . PHE B 55 ? 0.4019 0.6119 0.5052 0.0773 0.1990 0.0688 54 PHE H CD2 2038 C CE1 . PHE B 55 ? 0.5319 0.7049 0.5975 0.0965 0.2418 0.0937 54 PHE H CE1 2039 C CE2 . PHE B 55 ? 0.4455 0.6199 0.4930 0.0850 0.2117 0.0667 54 PHE H CE2 2040 C CZ . PHE B 55 ? 0.6172 0.7754 0.6434 0.0947 0.2310 0.0784 54 PHE H CZ 2041 N N . GLY B 56 ? 0.3795 0.7092 0.6968 0.0218 0.1792 0.0545 55 GLY H N 2042 C CA . GLY B 56 ? 0.3517 0.7273 0.7300 0.0041 0.1721 0.0382 55 GLY H CA 2043 C C . GLY B 56 ? 0.3576 0.7748 0.7444 0.0092 0.1504 0.0294 55 GLY H C 2044 O O . GLY B 56 ? 0.3756 0.8447 0.8110 -0.0020 0.1412 0.0139 55 GLY H O 2045 N N . THR B 57 ? 0.3906 0.7861 0.7292 0.0272 0.1447 0.0385 56 THR H N 2046 C CA . THR B 57 ? 0.3358 0.7608 0.6726 0.0397 0.1307 0.0367 56 THR H CA 2047 C C . THR B 57 ? 0.2496 0.6840 0.5820 0.0307 0.1059 0.0230 56 THR H C 2048 O O . THR B 57 ? 0.3048 0.6989 0.6023 0.0253 0.0993 0.0209 56 THR H O 2049 C CB . THR B 57 ? 0.3653 0.7514 0.6503 0.0604 0.1410 0.0496 56 THR H CB 2050 O OG1 . THR B 57 ? 0.5350 0.9141 0.8236 0.0711 0.1659 0.0629 56 THR H OG1 2051 C CG2 . THR B 57 ? 0.3154 0.7236 0.5953 0.0777 0.1332 0.0519 56 THR H CG2 2052 N N . ALA B 58 ? 0.2070 0.6987 0.5746 0.0303 0.0923 0.0130 57 ALA H N 2053 C CA . ALA B 58 ? 0.2508 0.7538 0.6134 0.0231 0.0705 -0.0005 57 ALA H CA 2054 C C . ALA B 58 ? 0.2369 0.7678 0.5837 0.0479 0.0603 0.0050 57 ALA H C 2055 O O . ALA B 58 ? 0.2364 0.7951 0.5935 0.0640 0.0622 0.0119 57 ALA H O 2056 C CB . ALA B 58 ? 0.1884 0.7131 0.5916 -0.0017 0.0617 -0.0205 57 ALA H CB 2057 N N . SER B 59 ? 0.2282 0.7315 0.5407 0.0512 0.0506 0.0032 58 SER H N 2058 C CA . SER B 59 ? 0.2089 0.7312 0.5012 0.0778 0.0454 0.0106 58 SER H CA 2059 C C . SER B 59 ? 0.2442 0.7895 0.5399 0.0685 0.0244 -0.0059 58 SER H C 2060 O O . SER B 59 ? 0.2057 0.7230 0.5030 0.0431 0.0187 -0.0191 58 SER H O 2061 C CB . SER B 59 ? 0.3905 0.8470 0.6336 0.0942 0.0625 0.0250 58 SER H CB 2062 O OG . SER B 59 ? 0.4584 0.8875 0.6938 0.0986 0.0833 0.0358 58 SER H OG 2063 N N . TYR B 60 ? 0.2611 0.8407 0.5467 0.0891 0.0140 -0.0035 59 TYR H N 2064 C CA . TYR B 60 ? 0.2922 0.8917 0.5729 0.0815 -0.0057 -0.0202 59 TYR H CA 2065 C C . TYR B 60 ? 0.3388 0.9471 0.5822 0.1182 -0.0055 -0.0057 59 TYR H C 2066 O O . TYR B 60 ? 0.3139 0.9280 0.5404 0.1507 0.0069 0.0164 59 TYR H O 2067 C CB . TYR B 60 ? 0.3186 0.9659 0.6286 0.0650 -0.0209 -0.0397 59 TYR H CB 2068 C CG . TYR B 60 ? 0.3344 0.9692 0.6841 0.0328 -0.0143 -0.0516 59 TYR H CG 2069 C CD1 . TYR B 60 ? 0.3751 0.9777 0.7350 0.0019 -0.0136 -0.0675 59 TYR H CD1 2070 C CD2 . TYR B 60 ? 0.2663 0.9189 0.6430 0.0360 -0.0047 -0.0444 59 TYR H CD2 2071 C CE1 . TYR B 60 ? 0.2052 0.7920 0.5982 -0.0221 -0.0013 -0.0735 59 TYR H CE1 2072 C CE2 . TYR B 60 ? 0.2553 0.8949 0.6691 0.0101 0.0065 -0.0526 59 TYR H CE2 2073 C CZ . TYR B 60 ? 0.2701 0.8761 0.6904 -0.0178 0.0091 -0.0660 59 TYR H CZ 2074 O OH . TYR B 60 ? 0.2797 0.8692 0.7327 -0.0389 0.0259 -0.0692 59 TYR H OH 2075 N N . ALA B 61 ? 0.2375 0.8410 0.4661 0.1149 -0.0150 -0.0161 60 ALA H N 2076 C CA . ALA B 61 ? 0.3202 0.9377 0.5124 0.1517 -0.0151 -0.0035 60 ALA H CA 2077 C C . ALA B 61 ? 0.3362 1.0203 0.5283 0.1616 -0.0325 -0.0098 60 ALA H C 2078 O O . ALA B 61 ? 0.3377 1.0535 0.5563 0.1309 -0.0498 -0.0369 60 ALA H O 2079 C CB . ALA B 61 ? 0.2640 0.8487 0.4367 0.1420 -0.0196 -0.0146 60 ALA H CB 2080 N N . GLN B 62 ? 0.4192 0.7741 0.6978 0.1794 -0.0487 0.0354 61 GLN H N 2081 C CA . GLN B 62 ? 0.3529 0.7787 0.6654 0.1927 -0.0603 0.0412 61 GLN H CA 2082 C C . GLN B 62 ? 0.3493 0.8253 0.6532 0.1708 -0.0753 0.0407 61 GLN H C 2083 O O . GLN B 62 ? 0.4264 0.9664 0.7588 0.1709 -0.0872 0.0362 61 GLN H O 2084 C CB . GLN B 62 ? 0.4079 0.8225 0.7291 0.2261 -0.0740 0.0675 61 GLN H CB 2085 C CG . GLN B 62 ? 0.5091 0.8761 0.8403 0.2541 -0.0595 0.0628 61 GLN H CG 2086 C CD . GLN B 62 ? 0.5893 0.9469 0.9376 0.2914 -0.0738 0.0871 61 GLN H CD 2087 O OE1 . GLN B 62 ? 0.6912 1.0700 1.0377 0.2944 -0.0964 0.1131 61 GLN H OE1 2088 N NE2 . GLN B 62 ? 0.5690 0.8918 0.9301 0.3222 -0.0601 0.0791 61 GLN H NE2 2089 N N . LYS B 63 ? 0.3817 0.8286 0.6470 0.1523 -0.0749 0.0442 62 LYS H N 2090 C CA . LYS B 63 ? 0.3566 0.8405 0.6006 0.1335 -0.0846 0.0396 62 LYS H CA 2091 C C . LYS B 63 ? 0.3359 0.8554 0.5978 0.1125 -0.0811 0.0081 62 LYS H C 2092 O O . LYS B 63 ? 0.3666 0.9337 0.6268 0.1038 -0.0974 -0.0003 62 LYS H O 2093 C CB . LYS B 63 ? 0.3799 0.8234 0.5855 0.1198 -0.0757 0.0478 62 LYS H CB 2094 C CG . LYS B 63 ? 0.4895 0.9644 0.6638 0.1038 -0.0792 0.0400 62 LYS H CG 2095 C CD . LYS B 63 ? 0.5624 1.0027 0.7086 0.0940 -0.0641 0.0513 62 LYS H CD 2096 C CE . LYS B 63 ? 0.5933 1.0631 0.7027 0.0826 -0.0617 0.0404 62 LYS H CE 2097 N NZ . LYS B 63 ? 0.5937 1.0382 0.6847 0.0754 -0.0413 0.0535 62 LYS H NZ 2098 N N . PHE B 64 ? 0.2864 0.7789 0.5626 0.1036 -0.0621 -0.0085 63 PHE H N 2099 C CA . PHE B 64 ? 0.2654 0.7789 0.5572 0.0799 -0.0565 -0.0351 63 PHE H CA 2100 C C . PHE B 64 ? 0.3601 0.9082 0.7011 0.0832 -0.0504 -0.0421 63 PHE H C 2101 O O . PHE B 64 ? 0.3412 0.9112 0.7037 0.0615 -0.0471 -0.0604 63 PHE H O 2102 C CB . PHE B 64 ? 0.2513 0.7111 0.5223 0.0634 -0.0391 -0.0464 63 PHE H CB 2103 C CG . PHE B 64 ? 0.3970 0.8312 0.6319 0.0586 -0.0403 -0.0398 63 PHE H CG 2104 C CD1 . PHE B 64 ? 0.4454 0.9036 0.6623 0.0459 -0.0466 -0.0519 63 PHE H CD1 2105 C CD2 . PHE B 64 ? 0.3131 0.6996 0.5335 0.0666 -0.0345 -0.0220 63 PHE H CD2 2106 C CE1 . PHE B 64 ? 0.4136 0.8538 0.5991 0.0441 -0.0411 -0.0447 63 PHE H CE1 2107 C CE2 . PHE B 64 ? 0.3204 0.6915 0.5184 0.0609 -0.0324 -0.0122 63 PHE H CE2 2108 C CZ . PHE B 64 ? 0.3321 0.7328 0.5131 0.0510 -0.0327 -0.0227 63 PHE H CZ 2109 N N . GLN B 65 ? 0.3364 0.8890 0.6984 0.1106 -0.0472 -0.0270 64 GLN H N 2110 C CA . GLN B 65 ? 0.3102 0.9018 0.7244 0.1187 -0.0352 -0.0309 64 GLN H CA 2111 C C . GLN B 65 ? 0.2557 0.9189 0.7136 0.1024 -0.0523 -0.0376 64 GLN H C 2112 O O . GLN B 65 ? 0.3355 1.0266 0.7928 0.1067 -0.0793 -0.0286 64 GLN H O 2113 C CB . GLN B 65 ? 0.3155 0.9046 0.7465 0.1572 -0.0317 -0.0135 64 GLN H CB 2114 C CG . GLN B 65 ? 0.4124 0.9206 0.8021 0.1718 -0.0152 -0.0108 64 GLN H CG 2115 C CD . GLN B 65 ? 0.4492 0.9520 0.8616 0.2082 -0.0001 -0.0057 64 GLN H CD 2116 O OE1 . GLN B 65 ? 0.5679 1.0362 0.9679 0.2352 -0.0085 0.0082 64 GLN H OE1 2117 N NE2 . GLN B 65 ? 0.3992 0.9339 0.8454 0.2100 0.0244 -0.0164 64 GLN H NE2 2118 N N . GLY B 66 ? 0.2469 0.9192 0.7319 0.0796 -0.0374 -0.0504 65 GLY H N 2119 C CA . GLY B 66 ? 0.2574 0.9722 0.7784 0.0563 -0.0540 -0.0556 65 GLY H CA 2120 C C . GLY B 66 ? 0.5114 1.2099 1.0103 0.0212 -0.0602 -0.0770 65 GLY H C 2121 O O . GLY B 66 ? 0.2627 0.9830 0.7937 -0.0034 -0.0675 -0.0846 65 GLY H O 2122 N N . ARG B 67 ? 0.2405 0.8997 0.6895 0.0194 -0.0576 -0.0860 66 ARG H N 2123 C CA . ARG B 67 ? 0.4271 1.0634 0.8535 -0.0094 -0.0612 -0.1084 66 ARG H CA 2124 C C . ARG B 67 ? 0.3318 0.9125 0.7401 -0.0162 -0.0347 -0.1128 66 ARG H C 2125 O O . ARG B 67 ? 0.3750 0.9274 0.7694 -0.0384 -0.0341 -0.1293 66 ARG H O 2126 C CB . ARG B 67 ? 0.4456 1.0782 0.8239 -0.0072 -0.0818 -0.1156 66 ARG H CB 2127 C CG . ARG B 67 ? 0.4700 1.1500 0.8490 -0.0041 -0.1136 -0.1140 66 ARG H CG 2128 C CD . ARG B 67 ? 0.4242 1.0964 0.7453 -0.0099 -0.1300 -0.1295 66 ARG H CD 2129 N NE . ARG B 67 ? 0.3127 0.9436 0.5833 0.0088 -0.1152 -0.1122 66 ARG H NE 2130 C CZ . ARG B 67 ? 0.4518 1.0377 0.6829 0.0023 -0.0995 -0.1225 66 ARG H CZ 2131 N NH1 . ARG B 67 ? 0.3202 0.8898 0.5513 -0.0194 -0.0965 -0.1515 66 ARG H NH1 2132 N NH2 . ARG B 67 ? 0.3718 0.9289 0.5691 0.0176 -0.0867 -0.1025 66 ARG H NH2 2133 N N . VAL B 68 ? 0.2649 0.8186 0.6657 0.0042 -0.0148 -0.0974 67 VAL H N 2134 C CA . VAL B 68 ? 0.3019 0.7904 0.6706 0.0003 0.0045 -0.0981 67 VAL H CA 2135 C C . VAL B 68 ? 0.3863 0.8693 0.7723 0.0040 0.0300 -0.0917 67 VAL H C 2136 O O . VAL B 68 ? 0.4084 0.9219 0.8183 0.0246 0.0383 -0.0819 67 VAL H O 2137 C CB . VAL B 68 ? 0.2782 0.7200 0.6026 0.0195 0.0024 -0.0873 67 VAL H CB 2138 C CG1 . VAL B 68 ? 0.3449 0.7945 0.6745 0.0492 0.0041 -0.0708 67 VAL H CG1 2139 C CG2 . VAL B 68 ? 0.2215 0.5986 0.5161 0.0126 0.0148 -0.0888 67 VAL H CG2 2140 N N . THR B 69 ? 0.3279 0.7723 0.7008 -0.0145 0.0435 -0.0966 68 THR H N 2141 C CA . THR B 69 ? 0.2692 0.6996 0.6426 -0.0117 0.0709 -0.0888 68 THR H CA 2142 C C . THR B 69 ? 0.3473 0.7021 0.6677 -0.0156 0.0773 -0.0882 68 THR H C 2143 O O . THR B 69 ? 0.3971 0.7263 0.7103 -0.0371 0.0698 -0.0947 68 THR H O 2144 C CB . THR B 69 ? 0.2907 0.7655 0.7156 -0.0365 0.0821 -0.0895 68 THR H CB 2145 O OG1 . THR B 69 ? 0.3088 0.8601 0.7911 -0.0321 0.0731 -0.0883 68 THR H OG1 2146 C CG2 . THR B 69 ? 0.2726 0.7305 0.6892 -0.0338 0.1163 -0.0779 68 THR H CG2 2147 N N . ILE B 70 ? 0.3180 0.6347 0.6012 0.0065 0.0884 -0.0813 69 ILE H N 2148 C CA . ILE B 70 ? 0.3619 0.6065 0.5921 0.0040 0.0886 -0.0800 69 ILE H CA 2149 C C . ILE B 70 ? 0.3810 0.6047 0.5867 0.0060 0.1155 -0.0739 69 ILE H C 2150 O O . ILE B 70 ? 0.3824 0.6090 0.5753 0.0296 0.1328 -0.0717 69 ILE H O 2151 C CB . ILE B 70 ? 0.3821 0.5843 0.5765 0.0246 0.0735 -0.0784 69 ILE H CB 2152 C CG1 . ILE B 70 ? 0.3512 0.5735 0.5649 0.0218 0.0513 -0.0797 69 ILE H CG1 2153 C CG2 . ILE B 70 ? 0.4015 0.5322 0.5459 0.0203 0.0681 -0.0771 69 ILE H CG2 2154 C CD1 . ILE B 70 ? 0.4061 0.5931 0.5959 0.0386 0.0373 -0.0730 69 ILE H CD1 2155 N N . THR B 71 ? 0.4296 0.6298 0.6258 -0.0172 0.1204 -0.0706 70 THR H N 2156 C CA . THR B 71 ? 0.4776 0.6556 0.6428 -0.0186 0.1477 -0.0605 70 THR H CA 2157 C C . THR B 71 ? 0.5469 0.6458 0.6455 -0.0210 0.1365 -0.0569 70 THR H C 2158 O O . THR B 71 ? 0.5476 0.6159 0.6380 -0.0235 0.1080 -0.0619 70 THR H O 2159 C CB . THR B 71 ? 0.4541 0.6713 0.6661 -0.0465 0.1647 -0.0527 70 THR H CB 2160 O OG1 . THR B 71 ? 0.3988 0.5968 0.6248 -0.0720 0.1421 -0.0569 70 THR H OG1 2161 C CG2 . THR B 71 ? 0.4005 0.7012 0.6837 -0.0452 0.1731 -0.0548 70 THR H CG2 2162 N N . ALA B 72 ? 0.5643 0.6330 0.6163 -0.0198 0.1589 -0.0467 71 ALA H N 2163 C CA . ALA B 72 ? 0.6001 0.5929 0.5825 -0.0218 0.1452 -0.0412 71 ALA H CA 2164 C C . ALA B 72 ? 0.6971 0.6707 0.6410 -0.0317 0.1733 -0.0238 71 ALA H C 2165 O O . ALA B 72 ? 0.7861 0.7786 0.7121 -0.0186 0.2085 -0.0197 71 ALA H O 2166 C CB . ALA B 72 ? 0.5789 0.5261 0.5039 0.0047 0.1316 -0.0509 71 ALA H CB 2167 N N . ASP B 73 ? 0.7474 0.6836 0.6794 -0.0533 0.1595 -0.0117 72 ASP H N 2168 C CA . ASP B 73 ? 0.8547 0.7618 0.7410 -0.0644 0.1825 0.0104 72 ASP H CA 2169 C C . ASP B 73 ? 0.9864 0.8156 0.7733 -0.0506 0.1660 0.0140 72 ASP H C 2170 O O . ASP B 73 ? 0.9947 0.7781 0.7672 -0.0571 0.1286 0.0158 72 ASP H O 2171 C CB . ASP B 73 ? 0.8722 0.7774 0.8024 -0.0962 0.1754 0.0246 72 ASP H CB 2172 C CG . ASP B 73 ? 1.0143 0.8924 0.9035 -0.1109 0.2019 0.0537 72 ASP H CG 2173 O OD1 . ASP B 73 ? 1.0622 0.9881 0.9913 -0.1246 0.2379 0.0659 72 ASP H OD1 2174 O OD2 . ASP B 73 ? 1.0936 0.9043 0.9125 -0.1095 0.1857 0.0668 72 ASP H OD2 2175 N N . LYS B 74 ? 1.1569 0.9720 0.8761 -0.0302 0.1929 0.0139 73 LYS H N 2176 C CA . LYS B 74 ? 1.2499 0.9881 0.8640 -0.0143 0.1742 0.0114 73 LYS H CA 2177 C C . LYS B 74 ? 1.3190 1.0028 0.8723 -0.0308 0.1674 0.0372 73 LYS H C 2178 O O . LYS B 74 ? 1.3788 0.9951 0.8573 -0.0248 0.1335 0.0371 73 LYS H O 2179 C CB . LYS B 74 ? 1.3490 1.0840 0.9006 0.0156 0.2086 -0.0001 73 LYS H CB 2180 C CG . LYS B 74 ? 1.4639 1.1592 0.9772 0.0410 0.1787 -0.0273 73 LYS H CG 2181 C CD . LYS B 74 ? 1.5471 1.1622 0.9937 0.0351 0.1273 -0.0274 73 LYS H CD 2182 C CE . LYS B 74 ? 1.5127 1.0856 0.9277 0.0555 0.0944 -0.0536 73 LYS H CE 2183 N NZ . LYS B 74 ? 1.5054 1.0054 0.8648 0.0470 0.0397 -0.0528 73 LYS H NZ 2184 N N . SER B 75 ? 1.2582 0.9699 0.8457 -0.0527 0.1964 0.0612 74 SER H N 2185 C CA . SER B 75 ? 1.3171 0.9765 0.8483 -0.0689 0.1932 0.0916 74 SER H CA 2186 C C . SER B 75 ? 1.2996 0.9217 0.8576 -0.0830 0.1403 0.0957 74 SER H C 2187 O O . SER B 75 ? 1.3898 0.9530 0.8898 -0.0897 0.1209 0.1181 74 SER H O 2188 C CB . SER B 75 ? 1.2956 0.9953 0.8657 -0.0914 0.2401 0.1192 74 SER H CB 2189 O OG . SER B 75 ? 1.2206 0.9738 0.9073 -0.1127 0.2353 0.1143 74 SER H OG 2190 N N . THR B 76 ? 1.2054 0.8629 0.8505 -0.0856 0.1179 0.0753 75 THR H N 2191 C CA . THR B 76 ? 1.1732 0.8047 0.8556 -0.0949 0.0730 0.0763 75 THR H CA 2192 C C . THR B 76 ? 1.1237 0.7580 0.8260 -0.0793 0.0378 0.0507 75 THR H C 2193 O O . THR B 76 ? 1.1321 0.7516 0.8701 -0.0829 0.0019 0.0499 75 THR H O 2194 C CB . THR B 76 ? 1.0779 0.7466 0.8553 -0.1173 0.0804 0.0792 75 THR H CB 2195 O OG1 . THR B 76 ? 0.9940 0.7302 0.8395 -0.1146 0.0945 0.0548 75 THR H OG1 2196 C CG2 . THR B 76 ? 1.1255 0.7902 0.8947 -0.1380 0.1137 0.1082 75 THR H CG2 2197 N N . SER B 77 ? 1.0870 0.7403 0.7696 -0.0614 0.0500 0.0318 76 SER H N 2198 C CA . SER B 77 ? 1.0604 0.7207 0.7679 -0.0486 0.0219 0.0099 76 SER H CA 2199 C C . SER B 77 ? 0.9161 0.6238 0.7221 -0.0585 0.0128 0.0021 76 SER H C 2200 O O . SER B 77 ? 0.8977 0.5923 0.7315 -0.0597 -0.0210 0.0001 76 SER H O 2201 C CB . SER B 77 ? 1.1589 0.7545 0.8105 -0.0428 -0.0237 0.0117 76 SER H CB 2202 O OG . SER B 77 ? 1.2746 0.8242 0.8248 -0.0291 -0.0182 0.0100 76 SER H OG 2203 N N . THR B 78 ? 0.8192 0.5837 0.6776 -0.0651 0.0436 -0.0025 77 THR H N 2204 C CA . THR B 78 ? 0.6865 0.4959 0.6268 -0.0736 0.0378 -0.0134 77 THR H CA 2205 C C . THR B 78 ? 0.6203 0.4898 0.5957 -0.0649 0.0566 -0.0288 77 THR H C 2206 O O . THR B 78 ? 0.7224 0.6255 0.7044 -0.0668 0.0869 -0.0265 77 THR H O 2207 C CB . THR B 78 ? 0.6894 0.5051 0.6677 -0.0958 0.0476 -0.0038 77 THR H CB 2208 O OG1 . THR B 78 ? 0.8128 0.5687 0.7556 -0.1019 0.0303 0.0151 77 THR H OG1 2209 C CG2 . THR B 78 ? 0.6372 0.4877 0.6879 -0.1021 0.0372 -0.0202 77 THR H CG2 2210 N N . ALA B 79 ? 0.5113 0.3965 0.5124 -0.0550 0.0383 -0.0415 78 ALA H N 2211 C CA . ALA B 79 ? 0.4704 0.4102 0.5052 -0.0455 0.0503 -0.0532 78 ALA H CA 2212 C C . ALA B 79 ? 0.4838 0.4717 0.5824 -0.0592 0.0511 -0.0612 78 ALA H C 2213 O O . ALA B 79 ? 0.5208 0.4939 0.6384 -0.0710 0.0380 -0.0620 78 ALA H O 2214 C CB . ALA B 79 ? 0.4832 0.4109 0.5069 -0.0283 0.0310 -0.0592 78 ALA H CB 2215 N N . TYR B 80 ? 0.4650 0.5088 0.5957 -0.0562 0.0650 -0.0681 79 TYR H N 2216 C CA . TYR B 80 ? 0.3999 0.4889 0.5834 -0.0696 0.0625 -0.0788 79 TYR H CA 2217 C C . TYR B 80 ? 0.3738 0.5107 0.5791 -0.0559 0.0577 -0.0873 79 TYR H C 2218 O O . TYR B 80 ? 0.4482 0.5978 0.6424 -0.0382 0.0655 -0.0833 79 TYR H O 2219 C CB . TYR B 80 ? 0.4257 0.5409 0.6365 -0.0889 0.0813 -0.0754 79 TYR H CB 2220 C CG . TYR B 80 ? 0.4817 0.5491 0.6732 -0.1055 0.0865 -0.0626 79 TYR H CG 2221 C CD1 . TYR B 80 ? 0.4509 0.4967 0.6641 -0.1236 0.0737 -0.0672 79 TYR H CD1 2222 C CD2 . TYR B 80 ? 0.5074 0.5481 0.6551 -0.1013 0.1049 -0.0454 79 TYR H CD2 2223 C CE1 . TYR B 80 ? 0.5004 0.4983 0.6974 -0.1379 0.0764 -0.0517 79 TYR H CE1 2224 C CE2 . TYR B 80 ? 0.5411 0.5360 0.6651 -0.1165 0.1089 -0.0290 79 TYR H CE2 2225 C CZ . TYR B 80 ? 0.5643 0.5377 0.7160 -0.1353 0.0934 -0.0305 79 TYR H CZ 2226 O OH . TYR B 80 ? 0.6594 0.5830 0.7888 -0.1496 0.0953 -0.0106 79 TYR H OH 2227 N N . MET B 81 ? 0.3108 0.4707 0.5430 -0.0623 0.0452 -0.0989 80 MET H N 2228 C CA . MET B 81 ? 0.3406 0.5469 0.5891 -0.0513 0.0387 -0.1046 80 MET H CA 2229 C C . MET B 81 ? 0.3696 0.6184 0.6526 -0.0675 0.0343 -0.1192 80 MET H C 2230 O O . MET B 81 ? 0.4609 0.6976 0.7467 -0.0772 0.0255 -0.1318 80 MET H O 2231 C CB . MET B 81 ? 0.4344 0.6229 0.6679 -0.0398 0.0254 -0.1032 80 MET H CB 2232 C CG . MET B 81 ? 0.4269 0.6534 0.6650 -0.0249 0.0197 -0.1007 80 MET H CG 2233 S SD . MET B 81 ? 0.6264 0.9073 0.8854 -0.0327 0.0117 -0.1161 80 MET H SD 2234 C CE . MET B 81 ? 0.2242 0.4744 0.4777 -0.0428 0.0094 -0.1284 80 MET H CE 2235 N N . GLU B 82 ? 0.3277 0.6260 0.6387 -0.0695 0.0392 -0.1189 81 GLU H N 2236 C CA . GLU B 82 ? 0.3558 0.6960 0.7018 -0.0875 0.0287 -0.1338 81 GLU H CA 2237 C C . GLU B 82 ? 0.3976 0.7848 0.7479 -0.0743 0.0129 -0.1385 81 GLU H C 2238 O O . GLU B 82 ? 0.4113 0.8303 0.7707 -0.0569 0.0154 -0.1264 81 GLU H O 2239 C CB . GLU B 82 ? 0.3444 0.7154 0.7314 -0.1046 0.0410 -0.1285 81 GLU H CB 2240 C CG . GLU B 82 ? 0.3792 0.7765 0.8050 -0.1327 0.0261 -0.1455 81 GLU H CG 2241 C CD . GLU B 82 ? 0.4662 0.8904 0.9414 -0.1557 0.0397 -0.1360 81 GLU H CD 2242 O OE1 . GLU B 82 ? 0.4832 0.8956 0.9748 -0.1803 0.0275 -0.1430 81 GLU H OE1 2243 O OE2 . GLU B 82 ? 0.5581 1.0029 1.0430 -0.1444 0.0626 -0.1166 81 GLU H OE2 2244 N N . LEU B 83 ? 0.3638 0.7525 0.7039 -0.0806 -0.0029 -0.1557 82 LEU H N 2245 C CA . LEU B 83 ? 0.3214 0.7506 0.6536 -0.0694 -0.0198 -0.1595 82 LEU H CA 2246 C C . LEU B 83 ? 0.3426 0.8065 0.6954 -0.0896 -0.0393 -0.1816 82 LEU H C 2247 O O . LEU B 83 ? 0.2803 0.7173 0.6244 -0.1057 -0.0440 -0.2032 82 LEU H O 2248 C CB . LEU B 83 ? 0.2973 0.6990 0.5876 -0.0559 -0.0205 -0.1598 82 LEU H CB 2249 C CG . LEU B 83 ? 0.2953 0.7316 0.5645 -0.0406 -0.0336 -0.1550 82 LEU H CG 2250 C CD1 . LEU B 83 ? 0.3001 0.7607 0.5816 -0.0222 -0.0344 -0.1310 82 LEU H CD1 2251 C CD2 . LEU B 83 ? 0.2589 0.6681 0.4915 -0.0304 -0.0270 -0.1521 82 LEU H CD2 2252 N N . SER B 84 A 0.3355 0.8575 0.7173 -0.0881 -0.0530 -0.1770 82 SER H N 2253 C CA . SER B 84 A 0.3640 0.9074 0.7603 -0.1071 -0.0758 -0.1918 82 SER H CA 2254 C C . SER B 84 A 0.3933 0.9699 0.7607 -0.0963 -0.1023 -0.1997 82 SER H C 2255 O O . SER B 84 A 0.3014 0.8913 0.6439 -0.0733 -0.1012 -0.1884 82 SER H O 2256 C CB . SER B 84 A 0.2958 0.8707 0.7464 -0.1154 -0.0735 -0.1742 82 SER H CB 2257 O OG . SER B 84 A 0.4009 1.0121 0.8666 -0.0902 -0.0678 -0.1513 82 SER H OG 2258 N N . SER B 85 B 0.3588 0.9456 0.7271 -0.1135 -0.1274 -0.2172 82 SER H N 2259 C CA . SER B 85 B 0.4666 1.0803 0.7972 -0.1062 -0.1565 -0.2275 82 SER H CA 2260 C C . SER B 85 B 0.4002 0.9969 0.6683 -0.0917 -0.1505 -0.2408 82 SER H C 2261 O O . SER B 85 B 0.4084 1.0293 0.6415 -0.0710 -0.1583 -0.2275 82 SER H O 2262 C CB . SER B 85 B 0.4855 1.1510 0.8380 -0.0878 -0.1693 -0.1993 82 SER H CB 2263 O OG . SER B 85 B 0.5768 1.2647 0.8838 -0.0786 -0.1983 -0.2044 82 SER H OG 2264 N N . LEU B 86 C 0.5624 1.1102 0.8156 -0.1009 -0.1337 -0.2613 82 LEU H N 2265 C CA . LEU B 86 C 0.4141 0.9237 0.6093 -0.0833 -0.1149 -0.2635 82 LEU H CA 2266 C C . LEU B 86 C 0.5646 1.0892 0.6956 -0.0743 -0.1323 -0.2795 82 LEU H C 2267 O O . LEU B 86 C 0.5230 1.0540 0.6391 -0.0895 -0.1582 -0.3116 82 LEU H O 2268 C CB . LEU B 86 C 0.4659 0.9187 0.6641 -0.0943 -0.0971 -0.2841 82 LEU H CB 2269 C CG . LEU B 86 C 0.3693 0.7953 0.6103 -0.0977 -0.0751 -0.2633 82 LEU H CG 2270 C CD1 . LEU B 86 C 0.3852 0.7575 0.6347 -0.1122 -0.0665 -0.2843 82 LEU H CD1 2271 C CD2 . LEU B 86 C 0.3364 0.7531 0.5618 -0.0739 -0.0547 -0.2332 82 LEU H CD2 2272 N N . ARG B 87 ? 0.4722 1.0002 0.5627 -0.0504 -0.1185 -0.2560 83 ARG H N 2273 C CA . ARG B 87 ? 0.5339 1.0730 0.5518 -0.0382 -0.1267 -0.2643 83 ARG H CA 2274 C C . ARG B 87 ? 0.5900 1.0905 0.5697 -0.0258 -0.0923 -0.2694 83 ARG H C 2275 O O . ARG B 87 ? 0.5013 0.9727 0.5166 -0.0249 -0.0672 -0.2590 83 ARG H O 2276 C CB . ARG B 87 ? 0.6071 1.1859 0.6104 -0.0205 -0.1378 -0.2268 83 ARG H CB 2277 C CG . ARG B 87 ? 0.6255 1.2451 0.6882 -0.0263 -0.1637 -0.2124 83 ARG H CG 2278 C CD . ARG B 87 ? 0.6461 1.2848 0.7169 -0.0036 -0.1602 -0.1671 83 ARG H CD 2279 N NE . ARG B 87 ? 0.6485 1.3250 0.7859 -0.0040 -0.1777 -0.1534 83 ARG H NE 2280 C CZ . ARG B 87 ? 0.6932 1.3872 0.8501 0.0171 -0.1790 -0.1176 83 ARG H CZ 2281 N NH1 . ARG B 87 ? 0.7502 1.4238 0.8650 0.0365 -0.1665 -0.0900 83 ARG H NH1 2282 N NH2 . ARG B 87 ? 0.6733 1.4050 0.8958 0.0193 -0.1914 -0.1086 83 ARG H NH2 2283 N N . SER B 88 ? 0.4129 0.6156 0.6844 0.0465 -0.1843 -0.1824 84 SER H N 2284 C CA . SER B 88 ? 0.5080 0.6754 0.7321 0.0364 -0.1691 -0.1496 84 SER H CA 2285 C C . SER B 88 ? 0.5583 0.7000 0.7421 0.0352 -0.1603 -0.1305 84 SER H C 2286 O O . SER B 88 ? 0.5747 0.7074 0.7399 0.0189 -0.1394 -0.1066 84 SER H O 2287 C CB . SER B 88 ? 0.5528 0.6799 0.7375 0.0534 -0.1871 -0.1484 84 SER H CB 2288 O OG . SER B 88 ? 0.7047 0.7942 0.8499 0.0819 -0.2133 -0.1599 84 SER H OG 2289 N N . GLU B 89 ? 0.5773 0.7087 0.7497 0.0531 -0.1770 -0.1437 85 GLU H N 2290 C CA . GLU B 89 ? 0.5407 0.6470 0.6762 0.0523 -0.1694 -0.1290 85 GLU H CA 2291 C C . GLU B 89 ? 0.4590 0.6046 0.6303 0.0309 -0.1466 -0.1218 85 GLU H C 2292 O O . GLU B 89 ? 0.4673 0.5992 0.6157 0.0275 -0.1383 -0.1104 85 GLU H O 2293 C CB . GLU B 89 ? 0.6859 0.7659 0.7951 0.0800 -0.1956 -0.1469 85 GLU H CB 2294 C CG . GLU B 89 ? 0.8767 0.9052 0.9366 0.1068 -0.2213 -0.1551 85 GLU H CG 2295 C CD . GLU B 89 ? 0.9305 0.9890 1.0335 0.1207 -0.2434 -0.1830 85 GLU H CD 2296 O OE1 . GLU B 89 ? 0.9621 0.9878 1.0351 0.1342 -0.2571 -0.1844 85 GLU H OE1 2297 O OE2 . GLU B 89 ? 0.8909 1.0056 1.0586 0.1175 -0.2461 -0.2053 85 GLU H OE2 2298 N N . ASP B 90 ? 0.4274 0.6176 0.6511 0.0166 -0.1358 -0.1296 86 ASP H N 2299 C CA . ASP B 90 ? 0.4223 0.6425 0.6729 -0.0031 -0.1127 -0.1225 86 ASP H CA 2300 C C . ASP B 90 ? 0.4332 0.6478 0.6708 -0.0217 -0.0908 -0.0984 86 ASP H C 2301 O O . ASP B 90 ? 0.3314 0.5621 0.5805 -0.0362 -0.0720 -0.0900 86 ASP H O 2302 C CB . ASP B 90 ? 0.3623 0.6275 0.6716 -0.0098 -0.1089 -0.1461 86 ASP H CB 2303 C CG . ASP B 90 ? 0.3684 0.6481 0.6990 0.0093 -0.1307 -0.1748 86 ASP H CG 2304 O OD1 . ASP B 90 ? 0.3851 0.6409 0.6829 0.0246 -0.1438 -0.1719 86 ASP H OD1 2305 O OD2 . ASP B 90 ? 0.4264 0.7411 0.8069 0.0089 -0.1345 -0.2023 86 ASP H OD2 2306 N N . THR B 91 ? 0.3190 0.5089 0.5303 -0.0191 -0.0946 -0.0890 87 THR H N 2307 C CA . THR B 91 ? 0.3293 0.5122 0.5253 -0.0329 -0.0773 -0.0685 87 THR H CA 2308 C C . THR B 91 ? 0.4076 0.5780 0.5784 -0.0368 -0.0676 -0.0544 87 THR H C 2309 O O . THR B 91 ? 0.4304 0.5702 0.5667 -0.0290 -0.0737 -0.0507 87 THR H O 2310 C CB . THR B 91 ? 0.4203 0.5776 0.5913 -0.0278 -0.0839 -0.0628 87 THR H CB 2311 O OG1 . THR B 91 ? 0.3791 0.5509 0.5773 -0.0258 -0.0919 -0.0766 87 THR H OG1 2312 C CG2 . THR B 91 ? 0.3139 0.4657 0.4693 -0.0402 -0.0671 -0.0440 87 THR H CG2 2313 N N . ALA B 92 ? 0.3368 0.5271 0.5219 -0.0490 -0.0517 -0.0480 88 ALA H N 2314 C CA . ALA B 92 ? 0.3584 0.5444 0.5287 -0.0523 -0.0437 -0.0394 88 ALA H CA 2315 C C . ALA B 92 ? 0.3583 0.5631 0.5408 -0.0632 -0.0281 -0.0329 88 ALA H C 2316 O O . ALA B 92 ? 0.3564 0.5739 0.5562 -0.0685 -0.0219 -0.0354 88 ALA H O 2317 C CB . ALA B 92 ? 0.4154 0.6014 0.5875 -0.0443 -0.0522 -0.0486 88 ALA H CB 2318 N N . VAL B 93 ? 0.3500 0.5526 0.5203 -0.0658 -0.0215 -0.0260 89 VAL H N 2319 C CA . VAL B 93 ? 0.3563 0.5728 0.5331 -0.0713 -0.0103 -0.0223 89 VAL H CA 2320 C C . VAL B 93 ? 0.3693 0.5969 0.5584 -0.0704 -0.0092 -0.0280 89 VAL H C 2321 O O . VAL B 93 ? 0.3576 0.5800 0.5408 -0.0663 -0.0151 -0.0303 89 VAL H O 2322 C CB . VAL B 93 ? 0.3103 0.5232 0.4722 -0.0728 -0.0054 -0.0162 89 VAL H CB 2323 C CG1 . VAL B 93 ? 0.2626 0.4857 0.4263 -0.0735 0.0021 -0.0145 89 VAL H CG1 2324 C CG2 . VAL B 93 ? 0.2649 0.4681 0.4159 -0.0734 -0.0059 -0.0126 89 VAL H CG2 2325 N N . TYR B 94 ? 0.3414 0.5801 0.5437 -0.0746 -0.0003 -0.0305 90 TYR H N 2326 C CA . TYR B 94 ? 0.3429 0.5929 0.5583 -0.0747 0.0030 -0.0371 90 TYR H CA 2327 C C . TYR B 94 ? 0.3558 0.6044 0.5589 -0.0760 0.0129 -0.0306 90 TYR H C 2328 O O . TYR B 94 ? 0.4146 0.6560 0.6068 -0.0788 0.0223 -0.0260 90 TYR H O 2329 C CB . TYR B 94 ? 0.2895 0.5519 0.5303 -0.0796 0.0087 -0.0491 90 TYR H CB 2330 C CG . TYR B 94 ? 0.3176 0.5857 0.5753 -0.0740 -0.0057 -0.0613 90 TYR H CG 2331 C CD1 . TYR B 94 ? 0.3509 0.6107 0.6047 -0.0734 -0.0113 -0.0599 90 TYR H CD1 2332 C CD2 . TYR B 94 ? 0.3143 0.5943 0.5894 -0.0666 -0.0158 -0.0757 90 TYR H CD2 2333 C CE1 . TYR B 94 ? 0.3538 0.6154 0.6192 -0.0650 -0.0272 -0.0726 90 TYR H CE1 2334 C CE2 . TYR B 94 ? 0.3204 0.6027 0.6072 -0.0568 -0.0331 -0.0899 90 TYR H CE2 2335 C CZ . TYR B 94 ? 0.3585 0.6307 0.6396 -0.0556 -0.0390 -0.0883 90 TYR H CZ 2336 O OH . TYR B 94 ? 0.2687 0.5402 0.5580 -0.0428 -0.0586 -0.1040 90 TYR H OH 2337 N N . TYR B 95 ? 0.2855 0.5372 0.4865 -0.0723 0.0095 -0.0312 91 TYR H N 2338 C CA . TYR B 95 ? 0.2730 0.5236 0.4626 -0.0710 0.0158 -0.0273 91 TYR H CA 2339 C C . TYR B 95 ? 0.3022 0.5596 0.5010 -0.0714 0.0222 -0.0327 91 TYR H C 2340 O O . TYR B 95 ? 0.2799 0.5469 0.4954 -0.0705 0.0173 -0.0406 91 TYR H O 2341 C CB . TYR B 95 ? 0.2760 0.5251 0.4564 -0.0676 0.0090 -0.0254 91 TYR H CB 2342 C CG . TYR B 95 ? 0.3776 0.6209 0.5499 -0.0687 0.0060 -0.0226 91 TYR H CG 2343 C CD1 . TYR B 95 ? 0.3863 0.6296 0.5500 -0.0668 0.0083 -0.0208 91 TYR H CD1 2344 C CD2 . TYR B 95 ? 0.3673 0.6022 0.5372 -0.0701 0.0005 -0.0233 91 TYR H CD2 2345 C CE1 . TYR B 95 ? 0.4095 0.6510 0.5695 -0.0680 0.0064 -0.0210 91 TYR H CE1 2346 C CE2 . TYR B 95 ? 0.3629 0.5905 0.5241 -0.0725 0.0008 -0.0216 91 TYR H CE2 2347 C CZ . TYR B 95 ? 0.4016 0.6359 0.5615 -0.0723 0.0043 -0.0210 91 TYR H CZ 2348 O OH . TYR B 95 ? 0.4306 0.6613 0.5857 -0.0748 0.0053 -0.0219 91 TYR H OH 2349 N N . CYS B 96 ? 0.2580 0.5075 0.4428 -0.0712 0.0326 -0.0297 92 CYS H N 2350 C CA . CYS B 96 ? 0.2637 0.5158 0.4503 -0.0704 0.0393 -0.0335 92 CYS H CA 2351 C C . CYS B 96 ? 0.3614 0.6105 0.5325 -0.0624 0.0328 -0.0296 92 CYS H C 2352 O O . CYS B 96 ? 0.2861 0.5296 0.4437 -0.0582 0.0277 -0.0258 92 CYS H O 2353 C CB . CYS B 96 ? 0.3081 0.5460 0.4840 -0.0759 0.0584 -0.0345 92 CYS H CB 2354 S SG . CYS B 96 ? 0.5676 0.7727 0.6978 -0.0692 0.0644 -0.0250 92 CYS H SG 2355 N N . ALA B 97 ? 0.3148 0.5701 0.4910 -0.0599 0.0322 -0.0331 93 ALA H N 2356 C CA . ALA B 97 ? 0.3077 0.5622 0.4730 -0.0528 0.0255 -0.0319 93 ALA H CA 2357 C C . ALA B 97 ? 0.3277 0.5823 0.4912 -0.0497 0.0304 -0.0348 93 ALA H C 2358 O O . ALA B 97 ? 0.3416 0.6047 0.5212 -0.0533 0.0343 -0.0399 93 ALA H O 2359 C CB . ALA B 97 ? 0.2820 0.5438 0.4558 -0.0535 0.0140 -0.0334 93 ALA H CB 2360 N N . ARG B 98 ? 0.3678 0.6139 0.5127 -0.0417 0.0290 -0.0335 94 ARG H N 2361 C CA . ARG B 98 ? 0.3627 0.6053 0.5010 -0.0372 0.0333 -0.0356 94 ARG H CA 2362 C C . ARG B 98 ? 0.4066 0.6626 0.5576 -0.0353 0.0223 -0.0391 94 ARG H C 2363 O O . ARG B 98 ? 0.4108 0.6712 0.5633 -0.0341 0.0125 -0.0401 94 ARG H O 2364 C CB . ARG B 98 ? 0.3203 0.5412 0.4260 -0.0263 0.0352 -0.0337 94 ARG H CB 2365 C CG . ARG B 98 ? 0.3689 0.5786 0.4604 -0.0214 0.0428 -0.0350 94 ARG H CG 2366 C CD . ARG B 98 ? 0.4626 0.6453 0.5149 -0.0059 0.0403 -0.0344 94 ARG H CD 2367 N NE . ARG B 98 ? 0.4966 0.6928 0.5545 0.0042 0.0214 -0.0397 94 ARG H NE 2368 C CZ . ARG B 98 ? 0.4973 0.6776 0.5285 0.0212 0.0127 -0.0441 94 ARG H CZ 2369 N NH1 . ARG B 98 ? 0.4674 0.6099 0.4550 0.0316 0.0212 -0.0413 94 ARG H NH1 2370 N NH2 . ARG B 98 ? 0.3683 0.5674 0.4139 0.0281 -0.0039 -0.0533 94 ARG H NH2 2371 N N . VAL B 99 ? 0.3817 0.6431 0.5413 -0.0356 0.0255 -0.0426 95 VAL H N 2372 C CA . VAL B 99 ? 0.3716 0.6397 0.5363 -0.0321 0.0156 -0.0457 95 VAL H CA 2373 C C . VAL B 99 ? 0.3713 0.6319 0.5189 -0.0237 0.0145 -0.0455 95 VAL H C 2374 O O . VAL B 99 ? 0.3728 0.6289 0.5138 -0.0197 0.0209 -0.0466 95 VAL H O 2375 C CB . VAL B 99 ? 0.4074 0.6852 0.5882 -0.0328 0.0165 -0.0520 95 VAL H CB 2376 C CG1 . VAL B 99 ? 0.3174 0.5959 0.4971 -0.0282 0.0046 -0.0548 95 VAL H CG1 2377 C CG2 . VAL B 99 ? 0.2596 0.5454 0.4582 -0.0381 0.0160 -0.0560 95 VAL H CG2 2378 N N . GLY B 100 ? 0.4085 0.6683 0.5501 -0.0205 0.0064 -0.0465 96 GLY H N 2379 C CA . GLY B 100 ? 0.3719 0.6255 0.4982 -0.0097 0.0020 -0.0497 96 GLY H CA 2380 C C . GLY B 100 ? 0.3623 0.6209 0.4927 -0.0071 -0.0042 -0.0542 96 GLY H C 2381 O O . GLY B 100 ? 0.4234 0.6750 0.5399 0.0031 -0.0059 -0.0563 96 GLY H O 2382 N N . TYR B 101 ? 0.3485 0.6143 0.4928 -0.0153 -0.0077 -0.0557 97 TYR H N 2383 C CA . TYR B 101 ? 0.3729 0.6389 0.5175 -0.0140 -0.0134 -0.0601 97 TYR H CA 2384 C C . TYR B 101 ? 0.4316 0.6958 0.5796 -0.0165 -0.0134 -0.0586 97 TYR H C 2385 O O . TYR B 101 ? 0.5232 0.7846 0.6750 -0.0226 -0.0146 -0.0579 97 TYR H O 2386 C CB . TYR B 101 ? 0.3107 0.5791 0.4611 -0.0205 -0.0180 -0.0674 97 TYR H CB 2387 C CG . TYR B 101 ? 0.2989 0.5752 0.4526 -0.0165 -0.0209 -0.0745 97 TYR H CG 2388 C CD1 . TYR B 101 ? 0.3052 0.5849 0.4558 -0.0056 -0.0277 -0.0832 97 TYR H CD1 2389 C CD2 . TYR B 101 ? 0.3295 0.6099 0.4891 -0.0212 -0.0188 -0.0746 97 TYR H CD2 2390 C CE1 . TYR B 101 ? 0.3049 0.5927 0.4588 0.0022 -0.0341 -0.0940 97 TYR H CE1 2391 C CE2 . TYR B 101 ? 0.3451 0.6342 0.5084 -0.0147 -0.0238 -0.0843 97 TYR H CE2 2392 C CZ . TYR B 101 ? 0.3164 0.6096 0.4772 -0.0021 -0.0323 -0.0950 97 TYR H CZ 2393 O OH . TYR B 101 ? 0.3840 0.6868 0.5488 0.0083 -0.0410 -0.1087 97 TYR H OH 2394 N N . CYS B 102 ? 0.4202 0.6843 0.5648 -0.0097 -0.0133 -0.0596 98 CYS H N 2395 C CA . CYS B 102 ? 0.4086 0.6734 0.5576 -0.0084 -0.0158 -0.0620 98 CYS H CA 2396 C C . CYS B 102 ? 0.3795 0.6323 0.5205 -0.0109 -0.0249 -0.0645 98 CYS H C 2397 O O . CYS B 102 ? 0.4188 0.6647 0.5519 -0.0130 -0.0271 -0.0662 98 CYS H O 2398 C CB . CYS B 102 ? 0.3972 0.6646 0.5438 -0.0003 -0.0132 -0.0643 98 CYS H CB 2399 S SG . CYS B 102 ? 0.9118 1.1816 1.0588 0.0009 0.0033 -0.0628 98 CYS H SG 2400 N N . SER B 103 ? 0.3678 0.6150 0.5084 -0.0099 -0.0298 -0.0667 99 SER H N 2401 C CA . SER B 103 ? 0.3698 0.5937 0.4904 -0.0095 -0.0380 -0.0692 99 SER H CA 2402 C C . SER B 103 ? 0.3360 0.5565 0.4492 -0.0001 -0.0442 -0.0735 99 SER H C 2403 O O . SER B 103 ? 0.3646 0.6021 0.4895 0.0045 -0.0409 -0.0741 99 SER H O 2404 C CB . SER B 103 ? 0.3962 0.6080 0.5106 -0.0070 -0.0444 -0.0715 99 SER H CB 2405 O OG . SER B 103 ? 0.4164 0.6437 0.5459 0.0035 -0.0501 -0.0786 99 SER H OG 2406 N N . SER B 104 ? 0.3640 0.5577 0.4528 0.0032 -0.0526 -0.0765 100 SER H N 2407 C CA . SER B 104 ? 0.4450 0.6316 0.5226 0.0129 -0.0598 -0.0809 100 SER H CA 2408 C C . SER B 104 ? 0.5171 0.7198 0.6081 0.0271 -0.0678 -0.0888 100 SER H C 2409 O O . SER B 104 ? 0.5769 0.7834 0.6669 0.0362 -0.0723 -0.0936 100 SER H O 2410 C CB . SER B 104 ? 0.4293 0.5736 0.4684 0.0120 -0.0651 -0.0822 100 SER H CB 2411 O OG . SER B 104 ? 0.4804 0.6008 0.4986 0.0209 -0.0753 -0.0859 100 SER H OG 2412 N N . THR B 105 A 0.5254 0.7398 0.6319 0.0288 -0.0692 -0.0927 100 THR H N 2413 C CA . THR B 105 A 0.4855 0.7199 0.6119 0.0417 -0.0771 -0.1063 100 THR H CA 2414 C C . THR B 105 A 0.4309 0.7030 0.5963 0.0363 -0.0631 -0.1097 100 THR H C 2415 O O . THR B 105 A 0.4718 0.7659 0.6588 0.0436 -0.0631 -0.1226 100 THR H O 2416 C CB . THR B 105 A 0.4581 0.6777 0.5747 0.0512 -0.0918 -0.1150 100 THR H CB 2417 O OG1 . THR B 105 A 0.4834 0.7032 0.6056 0.0401 -0.0845 -0.1080 100 THR H OG1 2418 C CG2 . THR B 105 A 0.4774 0.6492 0.5450 0.0601 -0.1055 -0.1144 100 THR H CG2 2419 N N . SER B 106 B 0.3746 0.6516 0.5469 0.0234 -0.0499 -0.0998 100 SER H N 2420 C CA . SER B 106 B 0.3816 0.6834 0.5806 0.0168 -0.0334 -0.1018 100 SER H CA 2421 C C . SER B 106 B 0.4020 0.6980 0.5941 0.0055 -0.0210 -0.0882 100 SER H C 2422 O O . SER B 106 B 0.4259 0.7056 0.5995 0.0025 -0.0252 -0.0793 100 SER H O 2423 C CB . SER B 106 B 0.4091 0.7307 0.6363 0.0182 -0.0347 -0.1163 100 SER H CB 2424 O OG . SER B 106 B 0.4428 0.7542 0.6644 0.0152 -0.0410 -0.1123 100 SER H OG 2425 N N . CYS B 107 C 0.3462 0.6539 0.5521 -0.0007 -0.0047 -0.0889 100 CYS H N 2426 C CA . CYS B 107 C 0.3070 0.6055 0.5015 -0.0080 0.0060 -0.0777 100 CYS H CA 2427 C C . CYS B 107 C 0.3643 0.6684 0.5720 -0.0161 0.0127 -0.0783 100 CYS H C 2428 O O . CYS B 107 C 0.4335 0.7281 0.6300 -0.0210 0.0198 -0.0697 100 CYS H O 2429 C CB . CYS B 107 C 0.2984 0.5912 0.4820 -0.0071 0.0210 -0.0755 100 CYS H CB 2430 S SG . CYS B 107 C 0.4566 0.7394 0.6202 0.0032 0.0125 -0.0729 100 CYS H SG 2431 N N . ASN B 108 D 0.3634 0.6830 0.5949 -0.0159 0.0092 -0.0904 100 ASN H N 2432 C CA . ASN B 108 D 0.3537 0.6788 0.5989 -0.0227 0.0119 -0.0925 100 ASN H CA 2433 C C . ASN B 108 D 0.3649 0.6797 0.6004 -0.0187 -0.0063 -0.0890 100 ASN H C 2434 O O . ASN B 108 D 0.3360 0.6511 0.5774 -0.0225 -0.0077 -0.0890 100 ASN H O 2435 C CB . ASN B 108 D 0.3407 0.6898 0.6205 -0.0248 0.0186 -0.1117 100 ASN H CB 2436 C CG . ASN B 108 D 0.3731 0.7362 0.6678 -0.0124 0.0026 -0.1278 100 ASN H CG 2437 O OD1 . ASN B 108 D 0.4599 0.8126 0.7360 -0.0037 -0.0075 -0.1234 100 ASN H OD1 2438 N ND2 . ASN B 108 D 0.3880 0.7748 0.7166 -0.0103 -0.0009 -0.1489 100 ASN H ND2 2439 N N . ARG B 109 E 0.3586 0.6602 0.5754 -0.0115 -0.0187 -0.0864 100 ARG H N 2440 C CA . ARG B 109 E 0.3494 0.6294 0.5446 -0.0105 -0.0303 -0.0807 100 ARG H CA 2441 C C . ARG B 109 E 0.4344 0.7011 0.6098 -0.0152 -0.0265 -0.0700 100 ARG H C 2442 O O . ARG B 109 E 0.4471 0.7150 0.6183 -0.0121 -0.0251 -0.0700 100 ARG H O 2443 C CB . ARG B 109 E 0.3464 0.6140 0.5305 0.0018 -0.0474 -0.0901 100 ARG H CB 2444 C CG . ARG B 109 E 0.4316 0.7094 0.6331 0.0097 -0.0572 -0.1043 100 ARG H CG 2445 C CD . ARG B 109 E 0.4785 0.7322 0.6556 0.0260 -0.0782 -0.1132 100 ARG H CD 2446 N NE . ARG B 109 E 0.5307 0.7835 0.7011 0.0342 -0.0827 -0.1177 100 ARG H NE 2447 C CZ . ARG B 109 E 0.4750 0.7549 0.6727 0.0433 -0.0864 -0.1340 100 ARG H CZ 2448 N NH1 . ARG B 109 E 0.4527 0.7640 0.6889 0.0438 -0.0847 -0.1493 100 ARG H NH1 2449 N NH2 . ARG B 109 E 0.4236 0.7003 0.6120 0.0511 -0.0907 -0.1371 100 ARG H NH2 2450 N N . GLY B 110 F 0.4100 0.6659 0.5757 -0.0223 -0.0250 -0.0634 100 GLY H N 2451 C CA . GLY B 110 F 0.2794 0.5289 0.4343 -0.0273 -0.0213 -0.0586 100 GLY H CA 2452 C C . GLY B 110 F 0.3723 0.6200 0.5272 -0.0354 -0.0168 -0.0545 100 GLY H C 2453 O O . GLY B 110 F 0.4001 0.6492 0.5605 -0.0371 -0.0163 -0.0532 100 GLY H O 2454 N N . ALA B 111 G 0.3278 0.5746 0.4790 -0.0398 -0.0141 -0.0549 100 ALA H N 2455 C CA . ALA B 111 G 0.3322 0.5801 0.4859 -0.0470 -0.0101 -0.0545 100 ALA H CA 2456 C C . ALA B 111 G 0.3064 0.5673 0.4687 -0.0439 -0.0069 -0.0511 100 ALA H C 2457 O O . ALA B 111 G 0.3022 0.5688 0.4642 -0.0371 -0.0055 -0.0505 100 ALA H O 2458 C CB . ALA B 111 G 0.2926 0.5413 0.4465 -0.0520 -0.0083 -0.0617 100 ALA H CB 2459 N N . PHE B 112 H 0.2558 0.5156 0.4202 -0.0486 -0.0049 -0.0487 100 PHE H N 2460 C CA . PHE B 112 H 0.2511 0.5171 0.4181 -0.0463 -0.0014 -0.0452 100 PHE H CA 2461 C C . PHE B 112 H 0.2737 0.5451 0.4396 -0.0439 -0.0023 -0.0497 100 PHE H C 2462 O O . PHE B 112 H 0.3401 0.6135 0.5105 -0.0497 -0.0023 -0.0533 100 PHE H O 2463 C CB . PHE B 112 H 0.2675 0.5301 0.4376 -0.0511 -0.0002 -0.0416 100 PHE H CB 2464 C CG . PHE B 112 H 0.2863 0.5455 0.4602 -0.0504 -0.0033 -0.0424 100 PHE H CG 2465 C CD1 . PHE B 112 H 0.3371 0.5877 0.5092 -0.0527 -0.0071 -0.0424 100 PHE H CD1 2466 C CD2 . PHE B 112 H 0.3624 0.6267 0.5408 -0.0456 -0.0037 -0.0454 100 PHE H CD2 2467 C CE1 . PHE B 112 H 0.4069 0.6542 0.5817 -0.0479 -0.0140 -0.0470 100 PHE H CE1 2468 C CE2 . PHE B 112 H 0.4133 0.6782 0.5985 -0.0423 -0.0092 -0.0507 100 PHE H CE2 2469 C CZ . PHE B 112 H 0.3547 0.6113 0.5382 -0.0423 -0.0157 -0.0524 100 PHE H CZ 2470 N N . ASP B 113 ? 0.2939 0.5662 0.4526 -0.0341 -0.0036 -0.0515 101 ASP H N 2471 C CA . ASP B 113 ? 0.3638 0.6420 0.5212 -0.0269 -0.0093 -0.0605 101 ASP H CA 2472 C C . ASP B 113 ? 0.3840 0.6573 0.5315 -0.0210 -0.0094 -0.0587 101 ASP H C 2473 O O . ASP B 113 ? 0.3995 0.6817 0.5528 -0.0180 -0.0149 -0.0680 101 ASP H O 2474 C CB . ASP B 113 ? 0.3926 0.6688 0.5405 -0.0147 -0.0142 -0.0655 101 ASP H CB 2475 C CG . ASP B 113 ? 0.4727 0.7310 0.5975 -0.0059 -0.0091 -0.0571 101 ASP H CG 2476 O OD1 . ASP B 113 ? 0.4526 0.7044 0.5761 -0.0129 0.0001 -0.0483 101 ASP H OD1 2477 O OD2 . ASP B 113 ? 0.4951 0.7438 0.6020 0.0077 -0.0135 -0.0610 101 ASP H OD2 2478 N N . ILE B 114 ? 0.4272 0.6858 0.5601 -0.0198 -0.0026 -0.0489 102 ILE H N 2479 C CA . ILE B 114 ? 0.4221 0.6685 0.5385 -0.0145 -0.0013 -0.0462 102 ILE H CA 2480 C C . ILE B 114 ? 0.4611 0.7058 0.5849 -0.0263 0.0067 -0.0381 102 ILE H C 2481 O O . ILE B 114 ? 0.4664 0.7093 0.5958 -0.0333 0.0144 -0.0335 102 ILE H O 2482 C CB . ILE B 114 ? 0.4149 0.6352 0.4975 -0.0017 0.0024 -0.0436 102 ILE H CB 2483 C CG1 . ILE B 114 ? 0.4044 0.6246 0.4774 0.0134 -0.0086 -0.0532 102 ILE H CG1 2484 C CG2 . ILE B 114 ? 0.4087 0.6075 0.4654 0.0047 0.0040 -0.0409 102 ILE H CG2 2485 C CD1 . ILE B 114 ? 0.4415 0.6275 0.4724 0.0280 -0.0049 -0.0505 102 ILE H CD1 2486 N N . TRP B 115 ? 0.4206 0.6676 0.5465 -0.0276 0.0039 -0.0388 103 TRP H N 2487 C CA . TRP B 115 ? 0.3749 0.6207 0.5083 -0.0378 0.0093 -0.0325 103 TRP H CA 2488 C C . TRP B 115 ? 0.3772 0.6058 0.4902 -0.0337 0.0130 -0.0285 103 TRP H C 2489 O O . TRP B 115 ? 0.3308 0.5508 0.4250 -0.0216 0.0073 -0.0324 103 TRP H O 2490 C CB . TRP B 115 ? 0.3006 0.5593 0.4513 -0.0450 0.0048 -0.0356 103 TRP H CB 2491 C CG . TRP B 115 ? 0.2824 0.5479 0.4452 -0.0510 0.0036 -0.0386 103 TRP H CG 2492 C CD1 . TRP B 115 ? 0.2467 0.5185 0.4125 -0.0486 0.0007 -0.0456 103 TRP H CD1 2493 C CD2 . TRP B 115 ? 0.2789 0.5403 0.4474 -0.0590 0.0043 -0.0359 103 TRP H CD2 2494 N NE1 . TRP B 115 ? 0.3056 0.5752 0.4765 -0.0561 0.0015 -0.0461 103 TRP H NE1 2495 C CE2 . TRP B 115 ? 0.3061 0.5673 0.4759 -0.0611 0.0028 -0.0402 103 TRP H CE2 2496 C CE3 . TRP B 115 ? 0.2563 0.5116 0.4260 -0.0627 0.0047 -0.0315 103 TRP H CE3 2497 C CZ2 . TRP B 115 ? 0.2483 0.4976 0.4141 -0.0655 0.0016 -0.0395 103 TRP H CZ2 2498 C CZ3 . TRP B 115 ? 0.3047 0.5516 0.4737 -0.0655 0.0015 -0.0323 103 TRP H CZ3 2499 C CH2 . TRP B 115 ? 0.3468 0.5880 0.5106 -0.0662 -0.0001 -0.0358 103 TRP H CH2 2500 N N . GLY B 116 ? 0.3969 0.6192 0.5128 -0.0426 0.0217 -0.0230 104 GLY H N 2501 C CA . GLY B 116 ? 0.3074 0.5113 0.4044 -0.0419 0.0267 -0.0192 104 GLY H CA 2502 C C . GLY B 116 ? 0.3904 0.6038 0.4961 -0.0425 0.0185 -0.0198 104 GLY H C 2503 O O . GLY B 116 ? 0.3120 0.5439 0.4384 -0.0463 0.0122 -0.0230 104 GLY H O 2504 N N . GLN B 117 ? 0.3109 0.5078 0.3973 -0.0391 0.0199 -0.0172 105 GLN H N 2505 C CA . GLN B 117 ? 0.3348 0.5398 0.4273 -0.0382 0.0123 -0.0187 105 GLN H CA 2506 C C . GLN B 117 ? 0.4034 0.6172 0.5172 -0.0510 0.0148 -0.0150 105 GLN H C 2507 O O . GLN B 117 ? 0.4888 0.7089 0.6089 -0.0522 0.0100 -0.0158 105 GLN H O 2508 C CB . GLN B 117 ? 0.3417 0.5227 0.4021 -0.0280 0.0113 -0.0175 105 GLN H CB 2509 C CG . GLN B 117 ? 0.4133 0.5726 0.4611 -0.0367 0.0230 -0.0098 105 GLN H CG 2510 C CD . GLN B 117 ? 0.4916 0.6251 0.5177 -0.0397 0.0379 -0.0070 105 GLN H CD 2511 O OE1 . GLN B 117 ? 0.5179 0.6552 0.5462 -0.0379 0.0397 -0.0091 105 GLN H OE1 2512 N NE2 . GLN B 117 ? 0.5448 0.6498 0.5486 -0.0453 0.0505 -0.0032 105 GLN H NE2 2513 N N . GLY B 118 ? 0.3867 0.6006 0.5113 -0.0593 0.0218 -0.0132 106 GLY H N 2514 C CA . GLY B 118 ? 0.3292 0.5504 0.4731 -0.0676 0.0208 -0.0130 106 GLY H CA 2515 C C . GLY B 118 ? 0.3836 0.5932 0.5229 -0.0722 0.0269 -0.0109 106 GLY H C 2516 O O . GLY B 118 ? 0.4320 0.6247 0.5484 -0.0686 0.0305 -0.0078 106 GLY H O 2517 N N . THR B 119 ? 0.3554 0.5722 0.5152 -0.0789 0.0270 -0.0146 107 THR H N 2518 C CA . THR B 119 ? 0.3017 0.5109 0.4637 -0.0851 0.0327 -0.0156 107 THR H CA 2519 C C . THR B 119 ? 0.3826 0.6000 0.5607 -0.0851 0.0214 -0.0183 107 THR H C 2520 O O . THR B 119 ? 0.4388 0.6674 0.6348 -0.0840 0.0142 -0.0250 107 THR H O 2521 C CB . THR B 119 ? 0.3239 0.5331 0.4979 -0.0941 0.0471 -0.0233 107 THR H CB 2522 O OG1 . THR B 119 ? 0.3299 0.5194 0.4769 -0.0938 0.0603 -0.0194 107 THR H OG1 2523 C CG2 . THR B 119 ? 0.2938 0.4993 0.4780 -0.1029 0.0533 -0.0286 107 THR H CG2 2524 N N . MET B 120 ? 0.3643 0.5724 0.5314 -0.0843 0.0185 -0.0137 108 MET H N 2525 C CA . MET B 120 ? 0.3369 0.5464 0.5126 -0.0830 0.0081 -0.0158 108 MET H CA 2526 C C . MET B 120 ? 0.3659 0.5802 0.5627 -0.0884 0.0098 -0.0255 108 MET H C 2527 O O . MET B 120 ? 0.3721 0.5802 0.5677 -0.0957 0.0214 -0.0265 108 MET H O 2528 C CB . MET B 120 ? 0.3135 0.5122 0.4708 -0.0801 0.0051 -0.0085 108 MET H CB 2529 C CG . MET B 120 ? 0.3803 0.5745 0.5392 -0.0775 -0.0051 -0.0095 108 MET H CG 2530 S SD . MET B 120 ? 1.1330 1.3252 1.2901 -0.0728 -0.0136 -0.0122 108 MET H SD 2531 C CE . MET B 120 ? 0.3917 0.5657 0.5381 -0.0677 -0.0245 -0.0133 108 MET H CE 2532 N N . VAL B 121 ? 0.3522 0.5755 0.5669 -0.0843 -0.0018 -0.0350 109 VAL H N 2533 C CA . VAL B 121 ? 0.3309 0.5644 0.5724 -0.0870 -0.0043 -0.0500 109 VAL H CA 2534 C C . VAL B 121 ? 0.3351 0.5613 0.5736 -0.0772 -0.0224 -0.0531 109 VAL H C 2535 O O . VAL B 121 ? 0.3412 0.5601 0.5686 -0.0668 -0.0353 -0.0531 109 VAL H O 2536 C CB . VAL B 121 ? 0.2963 0.5500 0.5669 -0.0875 -0.0039 -0.0662 109 VAL H CB 2537 C CG1 . VAL B 121 ? 0.2712 0.5412 0.5768 -0.0891 -0.0086 -0.0877 109 VAL H CG1 2538 C CG2 . VAL B 121 ? 0.2987 0.5548 0.5686 -0.0975 0.0162 -0.0635 109 VAL H CG2 2539 N N . THR B 122 ? 0.3326 0.5556 0.5760 -0.0802 -0.0227 -0.0560 110 THR H N 2540 C CA . THR B 122 ? 0.3054 0.5176 0.5422 -0.0697 -0.0401 -0.0591 110 THR H CA 2541 C C . THR B 122 ? 0.3312 0.5592 0.6022 -0.0678 -0.0491 -0.0817 110 THR H C 2542 O O . THR B 122 ? 0.3924 0.6318 0.6858 -0.0800 -0.0370 -0.0898 110 THR H O 2543 C CB . THR B 122 ? 0.2815 0.4760 0.4940 -0.0718 -0.0369 -0.0450 110 THR H CB 2544 O OG1 . THR B 122 ? 0.3708 0.5558 0.5574 -0.0721 -0.0302 -0.0293 110 THR H OG1 2545 C CG2 . THR B 122 ? 0.3628 0.5419 0.5642 -0.0603 -0.0542 -0.0479 110 THR H CG2 2546 N N . VAL B 123 ? 0.3669 0.5930 0.6403 -0.0519 -0.0702 -0.0942 111 VAL H N 2547 C CA . VAL B 123 ? 0.3729 0.6171 0.6820 -0.0453 -0.0841 -0.1213 111 VAL H CA 2548 C C . VAL B 123 ? 0.4242 0.6462 0.7135 -0.0298 -0.1049 -0.1233 111 VAL H C 2549 O O . VAL B 123 ? 0.4876 0.6822 0.7417 -0.0128 -0.1210 -0.1183 111 VAL H O 2550 C CB . VAL B 123 ? 0.3836 0.6448 0.7137 -0.0341 -0.0965 -0.1413 111 VAL H CB 2551 C CG1 . VAL B 123 ? 0.3021 0.5909 0.6796 -0.0280 -0.1102 -0.1756 111 VAL H CG1 2552 C CG2 . VAL B 123 ? 0.2968 0.5750 0.6394 -0.0482 -0.0758 -0.1367 111 VAL H CG2 2553 N N . SER B 124 ? 0.4343 0.6636 0.7423 -0.0360 -0.1034 -0.1310 112 SER H N 2554 C CA . SER B 124 ? 0.4451 0.6519 0.7329 -0.0220 -0.1219 -0.1318 112 SER H CA 2555 C C . SER B 124 ? 0.4381 0.6657 0.7658 -0.0278 -0.1237 -0.1530 112 SER H C 2556 O O . SER B 124 ? 0.4578 0.7087 0.8180 -0.0485 -0.1025 -0.1589 112 SER H O 2557 C CB . SER B 124 ? 0.3902 0.5658 0.6313 -0.0258 -0.1125 -0.1021 112 SER H CB 2558 O OG . SER B 124 ? 0.4300 0.5832 0.6517 -0.0146 -0.1270 -0.1024 112 SER H OG 2559 N N . SER B 125 ? 0.4501 0.6654 0.7722 -0.0095 -0.1480 -0.1656 113 SER H N 2560 C CA . SER B 125 ? 0.4185 0.6528 0.7788 -0.0135 -0.1522 -0.1879 113 SER H CA 2561 C C . SER B 125 ? 0.3810 0.5980 0.7205 -0.0280 -0.1362 -0.1662 113 SER H C 2562 O O . SER B 125 ? 0.4558 0.6858 0.8238 -0.0381 -0.1318 -0.1800 113 SER H O 2563 C CB . SER B 125 ? 0.4820 0.7080 0.8421 0.0154 -0.1881 -0.2119 113 SER H CB 2564 O OG . SER B 125 ? 0.6029 0.8452 0.9826 0.0317 -0.2055 -0.2359 113 SER H OG 2565 N N . ALA B 126 ? 0.3778 0.5658 0.6685 -0.0290 -0.1275 -0.1346 114 ALA H N 2566 C CA . ALA B 126 ? 0.4426 0.6132 0.7096 -0.0397 -0.1141 -0.1140 114 ALA H CA 2567 C C . ALA B 126 ? 0.4308 0.6167 0.7169 -0.0645 -0.0861 -0.1108 114 ALA H C 2568 O O . ALA B 126 ? 0.4011 0.6038 0.7044 -0.0742 -0.0727 -0.1143 114 ALA H O 2569 C CB . ALA B 126 ? 0.3501 0.4904 0.5652 -0.0336 -0.1121 -0.0864 114 ALA H CB 2570 N N . SER B 127 ? 0.4426 0.6172 0.7200 -0.0738 -0.0771 -0.1040 115 SER H N 2571 C CA . SER B 127 ? 0.4580 0.6326 0.7380 -0.0956 -0.0498 -0.0989 115 SER H CA 2572 C C . SER B 127 ? 0.4371 0.5860 0.6692 -0.0959 -0.0401 -0.0698 115 SER H C 2573 O O . SER B 127 ? 0.4675 0.6008 0.6713 -0.0829 -0.0527 -0.0565 115 SER H O 2574 C CB . SER B 127 ? 0.4968 0.6735 0.7995 -0.1073 -0.0441 -0.1151 115 SER H CB 2575 O OG . SER B 127 ? 0.5539 0.7615 0.9101 -0.1091 -0.0505 -0.1480 115 SER H OG 2576 N N . THR B 128 ? 0.4252 0.5683 0.6473 -0.1098 -0.0177 -0.0624 116 THR H N 2577 C CA . THR B 128 ? 0.5145 0.6353 0.6931 -0.1074 -0.0103 -0.0395 116 THR H CA 2578 C C . THR B 128 ? 0.5678 0.6673 0.7207 -0.1031 -0.0155 -0.0304 116 THR H C 2579 O O . THR B 128 ? 0.5806 0.6723 0.7402 -0.1118 -0.0102 -0.0384 116 THR H O 2580 C CB . THR B 128 ? 0.5321 0.6418 0.6981 -0.1209 0.0137 -0.0364 116 THR H CB 2581 O OG1 . THR B 128 ? 0.5495 0.6795 0.7392 -0.1246 0.0188 -0.0448 116 THR H OG1 2582 C CG2 . THR B 128 ? 0.5534 0.6406 0.6736 -0.1133 0.0163 -0.0165 116 THR H CG2 2583 N N . LYS B 129 ? 0.5620 0.6528 0.6872 -0.0905 -0.0247 -0.0155 117 LYS H N 2584 C CA . LYS B 129 ? 0.5805 0.6530 0.6812 -0.0842 -0.0311 -0.0072 117 LYS H CA 2585 C C . LYS B 129 ? 0.5707 0.6342 0.6389 -0.0758 -0.0302 0.0078 117 LYS H C 2586 O O . LYS B 129 ? 0.4336 0.5077 0.5018 -0.0701 -0.0333 0.0109 117 LYS H O 2587 C CB . LYS B 129 ? 0.5395 0.6144 0.6498 -0.0742 -0.0497 -0.0129 117 LYS H CB 2588 C CG . LYS B 129 ? 0.5743 0.6301 0.6586 -0.0666 -0.0568 -0.0042 117 LYS H CG 2589 C CD . LYS B 129 ? 0.6131 0.6644 0.6981 -0.0541 -0.0750 -0.0088 117 LYS H CD 2590 C CE . LYS B 129 ? 0.6855 0.7165 0.7410 -0.0461 -0.0802 0.0012 117 LYS H CE 2591 N NZ . LYS B 129 ? 0.7971 0.8193 0.8502 -0.0526 -0.0763 0.0006 117 LYS H NZ 2592 N N . GLY B 130 ? 0.5974 0.6412 0.6382 -0.0748 -0.0262 0.0145 118 GLY H N 2593 C CA . GLY B 130 ? 0.5585 0.5966 0.5717 -0.0643 -0.0279 0.0236 118 GLY H CA 2594 C C . GLY B 130 ? 0.5318 0.5748 0.5430 -0.0547 -0.0394 0.0262 118 GLY H C 2595 O O . GLY B 130 ? 0.4892 0.5281 0.5074 -0.0540 -0.0471 0.0238 118 GLY H O 2596 N N . PRO B 131 ? 0.5618 0.6122 0.5628 -0.0471 -0.0398 0.0289 119 PRO H N 2597 C CA . PRO B 131 ? 0.5581 0.6118 0.5562 -0.0407 -0.0451 0.0294 119 PRO H CA 2598 C C . PRO B 131 ? 0.5355 0.5761 0.5137 -0.0335 -0.0498 0.0320 119 PRO H C 2599 O O . PRO B 131 ? 0.5177 0.5490 0.4791 -0.0298 -0.0496 0.0335 119 PRO H O 2600 C CB . PRO B 131 ? 0.5376 0.6083 0.5386 -0.0384 -0.0402 0.0267 119 PRO H CB 2601 C CG . PRO B 131 ? 0.4985 0.5680 0.4898 -0.0360 -0.0375 0.0265 119 PRO H CG 2602 C CD . PRO B 131 ? 0.5594 0.6157 0.5526 -0.0445 -0.0342 0.0287 119 PRO H CD 2603 N N . SER B 132 ? 0.5512 0.5862 0.5264 -0.0305 -0.0540 0.0324 120 SER H N 2604 C CA . SER B 132 ? 0.5934 0.6191 0.5506 -0.0230 -0.0572 0.0338 120 SER H CA 2605 C C . SER B 132 ? 0.6079 0.6484 0.5653 -0.0199 -0.0510 0.0288 120 SER H C 2606 O O . SER B 132 ? 0.6347 0.6773 0.5975 -0.0238 -0.0453 0.0264 120 SER H O 2607 C CB . SER B 132 ? 0.6402 0.6474 0.5906 -0.0211 -0.0642 0.0358 120 SER H CB 2608 O OG . SER B 132 ? 0.8017 0.7995 0.7573 -0.0241 -0.0703 0.0359 120 SER H OG 2609 N N . VAL B 133 ? 0.5816 0.6303 0.5319 -0.0124 -0.0518 0.0248 121 VAL H N 2610 C CA . VAL B 133 ? 0.5647 0.6351 0.5235 -0.0094 -0.0460 0.0139 121 VAL H CA 2611 C C . VAL B 133 ? 0.5553 0.6226 0.5054 -0.0044 -0.0452 0.0097 121 VAL H C 2612 O O . VAL B 133 ? 0.5733 0.6337 0.5088 0.0054 -0.0532 0.0100 121 VAL H O 2613 C CB . VAL B 133 ? 0.5174 0.6030 0.4766 -0.0004 -0.0498 0.0061 121 VAL H CB 2614 C CG1 . VAL B 133 ? 0.4539 0.5688 0.4307 0.0028 -0.0448 -0.0108 121 VAL H CG1 2615 C CG2 . VAL B 133 ? 0.4393 0.5242 0.4034 -0.0055 -0.0486 0.0105 121 VAL H CG2 2616 N N . PHE B 134 ? 0.5542 0.6225 0.5095 -0.0115 -0.0340 0.0052 122 PHE H N 2617 C CA . PHE B 134 ? 0.5754 0.6388 0.5219 -0.0092 -0.0286 -0.0003 122 PHE H CA 2618 C C . PHE B 134 ? 0.6121 0.7047 0.5788 -0.0123 -0.0153 -0.0194 122 PHE H C 2619 O O . PHE B 134 ? 0.6599 0.7656 0.6429 -0.0213 -0.0055 -0.0256 122 PHE H O 2620 C CB . PHE B 134 ? 0.5984 0.6289 0.5260 -0.0148 -0.0237 0.0083 122 PHE H CB 2621 C CG . PHE B 134 ? 0.6442 0.6510 0.5591 -0.0113 -0.0381 0.0218 122 PHE H CG 2622 C CD1 . PHE B 134 ? 0.6173 0.6169 0.5225 -0.0031 -0.0501 0.0265 122 PHE H CD1 2623 C CD2 . PHE B 134 ? 0.6747 0.6666 0.5884 -0.0159 -0.0398 0.0269 122 PHE H CD2 2624 C CE1 . PHE B 134 ? 0.6132 0.5939 0.5122 -0.0020 -0.0615 0.0349 122 PHE H CE1 2625 C CE2 . PHE B 134 ? 0.6966 0.6726 0.6061 -0.0124 -0.0536 0.0336 122 PHE H CE2 2626 C CZ . PHE B 134 ? 0.6468 0.6185 0.5512 -0.0067 -0.0634 0.0369 122 PHE H CZ 2627 N N . PRO B 135 ? 0.6005 0.7051 0.5687 -0.0051 -0.0146 -0.0313 123 PRO H N 2628 C CA . PRO B 135 ? 0.5892 0.7282 0.5842 -0.0081 -0.0018 -0.0558 123 PRO H CA 2629 C C . PRO B 135 ? 0.5219 0.6495 0.5165 -0.0250 0.0235 -0.0620 123 PRO H C 2630 O O . PRO B 135 ? 0.5079 0.5994 0.4745 -0.0281 0.0284 -0.0500 123 PRO H O 2631 C CB . PRO B 135 ? 0.5826 0.7357 0.5768 0.0081 -0.0125 -0.0672 123 PRO H CB 2632 C CG . PRO B 135 ? 0.5954 0.7108 0.5567 0.0120 -0.0204 -0.0469 123 PRO H CG 2633 C CD . PRO B 135 ? 0.6277 0.7173 0.5754 0.0068 -0.0267 -0.0254 123 PRO H CD 2634 N N . LEU B 136 ? 0.4891 0.4203 0.5739 0.0911 0.0686 -0.0390 124 LEU H N 2635 C CA . LEU B 136 ? 0.5036 0.4580 0.5609 0.0991 0.0941 -0.0293 124 LEU H CA 2636 C C . LEU B 136 ? 0.5254 0.5081 0.6257 0.1120 0.1186 -0.0239 124 LEU H C 2637 O O . LEU B 136 ? 0.5680 0.5752 0.7143 0.0993 0.1221 0.0008 124 LEU H O 2638 C CB . LEU B 136 ? 0.4294 0.3881 0.4784 0.0785 0.0924 -0.0004 124 LEU H CB 2639 C CG . LEU B 136 ? 0.4298 0.3659 0.4427 0.0706 0.0696 -0.0044 124 LEU H CG 2640 C CD1 . LEU B 136 ? 0.4689 0.4008 0.4830 0.0523 0.0673 0.0208 124 LEU H CD1 2641 C CD2 . LEU B 136 ? 0.4521 0.3855 0.4050 0.0893 0.0725 -0.0206 124 LEU H CD2 2642 N N . ALA B 137 ? 0.5324 0.5154 0.6200 0.1384 0.1344 -0.0505 125 ALA H N 2643 C CA . ALA B 137 ? 0.5521 0.5638 0.6859 0.1583 0.1590 -0.0508 125 ALA H CA 2644 C C . ALA B 137 ? 0.5949 0.6556 0.7400 0.1549 0.1908 -0.0227 125 ALA H C 2645 O O . ALA B 137 ? 0.6646 0.7303 0.7568 0.1528 0.2068 -0.0146 125 ALA H O 2646 C CB . ALA B 137 ? 0.5766 0.5731 0.6847 0.1905 0.1712 -0.0925 125 ALA H CB 2647 N N . PRO B 138 ? 0.6153 0.7148 0.8337 0.1540 0.1997 -0.0048 126 PRO H N 2648 C CA . PRO B 138 ? 0.6013 0.7570 0.8505 0.1489 0.2334 0.0205 126 PRO H CA 2649 C C . PRO B 138 ? 0.6306 0.8152 0.8634 0.1831 0.2754 0.0052 126 PRO H C 2650 O O . PRO B 138 ? 0.6164 0.7879 0.8491 0.2144 0.2765 -0.0266 126 PRO H O 2651 C CB . PRO B 138 ? 0.5385 0.7318 0.8786 0.1398 0.2205 0.0373 126 PRO H CB 2652 C CG . PRO B 138 ? 0.5463 0.7080 0.8996 0.1617 0.1971 0.0163 126 PRO H CG 2653 C CD . PRO B 138 ? 0.5897 0.6864 0.8706 0.1558 0.1761 -0.0032 126 PRO H CD 2654 N N . SER B 139 ? 0.6970 0.9182 0.9154 0.1775 0.3118 0.0279 127 SER H N 2655 C CA . SER B 139 ? 0.7519 1.0112 0.9497 0.2102 0.3589 0.0181 127 SER H CA 2656 C C . SER B 139 ? 0.7833 1.0986 1.0059 0.1924 0.4003 0.0597 127 SER H C 2657 O O . SER B 139 ? 0.7738 1.0985 1.0458 0.1543 0.3900 0.0914 127 SER H O 2658 C CB . SER B 139 ? 0.8163 1.0366 0.9067 0.2330 0.3603 -0.0118 127 SER H CB 2659 O OG . SER B 139 ? 0.8493 1.0506 0.8778 0.2116 0.3572 0.0139 127 SER H OG 2660 N N . SER B 140 ? 0.8107 1.1523 0.9925 0.2097 0.4314 0.0540 128 SER H N 2661 C CA . SER B 140 ? 0.8237 1.2060 1.0155 0.1869 0.4632 0.0921 128 SER H CA 2662 C C . SER B 140 ? 0.8709 1.2128 1.0026 0.1618 0.4610 0.1245 128 SER H C 2663 O O . SER B 140 ? 0.9223 1.2779 1.0824 0.1292 0.4749 0.1631 128 SER H O 2664 C CB . SER B 140 ? 0.9094 1.3269 1.0630 0.2147 0.4984 0.0769 128 SER H CB 2665 O OG . SER B 140 ? 0.9771 1.3544 1.0235 0.2407 0.4942 0.0490 128 SER H OG 2666 N N . LYS B 141 ? 0.8631 1.1521 0.9135 0.1772 0.4406 0.1067 129 LYS H N 2667 C CA . LYS B 141 ? 0.8757 1.1219 0.8642 0.1601 0.4332 0.1354 129 LYS H CA 2668 C C . LYS B 141 ? 0.8610 1.0734 0.8985 0.1264 0.4009 0.1484 129 LYS H C 2669 O O . LYS B 141 ? 0.8276 0.9931 0.8202 0.1123 0.3828 0.1647 129 LYS H O 2670 C CB . LYS B 141 ? 0.8704 1.0819 0.7490 0.1911 0.4177 0.1074 129 LYS H CB 2671 C CG . LYS B 141 ? 0.9668 1.2049 0.7822 0.2169 0.4409 0.0954 129 LYS H CG 2672 C CD . LYS B 141 ? 1.0391 1.2921 0.8385 0.2001 0.4706 0.1465 129 LYS H CD 2673 C CE . LYS B 141 ? 1.1958 1.4813 0.9335 0.2261 0.4981 0.1368 129 LYS H CE 2674 N NZ . LYS B 141 ? 1.2441 1.5805 1.0395 0.2376 0.5239 0.1120 129 LYS H NZ 2675 N N . SER B 142 ? 0.8396 1.0730 0.9671 0.1132 0.3834 0.1370 130 SER H N 2676 C CA . SER B 142 ? 0.7676 0.9740 0.9433 0.0774 0.3436 0.1433 130 SER H CA 2677 C C . SER B 142 ? 0.6745 0.9364 0.9594 0.0528 0.3513 0.1583 130 SER H C 2678 O O . SER B 142 ? 0.5986 0.8523 0.9321 0.0259 0.3165 0.1572 130 SER H O 2679 C CB . SER B 142 ? 0.7574 0.9254 0.9181 0.0879 0.2960 0.1074 130 SER H CB 2680 O OG . SER B 142 ? 0.8062 1.0014 1.0021 0.1140 0.2970 0.0812 130 SER H OG 2681 N N . THR B 143 ? 0.7497 1.0731 1.0704 0.0626 0.3943 0.1700 131 THR H N 2682 C CA . THR B 143 ? 0.7746 1.1558 1.1943 0.0385 0.3921 0.1786 131 THR H CA 2683 C C . THR B 143 ? 0.8923 1.2848 1.3202 0.0056 0.4158 0.2096 131 THR H C 2684 O O . THR B 143 ? 0.9648 1.3508 1.3315 0.0180 0.4482 0.2225 131 THR H O 2685 C CB . THR B 143 ? 0.7389 1.1778 1.1972 0.0735 0.4048 0.1574 131 THR H CB 2686 O OG1 . THR B 143 ? 0.7455 1.1589 1.1876 0.1077 0.3837 0.1270 131 THR H OG1 2687 C CG2 . THR B 143 ? 0.6855 1.1889 1.2495 0.0513 0.3938 0.1643 131 THR H CG2 2688 N N . SER B 144 ? 0.9339 1.3421 1.4348 -0.0364 0.3973 0.2197 132 SER H N 2689 C CA . SER B 144 ? 0.9861 1.4034 1.5076 -0.0720 0.4180 0.2461 132 SER H CA 2690 C C . SER B 144 ? 0.9405 1.4257 1.5678 -0.1012 0.4079 0.2430 132 SER H C 2691 O O . SER B 144 ? 0.9153 1.3877 1.5832 -0.1390 0.3761 0.2400 132 SER H O 2692 C CB . SER B 144 ? 1.0671 1.4062 1.5473 -0.1019 0.4030 0.2613 132 SER H CB 2693 O OG . SER B 144 ? 1.0822 1.4002 1.5985 -0.1253 0.3582 0.2442 132 SER H OG 2694 N N . GLY B 145 ? 0.9111 1.4704 1.5796 -0.0820 0.4338 0.2404 133 GLY H N 2695 C CA . GLY B 145 ? 0.8099 1.4463 1.5797 -0.1062 0.4288 0.2387 133 GLY H CA 2696 C C . GLY B 145 ? 0.6632 1.3212 1.4921 -0.1118 0.3780 0.2166 133 GLY H C 2697 O O . GLY B 145 ? 0.6386 1.2934 1.5062 -0.1538 0.3485 0.2151 133 GLY H O 2698 N N . GLY B 146 ? 0.5619 1.2395 1.3933 -0.0682 0.3664 0.1982 134 GLY H N 2699 C CA . GLY B 146 ? 0.5604 1.2660 1.4462 -0.0663 0.3190 0.1815 134 GLY H CA 2700 C C . GLY B 146 ? 0.5058 1.1433 1.3464 -0.0656 0.2790 0.1720 134 GLY H C 2701 O O . GLY B 146 ? 0.4290 1.0812 1.2936 -0.0486 0.2430 0.1595 134 GLY H O 2702 N N . THR B 147 ? 0.5643 1.1281 1.3385 -0.0825 0.2850 0.1797 135 THR H N 2703 C CA . THR B 147 ? 0.5439 1.0440 1.2736 -0.0826 0.2512 0.1704 135 THR H CA 2704 C C . THR B 147 ? 0.5240 0.9700 1.1743 -0.0488 0.2740 0.1701 135 THR H C 2705 O O . THR B 147 ? 0.5921 1.0132 1.1915 -0.0472 0.3095 0.1830 135 THR H O 2706 C CB . THR B 147 ? 0.6250 1.0780 1.3417 -0.1304 0.2307 0.1730 135 THR H CB 2707 O OG1 . THR B 147 ? 0.7890 1.2113 1.4726 -0.1463 0.2678 0.1923 135 THR H OG1 2708 C CG2 . THR B 147 ? 0.5818 1.0861 1.3705 -0.1634 0.1987 0.1631 135 THR H CG2 2709 N N . ALA B 148 ? 0.4684 0.8973 1.1057 -0.0210 0.2521 0.1552 136 ALA H N 2710 C CA . ALA B 148 ? 0.4050 0.7713 0.9486 0.0108 0.2596 0.1417 136 ALA H CA 2711 C C . ALA B 148 ? 0.4607 0.7527 0.9416 -0.0014 0.2189 0.1307 136 ALA H C 2712 O O . ALA B 148 ? 0.3956 0.6881 0.9042 -0.0171 0.1806 0.1260 136 ALA H O 2713 C CB . ALA B 148 ? 0.4614 0.8456 1.0129 0.0573 0.2629 0.1223 136 ALA H CB 2714 N N . ALA B 149 ? 0.4751 0.7098 0.8704 0.0081 0.2279 0.1269 137 ALA H N 2715 C CA . ALA B 149 ? 0.4426 0.6132 0.7796 0.0014 0.1941 0.1161 137 ALA H CA 2716 C C . ALA B 149 ? 0.4516 0.5953 0.7477 0.0333 0.1787 0.0914 137 ALA H C 2717 O O . ALA B 149 ? 0.4828 0.6326 0.7570 0.0623 0.2009 0.0801 137 ALA H O 2718 C CB . ALA B 149 ? 0.4287 0.5556 0.7053 -0.0097 0.2088 0.1299 137 ALA H CB 2719 N N . LEU B 150 ? 0.4079 0.5219 0.6950 0.0266 0.1419 0.0819 138 LEU H N 2720 C CA . LEU B 150 ? 0.4501 0.5318 0.7043 0.0485 0.1258 0.0610 138 LEU H CA 2721 C C . LEU B 150 ? 0.4846 0.5294 0.7114 0.0319 0.0939 0.0588 138 LEU H C 2722 O O . LEU B 150 ? 0.4307 0.4789 0.6701 0.0077 0.0820 0.0698 138 LEU H O 2723 C CB . LEU B 150 ? 0.3888 0.4944 0.6953 0.0687 0.1211 0.0551 138 LEU H CB 2724 C CG . LEU B 150 ? 0.4116 0.5495 0.7792 0.0561 0.0974 0.0700 138 LEU H CG 2725 C CD1 . LEU B 150 ? 0.4135 0.5171 0.7657 0.0555 0.0646 0.0676 138 LEU H CD1 2726 C CD2 . LEU B 150 ? 0.4439 0.6348 0.8799 0.0779 0.1109 0.0747 138 LEU H CD2 2727 N N . GLY B 151 ? 0.4932 0.5049 0.6852 0.0441 0.0811 0.0421 139 GLY H N 2728 C CA . GLY B 151 ? 0.4900 0.4751 0.6596 0.0302 0.0558 0.0410 139 GLY H CA 2729 C C . GLY B 151 ? 0.4284 0.3848 0.5743 0.0402 0.0431 0.0233 139 GLY H C 2730 O O . GLY B 151 ? 0.4058 0.3558 0.5578 0.0576 0.0488 0.0081 139 GLY H O 2731 N N . CYS B 152 ? 0.4212 0.3612 0.5444 0.0281 0.0264 0.0234 140 CYS H N 2732 C CA . CYS B 152 ? 0.4156 0.3353 0.5247 0.0305 0.0134 0.0086 140 CYS H CA 2733 C C . CYS B 152 ? 0.4705 0.3826 0.5367 0.0292 0.0095 0.0017 140 CYS H C 2734 O O . CYS B 152 ? 0.4674 0.3805 0.5192 0.0221 0.0104 0.0136 140 CYS H O 2735 C CB . CYS B 152 ? 0.3789 0.2969 0.5125 0.0189 -0.0028 0.0200 140 CYS H CB 2736 S SG . CYS B 152 ? 0.5883 0.5015 0.7696 0.0286 -0.0044 0.0270 140 CYS H SG 2737 N N . LEU B 153 ? 0.4805 0.3849 0.5295 0.0372 0.0034 -0.0193 141 LEU H N 2738 C CA . LEU B 153 ? 0.4667 0.3730 0.4812 0.0395 -0.0055 -0.0260 141 LEU H CA 2739 C C . LEU B 153 ? 0.4994 0.4074 0.5333 0.0279 -0.0232 -0.0334 141 LEU H C 2740 O O . LEU B 153 ? 0.4691 0.3716 0.5206 0.0253 -0.0309 -0.0521 141 LEU H O 2741 C CB . LEU B 153 ? 0.4971 0.4064 0.4736 0.0578 -0.0021 -0.0455 141 LEU H CB 2742 C CG . LEU B 153 ? 0.5523 0.4717 0.4915 0.0661 -0.0154 -0.0515 141 LEU H CG 2743 C CD1 . LEU B 153 ? 0.5690 0.4847 0.4870 0.0690 -0.0073 -0.0235 141 LEU H CD1 2744 C CD2 . LEU B 153 ? 0.5419 0.4702 0.4392 0.0854 -0.0168 -0.0750 141 LEU H CD2 2745 N N . VAL B 154 ? 0.5162 0.4310 0.5495 0.0202 -0.0276 -0.0196 142 VAL H N 2746 C CA . VAL B 154 ? 0.4755 0.4016 0.5290 0.0092 -0.0386 -0.0216 142 VAL H CA 2747 C C . VAL B 154 ? 0.4753 0.4197 0.5114 0.0178 -0.0487 -0.0343 142 VAL H C 2748 O O . VAL B 154 ? 0.5206 0.4711 0.5379 0.0260 -0.0477 -0.0254 142 VAL H O 2749 C CB . VAL B 154 ? 0.4642 0.3948 0.5244 -0.0003 -0.0358 -0.0019 142 VAL H CB 2750 C CG1 . VAL B 154 ? 0.3874 0.3364 0.4682 -0.0107 -0.0410 -0.0002 142 VAL H CG1 2751 C CG2 . VAL B 154 ? 0.4703 0.3925 0.5471 -0.0060 -0.0310 0.0119 142 VAL H CG2 2752 N N . LYS B 155 ? 0.4520 0.4053 0.4971 0.0172 -0.0604 -0.0570 143 LYS H N 2753 C CA . LYS B 155 ? 0.5060 0.4856 0.5327 0.0294 -0.0749 -0.0718 143 LYS H CA 2754 C C . LYS B 155 ? 0.4926 0.5049 0.5604 0.0154 -0.0895 -0.0827 143 LYS H C 2755 O O . LYS B 155 ? 0.4668 0.4744 0.5768 -0.0063 -0.0905 -0.0884 143 LYS H O 2756 C CB . LYS B 155 ? 0.6224 0.5986 0.6193 0.0423 -0.0809 -0.0957 143 LYS H CB 2757 C CG . LYS B 155 ? 0.6492 0.6561 0.6114 0.0619 -0.0978 -0.1068 143 LYS H CG 2758 C CD . LYS B 155 ? 0.7192 0.7247 0.6384 0.0774 -0.1018 -0.1304 143 LYS H CD 2759 C CE . LYS B 155 ? 0.7901 0.8318 0.6661 0.1009 -0.1219 -0.1373 143 LYS H CE 2760 N NZ . LYS B 155 ? 0.7679 0.8065 0.6142 0.1206 -0.1110 -0.0987 143 LYS H NZ 2761 N N . ASP B 156 ? 0.5158 0.5619 0.5752 0.0290 -0.0993 -0.0825 144 ASP H N 2762 C CA . ASP B 156 ? 0.4646 0.5584 0.5668 0.0195 -0.1154 -0.0959 144 ASP H CA 2763 C C . ASP B 156 ? 0.4258 0.5302 0.5796 -0.0050 -0.1039 -0.0825 144 ASP H C 2764 O O . ASP B 156 ? 0.4388 0.5527 0.6404 -0.0303 -0.1091 -0.0933 144 ASP H O 2765 C CB . ASP B 156 ? 0.4727 0.5781 0.5882 0.0102 -0.1369 -0.1308 144 ASP H CB 2766 C CG . ASP B 156 ? 0.5525 0.6629 0.6094 0.0382 -0.1506 -0.1454 144 ASP H CG 2767 O OD1 . ASP B 156 ? 0.5567 0.6750 0.5754 0.0648 -0.1479 -0.1255 144 ASP H OD1 2768 O OD2 . ASP B 156 ? 0.6091 0.7131 0.6555 0.0350 -0.1631 -0.1763 144 ASP H OD2 2769 N N . TYR B 157 ? 0.4124 0.5143 0.5553 0.0021 -0.0874 -0.0591 145 TYR H N 2770 C CA . TYR B 157 ? 0.4037 0.5238 0.5837 -0.0161 -0.0736 -0.0436 145 TYR H CA 2771 C C . TYR B 157 ? 0.3903 0.5517 0.5731 0.0005 -0.0677 -0.0374 145 TYR H C 2772 O O . TYR B 157 ? 0.4524 0.6118 0.6026 0.0283 -0.0719 -0.0399 145 TYR H O 2773 C CB . TYR B 157 ? 0.4097 0.4888 0.5725 -0.0242 -0.0573 -0.0232 145 TYR H CB 2774 C CG . TYR B 157 ? 0.4110 0.4669 0.5259 -0.0048 -0.0499 -0.0147 145 TYR H CG 2775 C CD1 . TYR B 157 ? 0.3972 0.4169 0.4802 0.0045 -0.0520 -0.0173 145 TYR H CD1 2776 C CD2 . TYR B 157 ? 0.4212 0.4914 0.5257 0.0030 -0.0390 -0.0060 145 TYR H CD2 2777 C CE1 . TYR B 157 ? 0.4503 0.4469 0.4995 0.0161 -0.0447 -0.0094 145 TYR H CE1 2778 C CE2 . TYR B 157 ? 0.4643 0.5063 0.5297 0.0171 -0.0339 -0.0038 145 TYR H CE2 2779 C CZ . TYR B 157 ? 0.4930 0.4974 0.5346 0.0211 -0.0374 -0.0044 145 TYR H CZ 2780 O OH . TYR B 157 ? 0.4809 0.4555 0.4931 0.0292 -0.0319 -0.0019 145 TYR H OH 2781 N N . PHE B 158 ? 0.3811 0.5786 0.6038 -0.0148 -0.0550 -0.0273 146 PHE H N 2782 C CA . PHE B 158 ? 0.3386 0.5816 0.5691 0.0027 -0.0442 -0.0230 146 PHE H CA 2783 C C . PHE B 158 ? 0.3894 0.6577 0.6456 -0.0162 -0.0202 -0.0040 146 PHE H C 2784 O O . PHE B 158 ? 0.4314 0.7108 0.7310 -0.0465 -0.0171 0.0043 146 PHE H O 2785 C CB . PHE B 158 ? 0.3259 0.6300 0.5964 0.0132 -0.0614 -0.0391 146 PHE H CB 2786 C CG . PHE B 158 ? 0.3453 0.7007 0.6294 0.0385 -0.0499 -0.0360 146 PHE H CG 2787 C CD1 . PHE B 158 ? 0.3623 0.6999 0.6044 0.0782 -0.0523 -0.0384 146 PHE H CD1 2788 C CD2 . PHE B 158 ? 0.3124 0.7324 0.6540 0.0240 -0.0334 -0.0292 146 PHE H CD2 2789 C CE1 . PHE B 158 ? 0.3105 0.6903 0.5668 0.1069 -0.0403 -0.0382 146 PHE H CE1 2790 C CE2 . PHE B 158 ? 0.2852 0.7575 0.6411 0.0518 -0.0192 -0.0284 146 PHE H CE2 2791 C CZ . PHE B 158 ? 0.3076 0.7581 0.6204 0.0953 -0.0236 -0.0350 146 PHE H CZ 2792 N N . PRO B 159 ? 0.4025 0.6771 0.6293 0.0022 -0.0018 0.0032 147 PRO H N 2793 C CA . PRO B 159 ? 0.4244 0.6707 0.6015 0.0354 -0.0036 -0.0070 147 PRO H CA 2794 C C . PRO B 159 ? 0.4501 0.6334 0.5739 0.0326 -0.0010 -0.0020 147 PRO H C 2795 O O . PRO B 159 ? 0.4368 0.5979 0.5608 0.0097 -0.0027 0.0091 147 PRO H O 2796 C CB . PRO B 159 ? 0.3821 0.6772 0.5683 0.0541 0.0167 -0.0077 147 PRO H CB 2797 C CG . PRO B 159 ? 0.3170 0.6387 0.5210 0.0268 0.0368 0.0113 147 PRO H CG 2798 C CD . PRO B 159 ? 0.3066 0.6254 0.5531 -0.0071 0.0243 0.0198 147 PRO H CD 2799 N N . GLU B 160 ? 0.5059 0.6614 0.5897 0.0563 0.0023 -0.0109 148 GLU H N 2800 C CA . GLU B 160 ? 0.4963 0.6030 0.5363 0.0517 0.0047 -0.0104 148 GLU H CA 2801 C C . GLU B 160 ? 0.5434 0.6740 0.5751 0.0390 0.0193 -0.0009 148 GLU H C 2802 O O . GLU B 160 ? 0.6423 0.8236 0.6944 0.0414 0.0343 0.0034 148 GLU H O 2803 C CB . GLU B 160 ? 0.4988 0.5687 0.5055 0.0777 0.0058 -0.0256 148 GLU H CB 2804 C CG . GLU B 160 ? 0.5507 0.5856 0.5527 0.0910 -0.0066 -0.0263 148 GLU H CG 2805 C CD . GLU B 160 ? 0.7012 0.6800 0.6779 0.0777 -0.0115 -0.0231 148 GLU H CD 2806 O OE1 . GLU B 160 ? 0.7362 0.7158 0.7165 0.0537 -0.0138 -0.0162 148 GLU H OE1 2807 O OE2 . GLU B 160 ? 0.7710 0.7059 0.7285 0.0920 -0.0119 -0.0249 148 GLU H OE2 2808 N N . PRO B 161 ? 0.5500 0.6510 0.5526 0.0263 0.0155 0.0046 149 PRO H N 2809 C CA . PRO B 161 ? 0.5302 0.5832 0.5212 0.0193 0.0004 0.0032 149 PRO H CA 2810 C C . PRO B 161 ? 0.5405 0.5921 0.5528 -0.0016 -0.0058 0.0226 149 PRO H C 2811 O O . PRO B 161 ? 0.5144 0.5943 0.5482 -0.0128 0.0012 0.0392 149 PRO H O 2812 C CB . PRO B 161 ? 0.5244 0.5566 0.4747 0.0215 -0.0001 -0.0083 149 PRO H CB 2813 C CG . PRO B 161 ? 0.4974 0.5715 0.4344 0.0191 0.0118 -0.0000 149 PRO H CG 2814 C CD . PRO B 161 ? 0.4942 0.6120 0.4649 0.0246 0.0264 0.0080 149 PRO H CD 2815 N N . VAL B 162 ? 0.5169 0.5348 0.5266 -0.0060 -0.0164 0.0219 150 VAL H N 2816 C CA . VAL B 162 ? 0.5473 0.5590 0.5735 -0.0202 -0.0217 0.0385 150 VAL H CA 2817 C C . VAL B 162 ? 0.6044 0.6010 0.6108 -0.0231 -0.0291 0.0391 150 VAL H C 2818 O O . VAL B 162 ? 0.6570 0.6339 0.6473 -0.0188 -0.0317 0.0240 150 VAL H O 2819 C CB . VAL B 162 ? 0.5473 0.5428 0.5991 -0.0216 -0.0268 0.0353 150 VAL H CB 2820 C CG1 . VAL B 162 ? 0.5075 0.5245 0.5873 -0.0244 -0.0251 0.0320 150 VAL H CG1 2821 C CG2 . VAL B 162 ? 0.6482 0.6198 0.6827 -0.0106 -0.0298 0.0215 150 VAL H CG2 2822 N N . THR B 163 ? 0.5978 0.6050 0.6093 -0.0310 -0.0333 0.0582 151 THR H N 2823 C CA . THR B 163 ? 0.5945 0.5991 0.5979 -0.0343 -0.0452 0.0596 151 THR H CA 2824 C C . THR B 163 ? 0.5995 0.5952 0.6368 -0.0361 -0.0498 0.0737 151 THR H C 2825 O O . THR B 163 ? 0.6666 0.6610 0.7254 -0.0365 -0.0460 0.0906 151 THR H O 2826 C CB . THR B 163 ? 0.6122 0.6447 0.5874 -0.0356 -0.0506 0.0701 151 THR H CB 2827 O OG1 . THR B 163 ? 0.6972 0.7447 0.6833 -0.0367 -0.0441 0.1004 151 THR H OG1 2828 C CG2 . THR B 163 ? 0.5609 0.6012 0.4981 -0.0301 -0.0441 0.0486 151 THR H CG2 2829 N N . VAL B 164 ? 0.5816 0.5700 0.6282 -0.0371 -0.0558 0.0659 152 VAL H N 2830 C CA . VAL B 164 ? 0.5838 0.5695 0.6647 -0.0342 -0.0573 0.0765 152 VAL H CA 2831 C C . VAL B 164 ? 0.5847 0.5933 0.6778 -0.0373 -0.0705 0.0819 152 VAL H C 2832 O O . VAL B 164 ? 0.6089 0.6216 0.6945 -0.0459 -0.0753 0.0667 152 VAL H O 2833 C CB . VAL B 164 ? 0.6367 0.6007 0.7279 -0.0297 -0.0466 0.0624 152 VAL H CB 2834 C CG1 . VAL B 164 ? 0.7253 0.6789 0.7950 -0.0330 -0.0431 0.0469 152 VAL H CG1 2835 C CG2 . VAL B 164 ? 0.5528 0.5202 0.6771 -0.0241 -0.0449 0.0683 152 VAL H CG2 2836 N N . SER B 165 ? 0.5443 0.5682 0.6605 -0.0304 -0.0778 0.1041 153 SER H N 2837 C CA . SER B 165 ? 0.4374 0.4941 0.5766 -0.0296 -0.0935 0.1118 153 SER H CA 2838 C C . SER B 165 ? 0.5019 0.5567 0.6888 -0.0170 -0.0866 0.1198 153 SER H C 2839 O O . SER B 165 ? 0.4797 0.5033 0.6738 -0.0091 -0.0716 0.1182 153 SER H O 2840 C CB . SER B 165 ? 0.3846 0.4705 0.5072 -0.0252 -0.1112 0.1348 153 SER H CB 2841 O OG . SER B 165 ? 0.3700 0.4423 0.5064 -0.0119 -0.1056 0.1642 153 SER H OG 2842 N N . TRP B 166 ? 0.5831 0.6752 0.8046 -0.0146 -0.0980 0.1250 154 TRP H N 2843 C CA . TRP B 166 ? 0.5189 0.6191 0.7911 0.0022 -0.0898 0.1325 154 TRP H CA 2844 C C . TRP B 166 ? 0.4995 0.6385 0.8032 0.0183 -0.1097 0.1592 154 TRP H C 2845 O O . TRP B 166 ? 0.5245 0.7084 0.8271 0.0105 -0.1330 0.1631 154 TRP H O 2846 C CB . TRP B 166 ? 0.4500 0.5681 0.7489 -0.0068 -0.0785 0.1153 154 TRP H CB 2847 C CG . TRP B 166 ? 0.3813 0.4589 0.6518 -0.0132 -0.0559 0.0967 154 TRP H CG 2848 C CD1 . TRP B 166 ? 0.3860 0.4438 0.6189 -0.0306 -0.0543 0.0829 154 TRP H CD1 2849 C CD2 . TRP B 166 ? 0.3961 0.4493 0.6704 0.0018 -0.0332 0.0896 154 TRP H CD2 2850 N NE1 . TRP B 166 ? 0.4412 0.4669 0.6550 -0.0263 -0.0335 0.0728 154 TRP H NE1 2851 C CE2 . TRP B 166 ? 0.4547 0.4794 0.6899 -0.0076 -0.0211 0.0749 154 TRP H CE2 2852 C CE3 . TRP B 166 ? 0.4037 0.4553 0.7082 0.0249 -0.0226 0.0920 154 TRP H CE3 2853 C CZ2 . TRP B 166 ? 0.4052 0.4073 0.6256 0.0044 -0.0016 0.0635 154 TRP H CZ2 2854 C CZ3 . TRP B 166 ? 0.4214 0.4460 0.7111 0.0355 -0.0013 0.0749 154 TRP H CZ3 2855 C CH2 . TRP B 166 ? 0.4246 0.4282 0.6700 0.0247 0.0077 0.0613 154 TRP H CH2 2856 N N . ASN B 167 ? 0.4730 0.5933 0.8045 0.0424 -0.1022 0.1762 155 ASN H N 2857 C CA . ASN B 167 ? 0.4404 0.5890 0.8030 0.0654 -0.1198 0.2086 155 ASN H CA 2858 C C . ASN B 167 ? 0.4645 0.6295 0.7854 0.0606 -0.1428 0.2325 155 ASN H C 2859 O O . ASN B 167 ? 0.4199 0.6375 0.7538 0.0712 -0.1683 0.2527 155 ASN H O 2860 C CB . ASN B 167 ? 0.4168 0.6299 0.8363 0.0736 -0.1294 0.2070 155 ASN H CB 2861 C CG . ASN B 167 ? 0.4291 0.6329 0.8927 0.0871 -0.1020 0.1909 155 ASN H CG 2862 O OD1 . ASN B 167 ? 0.4915 0.6427 0.9320 0.0841 -0.0781 0.1721 155 ASN H OD1 2863 N ND2 . ASN B 167 ? 0.4476 0.7091 0.9746 0.1038 -0.1054 0.1972 155 ASN H ND2 2864 N N . SER B 168 ? 0.4748 0.6015 0.7453 0.0461 -0.1335 0.2296 156 SER H N 2865 C CA . SER B 168 ? 0.5272 0.6661 0.7492 0.0427 -0.1468 0.2530 156 SER H CA 2866 C C . SER B 168 ? 0.5533 0.7513 0.7496 0.0319 -0.1731 0.2406 156 SER H C 2867 O O . SER B 168 ? 0.5802 0.8139 0.7494 0.0405 -0.1945 0.2656 156 SER H O 2868 C CB . SER B 168 ? 0.5694 0.7002 0.8031 0.0669 -0.1505 0.2979 156 SER H CB 2869 O OG . SER B 168 ? 0.5969 0.6662 0.8581 0.0736 -0.1259 0.2991 156 SER H OG 2870 N N . GLY B 169 ? 0.4973 0.7037 0.7006 0.0126 -0.1717 0.2020 157 GLY H N 2871 C CA . GLY B 169 ? 0.4513 0.7035 0.6351 -0.0037 -0.1962 0.1804 157 GLY H CA 2872 C C . GLY B 169 ? 0.4746 0.7852 0.7162 -0.0033 -0.2182 0.1767 157 GLY H C 2873 O O . GLY B 169 ? 0.5115 0.8569 0.7526 -0.0241 -0.2375 0.1497 157 GLY H O 2874 N N . ALA B 170 ? 0.4989 0.8199 0.7331 0.0375 -0.2228 0.1753 158 ALA H N 2875 C CA . ALA B 170 ? 0.5171 0.9202 0.8385 0.0509 -0.2478 0.1972 158 ALA H CA 2876 C C . ALA B 170 ? 0.4807 0.9112 0.8671 0.0281 -0.2319 0.1712 158 ALA H C 2877 O O . ALA B 170 ? 0.4422 0.9202 0.8642 0.0128 -0.2507 0.1584 158 ALA H O 2878 C CB . ALA B 170 ? 0.4479 0.8498 0.8025 0.1001 -0.2254 0.2365 158 ALA H CB 2879 N N . LEU B 171 ? 0.4558 0.8460 0.8468 0.0262 -0.1929 0.1601 159 LEU H N 2880 C CA . LEU B 171 ? 0.3935 0.7997 0.8397 0.0091 -0.1741 0.1418 159 LEU H CA 2881 C C . LEU B 171 ? 0.3768 0.7519 0.7728 -0.0288 -0.1770 0.1034 159 LEU H C 2882 O O . LEU B 171 ? 0.3516 0.6643 0.6879 -0.0306 -0.1540 0.0856 159 LEU H O 2883 C CB . LEU B 171 ? 0.3332 0.6942 0.7936 0.0329 -0.1216 0.1473 159 LEU H CB 2884 C CG . LEU B 171 ? 0.3529 0.7101 0.8519 0.0191 -0.0942 0.1296 159 LEU H CG 2885 C CD1 . LEU B 171 ? 0.2510 0.6743 0.8294 0.0150 -0.1026 0.1373 159 LEU H CD1 2886 C CD2 . LEU B 171 ? 0.3451 0.6389 0.8281 0.0405 -0.0435 0.1319 159 LEU H CD2 2887 N N . THR B 172 ? 0.4185 0.8226 0.8235 -0.0557 -0.1952 0.0843 160 THR H N 2888 C CA . THR B 172 ? 0.4022 0.7727 0.7587 -0.0887 -0.1939 0.0503 160 THR H CA 2889 C C . THR B 172 ? 0.4308 0.8101 0.8299 -0.1072 -0.1739 0.0330 160 THR H C 2890 O O . THR B 172 ? 0.4313 0.7698 0.7990 -0.1255 -0.1584 0.0109 160 THR H O 2891 C CB . THR B 172 ? 0.4082 0.7796 0.7095 -0.1083 -0.2260 0.0368 160 THR H CB 2892 O OG1 . THR B 172 ? 0.4307 0.8614 0.7776 -0.1105 -0.2500 0.0421 160 THR H OG1 2893 C CG2 . THR B 172 ? 0.4523 0.7988 0.6942 -0.0948 -0.2406 0.0520 160 THR H CG2 2894 N N . SER B 173 ? 0.4828 0.9138 0.9531 -0.1018 -0.1724 0.0443 161 SER H N 2895 C CA . SER B 173 ? 0.4025 0.8453 0.9176 -0.1230 -0.1505 0.0293 161 SER H CA 2896 C C . SER B 173 ? 0.3035 0.6969 0.8271 -0.1135 -0.1079 0.0310 161 SER H C 2897 O O . SER B 173 ? 0.2909 0.6691 0.8279 -0.0829 -0.0905 0.0508 161 SER H O 2898 C CB . SER B 173 ? 0.3915 0.9063 0.9880 -0.1174 -0.1561 0.0420 161 SER H CB 2899 O OG . SER B 173 ? 0.3805 0.9437 0.9741 -0.1263 -0.1994 0.0373 161 SER H OG 2900 N N . GLY B 174 ? 0.2565 0.6177 0.7685 -0.1391 -0.0882 0.0090 162 GLY H N 2901 C CA . GLY B 174 ? 0.2586 0.5626 0.7701 -0.1281 -0.0437 0.0062 162 GLY H CA 2902 C C . GLY B 174 ? 0.3756 0.6139 0.8044 -0.1025 -0.0347 0.0035 162 GLY H C 2903 O O . GLY B 174 ? 0.5234 0.7118 0.9310 -0.0824 -0.0011 0.0050 162 GLY H O 2904 N N . VAL B 175 ? 0.3533 0.5914 0.7342 -0.1055 -0.0644 -0.0019 163 VAL H N 2905 C CA . VAL B 175 ? 0.3096 0.4994 0.6248 -0.0858 -0.0585 -0.0065 163 VAL H CA 2906 C C . VAL B 175 ? 0.3601 0.4990 0.6153 -0.0936 -0.0486 -0.0298 163 VAL H C 2907 O O . VAL B 175 ? 0.3663 0.5053 0.6029 -0.1171 -0.0609 -0.0437 163 VAL H O 2908 C CB . VAL B 175 ? 0.2431 0.4531 0.5380 -0.0826 -0.0873 0.0009 163 VAL H CB 2909 C CG1 . VAL B 175 ? 0.2690 0.4342 0.5030 -0.0708 -0.0791 -0.0100 163 VAL H CG1 2910 C CG2 . VAL B 175 ? 0.2499 0.4979 0.5939 -0.0636 -0.0919 0.0287 163 VAL H CG2 2911 N N . HIS B 176 ? 0.3174 0.4106 0.5390 -0.0726 -0.0262 -0.0333 164 HIS H N 2912 C CA . HIS B 176 ? 0.4360 0.4850 0.6015 -0.0691 -0.0190 -0.0504 164 HIS H CA 2913 C C . HIS B 176 ? 0.4898 0.5275 0.6211 -0.0490 -0.0243 -0.0534 164 HIS H C 2914 O O . HIS B 176 ? 0.5098 0.5325 0.6352 -0.0315 -0.0137 -0.0484 164 HIS H O 2915 C CB . HIS B 176 ? 0.4755 0.4778 0.6265 -0.0622 0.0116 -0.0534 164 HIS H CB 2916 C CG . HIS B 176 ? 0.4988 0.5005 0.6730 -0.0889 0.0231 -0.0590 164 HIS H CG 2917 N ND1 . HIS B 176 ? 0.3927 0.4049 0.6174 -0.0973 0.0431 -0.0509 164 HIS H ND1 2918 C CD2 . HIS B 176 ? 0.4960 0.4849 0.6499 -0.1124 0.0213 -0.0740 164 HIS H CD2 2919 C CE1 . HIS B 176 ? 0.4228 0.4351 0.6626 -0.1279 0.0507 -0.0623 164 HIS H CE1 2920 N NE2 . HIS B 176 ? 0.4821 0.4759 0.6741 -0.1384 0.0377 -0.0770 164 HIS H NE2 2921 N N . THR B 177 ? 0.4594 0.5036 0.5682 -0.0545 -0.0386 -0.0634 165 THR H N 2922 C CA . THR B 177 ? 0.4451 0.4850 0.5303 -0.0396 -0.0413 -0.0706 165 THR H CA 2923 C C . THR B 177 ? 0.3693 0.3834 0.4225 -0.0283 -0.0342 -0.0831 165 THR H C 2924 O O . THR B 177 ? 0.3838 0.3892 0.4231 -0.0383 -0.0328 -0.0907 165 THR H O 2925 C CB . THR B 177 ? 0.4167 0.4800 0.5024 -0.0500 -0.0549 -0.0720 165 THR H CB 2926 O OG1 . THR B 177 ? 0.4280 0.5086 0.5371 -0.0513 -0.0590 -0.0566 165 THR H OG1 2927 C CG2 . THR B 177 ? 0.3177 0.3813 0.3886 -0.0397 -0.0533 -0.0841 165 THR H CG2 2928 N N . PHE B 178 ? 0.3893 0.3875 0.4258 -0.0059 -0.0292 -0.0842 166 PHE H N 2929 C CA . PHE B 178 ? 0.4599 0.4318 0.4652 0.0142 -0.0225 -0.0903 166 PHE H CA 2930 C C . PHE B 178 ? 0.4597 0.4568 0.4661 0.0230 -0.0322 -0.1004 166 PHE H C 2931 O O . PHE B 178 ? 0.5193 0.5511 0.5464 0.0159 -0.0435 -0.1048 166 PHE H O 2932 C CB . PHE B 178 ? 0.4269 0.3702 0.4058 0.0377 -0.0170 -0.0852 166 PHE H CB 2933 C CG . PHE B 178 ? 0.5067 0.4152 0.4828 0.0315 0.0033 -0.0756 166 PHE H CG 2934 C CD1 . PHE B 178 ? 0.4740 0.3942 0.4760 0.0212 0.0059 -0.0681 166 PHE H CD1 2935 C CD2 . PHE B 178 ? 0.5118 0.3724 0.4614 0.0364 0.0257 -0.0739 166 PHE H CD2 2936 C CE1 . PHE B 178 ? 0.4994 0.3928 0.5101 0.0164 0.0295 -0.0589 166 PHE H CE1 2937 C CE2 . PHE B 178 ? 0.5031 0.3329 0.4575 0.0273 0.0502 -0.0668 166 PHE H CE2 2938 C CZ . PHE B 178 ? 0.4909 0.3416 0.4806 0.0176 0.0516 -0.0593 166 PHE H CZ 2939 N N . PRO B 179 ? 0.4876 0.4640 0.4735 0.0388 -0.0226 -0.1040 167 PRO H N 2940 C CA . PRO B 179 ? 0.4771 0.4819 0.4738 0.0536 -0.0273 -0.1121 167 PRO H CA 2941 C C . PRO B 179 ? 0.5340 0.5745 0.5437 0.0731 -0.0463 -0.1141 167 PRO H C 2942 O O . PRO B 179 ? 0.5138 0.5346 0.4995 0.0892 -0.0513 -0.1077 167 PRO H O 2943 C CB . PRO B 179 ? 0.4944 0.4576 0.4609 0.0755 -0.0076 -0.1104 167 PRO H CB 2944 C CG . PRO B 179 ? 0.5218 0.4358 0.4636 0.0537 0.0093 -0.1077 167 PRO H CG 2945 C CD . PRO B 179 ? 0.5109 0.4342 0.4656 0.0417 -0.0011 -0.1011 167 PRO H CD 2946 N N . ALA B 180 ? 0.5464 0.6362 0.5905 0.0688 -0.0554 -0.1244 168 ALA H N 2947 C CA . ALA B 180 ? 0.4779 0.6112 0.5407 0.0786 -0.0766 -0.1315 168 ALA H CA 2948 C C . ALA B 180 ? 0.4157 0.5562 0.4677 0.1190 -0.0871 -0.1276 168 ALA H C 2949 O O . ALA B 180 ? 0.4339 0.5590 0.4804 0.1412 -0.0731 -0.1221 168 ALA H O 2950 C CB . ALA B 180 ? 0.5020 0.6873 0.6111 0.0597 -0.0781 -0.1459 168 ALA H CB 2951 N N . VAL B 181 ? 0.4082 0.5671 0.4504 0.1297 -0.1114 -0.1299 169 VAL H N 2952 C CA . VAL B 181 ? 0.4604 0.6347 0.4896 0.1716 -0.1305 -0.1246 169 VAL H CA 2953 C C . VAL B 181 ? 0.4864 0.7490 0.5704 0.1700 -0.1601 -0.1407 169 VAL H C 2954 O O . VAL B 181 ? 0.4601 0.7501 0.5648 0.1350 -0.1687 -0.1563 169 VAL H O 2955 C CB . VAL B 181 ? 0.6019 0.7194 0.5608 0.1885 -0.1379 -0.1136 169 VAL H CB 2956 C CG1 . VAL B 181 ? 0.5541 0.6801 0.5030 0.1610 -0.1547 -0.1248 169 VAL H CG1 2957 C CG2 . VAL B 181 ? 0.7770 0.8975 0.7073 0.2394 -0.1566 -0.1027 169 VAL H CG2 2958 N N . LEU B 182 ? 0.5321 0.5505 0.6391 0.1197 0.0001 -0.0321 170 LEU H N 2959 C CA . LEU B 182 ? 0.4434 0.5085 0.5847 0.1251 -0.0128 -0.0406 170 LEU H CA 2960 C C . LEU B 182 ? 0.4791 0.5562 0.6067 0.1372 -0.0383 -0.0321 170 LEU H C 2961 O O . LEU B 182 ? 0.5508 0.6149 0.6671 0.1602 -0.0483 -0.0160 170 LEU H O 2962 C CB . LEU B 182 ? 0.4117 0.4949 0.5944 0.1433 -0.0069 -0.0480 170 LEU H CB 2963 C CG . LEU B 182 ? 0.4070 0.5500 0.6403 0.1487 -0.0171 -0.0578 170 LEU H CG 2964 C CD1 . LEU B 182 ? 0.4055 0.5776 0.6548 0.1198 -0.0066 -0.0682 170 LEU H CD1 2965 C CD2 . LEU B 182 ? 0.4299 0.5899 0.7053 0.1729 -0.0081 -0.0652 170 LEU H CD2 2966 N N . GLN B 183 ? 0.4277 0.5284 0.5548 0.1221 -0.0492 -0.0431 171 GLN H N 2967 C CA . GLN B 183 ? 0.4613 0.5805 0.5695 0.1314 -0.0760 -0.0434 171 GLN H CA 2968 C C . GLN B 183 ? 0.5351 0.7048 0.6870 0.1480 -0.0988 -0.0489 171 GLN H C 2969 O O . GLN B 183 ? 0.5432 0.7373 0.7471 0.1482 -0.0902 -0.0556 171 GLN H O 2970 C CB . GLN B 183 ? 0.5388 0.6627 0.6369 0.1089 -0.0799 -0.0616 171 GLN H CB 2971 C CG . GLN B 183 ? 0.5693 0.6511 0.6318 0.0961 -0.0587 -0.0565 171 GLN H CG 2972 C CD . GLN B 183 ? 0.6432 0.7252 0.7123 0.0754 -0.0584 -0.0758 171 GLN H CD 2973 O OE1 . GLN B 183 ? 0.7739 0.8375 0.8074 0.0742 -0.0566 -0.0798 171 GLN H OE1 2974 N NE2 . GLN B 183 ? 0.5986 0.7003 0.7170 0.0596 -0.0574 -0.0872 171 GLN H NE2 2975 N N . SER B 184 ? 0.6066 0.7986 0.7370 0.1632 -0.1281 -0.0465 172 SER H N 2976 C CA . SER B 184 ? 0.6029 0.8513 0.7751 0.1830 -0.1565 -0.0502 172 SER H CA 2977 C C . SER B 184 ? 0.5230 0.8249 0.7585 0.1596 -0.1646 -0.0809 172 SER H C 2978 O O . SER B 184 ? 0.5302 0.8891 0.8224 0.1707 -0.1829 -0.0880 172 SER H O 2979 C CB . SER B 184 ? 0.6963 0.9601 0.8196 0.2054 -0.1893 -0.0391 172 SER H CB 2980 O OG . SER B 184 ? 0.7458 1.0128 0.8302 0.1857 -0.1988 -0.0601 172 SER H OG 2981 N N . SER B 185 ? 0.4762 0.7596 0.7080 0.1273 -0.1502 -0.0972 173 SER H N 2982 C CA . SER B 185 ? 0.4817 0.8040 0.7762 0.0991 -0.1528 -0.1226 173 SER H CA 2983 C C . SER B 185 ? 0.4372 0.7688 0.7856 0.0889 -0.1219 -0.1171 173 SER H C 2984 O O . SER B 185 ? 0.4065 0.7763 0.8175 0.0660 -0.1182 -0.1311 173 SER H O 2985 C CB . SER B 185 ? 0.5037 0.7942 0.7743 0.0712 -0.1490 -0.1397 173 SER H CB 2986 O OG . SER B 185 ? 0.4947 0.7286 0.7300 0.0648 -0.1171 -0.1236 173 SER H OG 2987 N N . GLY B 186 ? 0.3763 0.6743 0.7004 0.1045 -0.0985 -0.0979 174 GLY H N 2988 C CA . GLY B 186 ? 0.3260 0.6327 0.6862 0.0980 -0.0671 -0.0954 174 GLY H CA 2989 C C . GLY B 186 ? 0.3817 0.6476 0.7144 0.0726 -0.0399 -0.0908 174 GLY H C 2990 O O . GLY B 186 ? 0.4139 0.6859 0.7625 0.0655 -0.0124 -0.0871 174 GLY H O 2991 N N . LEU B 187 ? 0.4198 0.6483 0.7099 0.0616 -0.0477 -0.0910 175 LEU H N 2992 C CA . LEU B 187 ? 0.4191 0.6097 0.6847 0.0421 -0.0262 -0.0842 175 LEU H CA 2993 C C . LEU B 187 ? 0.4609 0.6062 0.6694 0.0548 -0.0171 -0.0718 175 LEU H C 2994 O O . LEU B 187 ? 0.4311 0.5615 0.6090 0.0725 -0.0302 -0.0681 175 LEU H O 2995 C CB . LEU B 187 ? 0.3950 0.5725 0.6608 0.0223 -0.0374 -0.0954 175 LEU H CB 2996 C CG . LEU B 187 ? 0.4530 0.6695 0.7834 0.0016 -0.0470 -0.1114 175 LEU H CG 2997 C CD1 . LEU B 187 ? 0.4800 0.6712 0.8077 -0.0164 -0.0593 -0.1289 175 LEU H CD1 2998 C CD2 . LEU B 187 ? 0.4788 0.7159 0.8557 -0.0159 -0.0190 -0.0992 175 LEU H CD2 2999 N N . TYR B 188 ? 0.4524 0.5795 0.6486 0.0446 0.0052 -0.0637 176 TYR H N 3000 C CA . TYR B 188 ? 0.4107 0.5013 0.5630 0.0511 0.0134 -0.0554 176 TYR H CA 3001 C C . TYR B 188 ? 0.4310 0.4934 0.5542 0.0430 0.0095 -0.0525 176 TYR H C 3002 O O . TYR B 188 ? 0.4253 0.4901 0.5619 0.0314 0.0043 -0.0579 176 TYR H O 3003 C CB . TYR B 188 ? 0.3733 0.4668 0.5240 0.0457 0.0351 -0.0522 176 TYR H CB 3004 C CG . TYR B 188 ? 0.4018 0.5186 0.5740 0.0587 0.0438 -0.0601 176 TYR H CG 3005 C CD1 . TYR B 188 ? 0.3907 0.4855 0.5485 0.0756 0.0444 -0.0646 176 TYR H CD1 3006 C CD2 . TYR B 188 ? 0.3851 0.5452 0.5975 0.0542 0.0539 -0.0639 176 TYR H CD2 3007 C CE1 . TYR B 188 ? 0.3435 0.4549 0.5247 0.0912 0.0535 -0.0761 176 TYR H CE1 3008 C CE2 . TYR B 188 ? 0.2968 0.4830 0.5323 0.0698 0.0649 -0.0744 176 TYR H CE2 3009 C CZ . TYR B 188 ? 0.3083 0.4680 0.5274 0.0901 0.0640 -0.0822 176 TYR H CZ 3010 O OH . TYR B 188 ? 0.3058 0.4866 0.5514 0.1092 0.0759 -0.0968 176 TYR H OH 3011 N N . SER B 189 ? 0.5036 0.5394 0.5929 0.0490 0.0136 -0.0457 177 SER H N 3012 C CA . SER B 189 ? 0.4796 0.4947 0.5449 0.0446 0.0139 -0.0432 177 SER H CA 3013 C C . SER B 189 ? 0.4829 0.4797 0.5262 0.0462 0.0242 -0.0345 177 SER H C 3014 O O . SER B 189 ? 0.5317 0.5194 0.5675 0.0544 0.0251 -0.0308 177 SER H O 3015 C CB . SER B 189 ? 0.4471 0.4612 0.4960 0.0526 -0.0010 -0.0499 177 SER H CB 3016 O OG . SER B 189 ? 0.4663 0.4646 0.4946 0.0503 0.0029 -0.0521 177 SER H OG 3017 N N . LEU B 190 ? 0.4553 0.4468 0.4943 0.0383 0.0313 -0.0310 178 LEU H N 3018 C CA . LEU B 190 ? 0.4626 0.4449 0.4890 0.0370 0.0386 -0.0256 178 LEU H CA 3019 C C . LEU B 190 ? 0.4689 0.4493 0.4909 0.0354 0.0418 -0.0224 178 LEU H C 3020 O O . LEU B 190 ? 0.4338 0.4140 0.4623 0.0360 0.0393 -0.0251 178 LEU H O 3021 C CB . LEU B 190 ? 0.4133 0.4047 0.4460 0.0307 0.0440 -0.0275 178 LEU H CB 3022 C CG . LEU B 190 ? 0.4408 0.4505 0.4789 0.0244 0.0465 -0.0241 178 LEU H CG 3023 C CD1 . LEU B 190 ? 0.4493 0.4618 0.4856 0.0220 0.0457 -0.0152 178 LEU H CD1 3024 C CD2 . LEU B 190 ? 0.4240 0.4471 0.4582 0.0223 0.0513 -0.0322 178 LEU H CD2 3025 N N . SER B 191 ? 0.4975 0.4762 0.5150 0.0332 0.0484 -0.0180 179 SER H N 3026 C CA . SER B 191 ? 0.4897 0.4757 0.5115 0.0335 0.0538 -0.0153 179 SER H CA 3027 C C . SER B 191 ? 0.4744 0.4771 0.5112 0.0255 0.0545 -0.0128 179 SER H C 3028 O O . SER B 191 ? 0.5250 0.5286 0.5629 0.0179 0.0532 -0.0165 179 SER H O 3029 C CB . SER B 191 ? 0.5110 0.4924 0.5184 0.0374 0.0627 -0.0120 179 SER H CB 3030 O OG . SER B 191 ? 0.5639 0.5365 0.5694 0.0311 0.0679 -0.0045 179 SER H OG 3031 N N . SER B 192 ? 0.4225 0.4402 0.4727 0.0290 0.0549 -0.0091 180 SER H N 3032 C CA . SER B 192 ? 0.3772 0.4214 0.4439 0.0237 0.0510 -0.0065 180 SER H CA 3033 C C . SER B 192 ? 0.4160 0.4788 0.5038 0.0292 0.0572 -0.0037 180 SER H C 3034 O O . SER B 192 ? 0.4385 0.4999 0.5336 0.0427 0.0585 -0.0006 180 SER H O 3035 C CB . SER B 192 ? 0.3918 0.4469 0.4577 0.0268 0.0413 0.0008 180 SER H CB 3036 O OG . SER B 192 ? 0.4363 0.5246 0.5117 0.0233 0.0327 0.0023 180 SER H OG 3037 N N . VAL B 193 ? 0.4028 0.4827 0.5063 0.0185 0.0629 -0.0059 181 VAL H N 3038 C CA . VAL B 193 ? 0.3571 0.4639 0.4878 0.0227 0.0733 -0.0034 181 VAL H CA 3039 C C . VAL B 193 ? 0.3659 0.5176 0.5335 0.0152 0.0634 -0.0044 181 VAL H C 3040 O O . VAL B 193 ? 0.4492 0.6085 0.6156 0.0023 0.0499 -0.0107 181 VAL H O 3041 C CB . VAL B 193 ? 0.4010 0.4992 0.5269 0.0150 0.0932 -0.0012 181 VAL H CB 3042 C CG1 . VAL B 193 ? 0.4465 0.5088 0.5313 0.0246 0.0979 -0.0006 181 VAL H CG1 3043 C CG2 . VAL B 193 ? 0.3608 0.4561 0.4984 -0.0077 0.0935 -0.0021 181 VAL H CG2 3044 N N . VAL B 194 ? 0.3790 0.5654 0.5809 0.0247 0.0695 -0.0013 182 VAL H N 3045 C CA . VAL B 194 ? 0.3729 0.6144 0.6198 0.0188 0.0582 -0.0028 182 VAL H CA 3046 C C . VAL B 194 ? 0.3683 0.6480 0.6601 0.0218 0.0773 -0.0019 182 VAL H C 3047 O O . VAL B 194 ? 0.3717 0.6473 0.6641 0.0434 0.0915 0.0010 182 VAL H O 3048 C CB . VAL B 194 ? 0.4633 0.7255 0.7138 0.0373 0.0350 0.0055 182 VAL H CB 3049 C CG1 . VAL B 194 ? 0.4258 0.6625 0.6703 0.0647 0.0421 0.0156 182 VAL H CG1 3050 C CG2 . VAL B 194 ? 0.4219 0.7527 0.7228 0.0366 0.0198 0.0047 182 VAL H CG2 3051 N N . THR B 195 ? 0.3764 0.6939 0.7088 -0.0012 0.0796 -0.0071 183 THR H N 3052 C CA . THR B 195 ? 0.4216 0.7885 0.8078 -0.0019 0.1001 -0.0052 183 THR H CA 3053 C C . THR B 195 ? 0.4490 0.8831 0.8896 0.0136 0.0809 -0.0060 183 THR H C 3054 O O . THR B 195 ? 0.4173 0.8826 0.8751 0.0033 0.0522 -0.0120 183 THR H O 3055 C CB . THR B 195 ? 0.4184 0.7967 0.8351 -0.0380 0.1151 -0.0076 183 THR H CB 3056 O OG1 . THR B 195 ? 0.4985 0.8871 0.9303 -0.0608 0.0878 -0.0215 183 THR H OG1 3057 C CG2 . THR B 195 ? 0.3982 0.7137 0.7656 -0.0465 0.1385 0.0017 183 THR H CG2 3058 N N . VAL B 196 ? 0.4864 0.9444 0.9529 0.0410 0.0960 -0.0015 184 VAL H N 3059 C CA . VAL B 196 ? 0.3936 0.9155 0.9176 0.0642 0.0792 0.0013 184 VAL H CA 3060 C C . VAL B 196 ? 0.3721 0.9556 0.9630 0.0691 0.1075 -0.0016 184 VAL H C 3061 O O . VAL B 196 ? 0.3937 0.9594 0.9706 0.0620 0.1435 -0.0032 184 VAL H O 3062 C CB . VAL B 196 ? 0.2718 0.7597 0.7704 0.1032 0.0681 0.0109 184 VAL H CB 3063 C CG1 . VAL B 196 ? 0.3025 0.7327 0.7366 0.0966 0.0467 0.0166 184 VAL H CG1 3064 C CG2 . VAL B 196 ? 0.2850 0.7379 0.7693 0.1242 0.1006 0.0056 184 VAL H CG2 3065 N N . PRO B 197 ? 0.3633 1.0260 1.0276 0.0821 0.0917 -0.0010 185 PRO H N 3066 C CA . PRO B 197 ? 0.3378 1.0529 1.0527 0.0905 0.1169 -0.0091 185 PRO H CA 3067 C C . PRO B 197 ? 0.3816 1.0550 1.0634 0.1241 0.1448 -0.0129 185 PRO H C 3068 O O . PRO B 197 ? 0.4539 1.0838 1.1103 0.1552 0.1319 -0.0093 185 PRO H O 3069 C CB . PRO B 197 ? 0.3432 1.1176 1.1238 0.1056 0.0829 -0.0121 185 PRO H CB 3070 C CG . PRO B 197 ? 0.3379 1.1177 1.1096 0.0841 0.0443 -0.0034 185 PRO H CG 3071 C CD . PRO B 197 ? 0.3336 1.0394 1.0207 0.0831 0.0463 0.0015 185 PRO H CD 3072 N N . SER B 198 ? 0.4225 1.1096 1.1020 0.1165 0.1820 -0.0200 186 SER H N 3073 C CA . SER B 198 ? 0.5115 1.1624 1.1519 0.1438 0.2094 -0.0308 186 SER H CA 3074 C C . SER B 198 ? 0.5329 1.2096 1.2120 0.1854 0.2029 -0.0435 186 SER H C 3075 O O . SER B 198 ? 0.5463 1.1869 1.1956 0.2131 0.2176 -0.0574 186 SER H O 3076 C CB . SER B 198 ? 0.6016 1.2690 1.2255 0.1228 0.2500 -0.0329 186 SER H CB 3077 O OG . SER B 198 ? 0.7016 1.3327 1.2749 0.1462 0.2740 -0.0474 186 SER H OG 3078 N N . SER B 199 ? 0.5334 1.2723 1.2800 0.1902 0.1789 -0.0413 187 SER H N 3079 C CA . SER B 199 ? 0.5859 1.3497 1.3762 0.2308 0.1702 -0.0504 187 SER H CA 3080 C C . SER B 199 ? 0.5951 1.3056 1.3715 0.2616 0.1371 -0.0398 187 SER H C 3081 O O . SER B 199 ? 0.6454 1.3550 1.4464 0.3004 0.1301 -0.0448 187 SER H O 3082 C CB . SER B 199 ? 0.5850 1.4368 1.4542 0.2225 0.1576 -0.0516 187 SER H CB 3083 O OG . SER B 199 ? 0.5417 1.4061 1.4322 0.2015 0.1199 -0.0395 187 SER H OG 3084 N N . SER B 200 ? 0.5600 1.2247 1.2943 0.2444 0.1176 -0.0225 188 SER H N 3085 C CA . SER B 200 ? 0.5815 1.1966 1.2957 0.2679 0.0864 -0.0043 188 SER H CA 3086 C C . SER B 200 ? 0.6342 1.1593 1.2889 0.2819 0.1011 -0.0086 188 SER H C 3087 O O . SER B 200 ? 0.6863 1.1585 1.3206 0.2985 0.0809 0.0072 188 SER H O 3088 C CB . SER B 200 ? 0.5629 1.1861 1.2628 0.2431 0.0553 0.0168 188 SER H CB 3089 O OG . SER B 200 ? 0.5830 1.1692 1.2323 0.2133 0.0703 0.0162 188 SER H OG 3090 N N . LEU B 201 ? 0.6350 1.1435 1.2609 0.2734 0.1356 -0.0300 189 LEU H N 3091 C CA . LEU B 201 ? 0.6311 1.0585 1.1991 0.2816 0.1478 -0.0415 189 LEU H CA 3092 C C . LEU B 201 ? 0.6973 1.0919 1.2759 0.3216 0.1464 -0.0544 189 LEU H C 3093 O O . LEU B 201 ? 0.7571 1.0789 1.2956 0.3301 0.1484 -0.0641 189 LEU H O 3094 C CB . LEU B 201 ? 0.5939 1.0201 1.1217 0.2621 0.1820 -0.0610 189 LEU H CB 3095 C CG . LEU B 201 ? 0.4844 0.9217 0.9903 0.2222 0.1868 -0.0472 189 LEU H CG 3096 C CD1 . LEU B 201 ? 0.4723 0.8998 0.9295 0.2079 0.2202 -0.0615 189 LEU H CD1 3097 C CD2 . LEU B 201 ? 0.4179 0.8044 0.8944 0.2126 0.1634 -0.0301 189 LEU H CD2 3098 N N . GLY B 202 ? 0.7723 1.2205 1.4076 0.3458 0.1421 -0.0557 190 GLY H N 3099 C CA . GLY B 202 ? 0.8424 1.2628 1.4929 0.3877 0.1419 -0.0670 190 GLY H CA 3100 C C . GLY B 202 ? 0.8760 1.2725 1.5523 0.4090 0.1074 -0.0390 190 GLY H C 3101 O O . GLY B 202 ? 0.9675 1.3238 1.6536 0.4433 0.1048 -0.0426 190 GLY H O 3102 N N . THR B 203 ? 0.8077 1.2282 1.4913 0.3894 0.0813 -0.0094 191 THR H N 3103 C CA . THR B 203 ? 0.8343 1.2414 1.5342 0.4085 0.0468 0.0234 191 THR H CA 3104 C C . THR B 203 ? 0.8117 1.1780 1.4655 0.3845 0.0275 0.0537 191 THR H C 3105 O O . THR B 203 ? 0.8809 1.1809 1.5128 0.3960 0.0157 0.0749 191 THR H O 3106 C CB . THR B 203 ? 0.8644 1.3641 1.6265 0.4180 0.0254 0.0330 191 THR H CB 3107 O OG1 . THR B 203 ? 0.8348 1.3957 1.6004 0.3797 0.0233 0.0322 191 THR H OG1 3108 C CG2 . THR B 203 ? 0.8866 1.4317 1.7024 0.4476 0.0433 0.0056 191 THR H CG2 3109 N N . GLN B 204 ? 0.6982 1.1050 1.3382 0.3505 0.0261 0.0558 192 GLN H N 3110 C CA . GLN B 204 ? 0.6106 0.9976 1.2091 0.3295 0.0063 0.0835 192 GLN H CA 3111 C C . GLN B 204 ? 0.5684 0.8693 1.1144 0.3183 0.0210 0.0819 192 GLN H C 3112 O O . GLN B 204 ? 0.5426 0.8211 1.0724 0.3069 0.0477 0.0537 192 GLN H O 3113 C CB . GLN B 204 ? 0.5632 1.0195 1.1645 0.2965 0.0009 0.0801 192 GLN H CB 3114 C CG . GLN B 204 ? 0.5698 1.0171 1.1248 0.2760 -0.0202 0.1036 192 GLN H CG 3115 C CD . GLN B 204 ? 0.6248 1.0776 1.1720 0.2939 -0.0549 0.1372 192 GLN H CD 3116 O OE1 . GLN B 204 ? 0.7008 1.1992 1.2881 0.3131 -0.0728 0.1420 192 GLN H OE1 3117 N NE2 . GLN B 204 ? 0.5911 0.9987 1.0853 0.2880 -0.0635 0.1618 192 GLN H NE2 3118 N N . THR B 205 ? 0.5516 0.8075 1.0701 0.3203 0.0031 0.1129 193 THR H N 3119 C CA . THR B 205 ? 0.5595 0.7382 1.0353 0.3060 0.0138 0.1138 193 THR H CA 3120 C C . THR B 205 ? 0.5151 0.7128 0.9541 0.2752 0.0094 0.1220 193 THR H C 3121 O O . THR B 205 ? 0.5235 0.7660 0.9507 0.2677 -0.0138 0.1445 193 THR H O 3122 C CB . THR B 205 ? 0.5556 0.6713 1.0222 0.3200 0.0018 0.1445 193 THR H CB 3123 O OG1 . THR B 205 ? 0.6101 0.6916 1.1067 0.3470 0.0099 0.1293 193 THR H OG1 3124 C CG2 . THR B 205 ? 0.5531 0.6008 0.9805 0.2974 0.0104 0.1489 193 THR H CG2 3125 N N . TYR B 206 ? 0.4540 0.6134 0.8552 0.2493 0.0275 0.0939 194 TYR H N 3126 C CA . TYR B 206 ? 0.4559 0.6167 0.8041 0.2123 0.0226 0.0910 194 TYR H CA 3127 C C . TYR B 206 ? 0.5348 0.6255 0.8451 0.1994 0.0268 0.0938 194 TYR H C 3128 O O . TYR B 206 ? 0.5641 0.6095 0.8710 0.1989 0.0426 0.0704 194 TYR H O 3129 C CB . TYR B 206 ? 0.3813 0.5682 0.7207 0.1911 0.0385 0.0600 194 TYR H CB 3130 C CG . TYR B 206 ? 0.3888 0.6508 0.7730 0.1957 0.0370 0.0568 194 TYR H CG 3131 C CD1 . TYR B 206 ? 0.3470 0.6624 0.7333 0.1786 0.0167 0.0651 194 TYR H CD1 3132 C CD2 . TYR B 206 ? 0.4831 0.7675 0.9113 0.2164 0.0564 0.0419 194 TYR H CD2 3133 C CE1 . TYR B 206 ? 0.3787 0.7681 0.8160 0.1788 0.0134 0.0595 194 TYR H CE1 3134 C CE2 . TYR B 206 ? 0.5150 0.8766 0.9947 0.2188 0.0572 0.0395 194 TYR H CE2 3135 C CZ . TYR B 206 ? 0.4565 0.8708 0.9437 0.1982 0.0345 0.0488 194 TYR H CZ 3136 O OH . TYR B 206 ? 0.4162 0.9124 0.9642 0.1966 0.0334 0.0438 194 TYR H OH 3137 N N . ILE B 207 ? 0.5489 0.6371 0.8314 0.1883 0.0126 0.1206 195 ILE H N 3138 C CA . ILE B 207 ? 0.5542 0.5860 0.8093 0.1736 0.0179 0.1272 195 ILE H CA 3139 C C . ILE B 207 ? 0.5173 0.5634 0.7266 0.1430 0.0163 0.1198 195 ILE H C 3140 O O . ILE B 207 ? 0.4449 0.5375 0.6369 0.1363 0.0041 0.1280 195 ILE H O 3141 C CB . ILE B 207 ? 0.5067 0.5139 0.7712 0.1890 0.0098 0.1715 195 ILE H CB 3142 C CG1 . ILE B 207 ? 0.5190 0.4995 0.8358 0.2231 0.0124 0.1784 195 ILE H CG1 3143 C CG2 . ILE B 207 ? 0.5154 0.4705 0.7590 0.1683 0.0187 0.1799 195 ILE H CG2 3144 C CD1 . ILE B 207 ? 0.5958 0.5479 0.9252 0.2412 0.0041 0.2284 195 ILE H CD1 3145 N N . CYS B 208 ? 0.4726 0.4803 0.6655 0.1262 0.0276 0.1005 196 CYS H N 3146 C CA . CYS B 208 ? 0.4941 0.5079 0.6508 0.1014 0.0283 0.0927 196 CYS H CA 3147 C C . CYS B 208 ? 0.4842 0.4845 0.6277 0.0944 0.0273 0.1215 196 CYS H C 3148 O O . CYS B 208 ? 0.5435 0.5011 0.7045 0.0956 0.0338 0.1320 196 CYS H O 3149 C CB . CYS B 208 ? 0.4419 0.4283 0.5916 0.0903 0.0386 0.0614 196 CYS H CB 3150 S SG . CYS B 208 ? 1.2252 1.2282 1.3403 0.0680 0.0393 0.0447 196 CYS H SG 3151 N N . ASN B 209 ? 0.4630 0.4998 0.5769 0.0862 0.0210 0.1330 197 ASN H N 3152 C CA . ASN B 209 ? 0.5203 0.5525 0.6155 0.0792 0.0251 0.1618 197 ASN H CA 3153 C C . ASN B 209 ? 0.5563 0.5928 0.6284 0.0579 0.0344 0.1433 197 ASN H C 3154 O O . ASN B 209 ? 0.5612 0.6346 0.6033 0.0520 0.0310 0.1354 197 ASN H O 3155 C CB . ASN B 209 ? 0.6025 0.6783 0.6746 0.0899 0.0123 0.1920 197 ASN H CB 3156 C CG . ASN B 209 ? 0.7165 0.7997 0.8167 0.1153 -0.0008 0.2107 197 ASN H CG 3157 O OD1 . ASN B 209 ? 0.7272 0.8588 0.8265 0.1231 -0.0167 0.2031 197 ASN H OD1 3158 N ND2 . ASN B 209 ? 0.7860 0.8220 0.9181 0.1286 0.0056 0.2335 197 ASN H ND2 3159 N N . VAL B 210 ? 0.5587 0.5597 0.6488 0.0475 0.0451 0.1336 198 VAL H N 3160 C CA . VAL B 210 ? 0.4947 0.5030 0.5738 0.0310 0.0526 0.1142 198 VAL H CA 3161 C C . VAL B 210 ? 0.5427 0.5582 0.6170 0.0202 0.0654 0.1399 198 VAL H C 3162 O O . VAL B 210 ? 0.6091 0.5964 0.7087 0.0161 0.0730 0.1634 198 VAL H O 3163 C CB . VAL B 210 ? 0.4435 0.4223 0.5457 0.0254 0.0539 0.0864 198 VAL H CB 3164 C CG1 . VAL B 210 ? 0.4291 0.4227 0.5244 0.0130 0.0581 0.0679 198 VAL H CG1 3165 C CG2 . VAL B 210 ? 0.3880 0.3629 0.4900 0.0366 0.0466 0.0650 198 VAL H CG2 3166 N N . ASN B 211 ? 0.4790 0.5317 0.5235 0.0150 0.0701 0.1343 199 ASN H N 3167 C CA . ASN B 211 ? 0.4946 0.5657 0.5305 0.0051 0.0873 0.1563 199 ASN H CA 3168 C C . ASN B 211 ? 0.4687 0.5527 0.5153 -0.0064 0.0979 0.1291 199 ASN H C 3169 O O . ASN B 211 ? 0.4363 0.5342 0.4693 -0.0025 0.0920 0.0976 199 ASN H O 3170 C CB . ASN B 211 ? 0.5914 0.7054 0.5787 0.0125 0.0867 0.1738 199 ASN H CB 3171 C CG . ASN B 211 ? 0.6581 0.7669 0.6378 0.0246 0.0796 0.2173 199 ASN H CG 3172 O OD1 . ASN B 211 ? 0.7759 0.8463 0.7889 0.0313 0.0724 0.2271 199 ASN H OD1 3173 N ND2 . ASN B 211 ? 0.6344 0.7835 0.5686 0.0302 0.0813 0.2433 199 ASN H ND2 3174 N N . HIS B 212 ? 0.5026 0.5819 0.5804 -0.0202 0.1135 0.1424 200 HIS H N 3175 C CA . HIS B 212 ? 0.4925 0.5961 0.5886 -0.0294 0.1246 0.1209 200 HIS H CA 3176 C C . HIS B 212 ? 0.5049 0.6386 0.6059 -0.0415 0.1511 0.1500 200 HIS H C 3177 O O . HIS B 212 ? 0.5401 0.6615 0.6861 -0.0583 0.1625 0.1676 200 HIS H O 3178 C CB . HIS B 212 ? 0.5643 0.6431 0.7082 -0.0372 0.1155 0.0985 200 HIS H CB 3179 C CG . HIS B 212 ? 0.6206 0.7299 0.7858 -0.0403 0.1193 0.0729 200 HIS H CG 3180 N ND1 . HIS B 212 ? 0.6511 0.7637 0.8695 -0.0544 0.1197 0.0642 200 HIS H ND1 3181 C CD2 . HIS B 212 ? 0.5656 0.7042 0.7114 -0.0295 0.1216 0.0525 200 HIS H CD2 3182 C CE1 . HIS B 212 ? 0.5926 0.7410 0.8238 -0.0498 0.1212 0.0428 200 HIS H CE1 3183 N NE2 . HIS B 212 ? 0.5219 0.6823 0.7095 -0.0335 0.1237 0.0358 200 HIS H NE2 3184 N N . LYS B 213 ? 0.5517 0.7264 0.6068 -0.0342 0.1621 0.1533 201 LYS H N 3185 C CA . LYS B 213 ? 0.4831 0.6974 0.5290 -0.0429 0.1921 0.1818 201 LYS H CA 3186 C C . LYS B 213 ? 0.4991 0.7342 0.6025 -0.0596 0.2135 0.1757 201 LYS H C 3187 O O . LYS B 213 ? 0.5419 0.7853 0.6695 -0.0766 0.2372 0.2125 201 LYS H O 3188 C CB . LYS B 213 ? 0.5019 0.7632 0.4848 -0.0291 0.1980 0.1678 201 LYS H CB 3189 C CG . LYS B 213 ? 0.5557 0.8678 0.5138 -0.0343 0.2322 0.1954 201 LYS H CG 3190 C CD . LYS B 213 ? 0.6144 0.9730 0.5047 -0.0186 0.2348 0.1697 201 LYS H CD 3191 C CE . LYS B 213 ? 0.7413 1.1334 0.6056 -0.0222 0.2615 0.1805 201 LYS H CE 3192 N NZ . LYS B 213 ? 0.8610 1.2399 0.7069 -0.0295 0.2663 0.2371 201 LYS H NZ 3193 N N . PRO B 214 ? 0.4794 0.7254 0.6094 -0.0551 0.2054 0.1323 202 PRO H N 3194 C CA . PRO B 214 ? 0.4557 0.7352 0.6461 -0.0691 0.2245 0.1269 202 PRO H CA 3195 C C . PRO B 214 ? 0.5054 0.7591 0.7603 -0.0938 0.2247 0.1468 202 PRO H C 3196 O O . PRO B 214 ? 0.6070 0.8943 0.9128 -0.1130 0.2484 0.1587 202 PRO H O 3197 C CB . PRO B 214 ? 0.3874 0.6728 0.5948 -0.0543 0.2060 0.0797 202 PRO H CB 3198 C CG . PRO B 214 ? 0.5402 0.8115 0.6846 -0.0336 0.1926 0.0625 202 PRO H CG 3199 C CD . PRO B 214 ? 0.3980 0.6340 0.5076 -0.0368 0.1826 0.0909 202 PRO H CD 3200 N N . SER B 215 ? 0.3922 0.7077 0.9861 0.0083 0.1647 0.2906 203 SER H N 3201 C CA . SER B 215 ? 0.3880 0.7636 1.0648 -0.0123 0.1259 0.2692 203 SER H CA 3202 C C . SER B 215 ? 0.4232 0.7343 1.0839 -0.0527 0.1177 0.2579 203 SER H C 3203 O O . SER B 215 ? 0.3779 0.7133 1.0907 -0.0746 0.0883 0.2367 203 SER H O 3204 C CB . SER B 215 ? 0.3510 0.7608 1.0118 0.0158 0.0832 0.2483 203 SER H CB 3205 O OG . SER B 215 ? 0.4170 0.7592 0.9947 0.0222 0.0820 0.2457 203 SER H OG 3206 N N . ASN B 216 ? 0.3640 0.5885 0.9392 -0.0577 0.1386 0.2660 204 ASN H N 3207 C CA . ASN B 216 ? 0.4488 0.6097 0.9879 -0.0818 0.1280 0.2560 204 ASN H CA 3208 C C . ASN B 216 ? 0.3630 0.5270 0.9206 -0.0849 0.0986 0.2490 204 ASN H C 3209 O O . ASN B 216 ? 0.4012 0.5440 0.9810 -0.1063 0.0827 0.2372 204 ASN H O 3210 C CB . ASN B 216 ? 0.4189 0.5769 0.9969 -0.1104 0.1327 0.2465 204 ASN H CB 3211 C CG . ASN B 216 ? 0.4909 0.5726 1.0066 -0.1274 0.1330 0.2424 204 ASN H CG 3212 O OD1 . ASN B 216 ? 0.5303 0.5661 0.9642 -0.1189 0.1384 0.2460 204 ASN H OD1 3213 N ND2 . ASN B 216 ? 0.4870 0.5579 1.0388 -0.1528 0.1257 0.2319 204 ASN H ND2 3214 N N . THR B 217 ? 0.3378 0.5187 0.8725 -0.0599 0.0930 0.2511 205 THR H N 3215 C CA . THR B 217 ? 0.3759 0.5524 0.8957 -0.0493 0.0600 0.2269 205 THR H CA 3216 C C . THR B 217 ? 0.3891 0.5174 0.8449 -0.0411 0.0654 0.2340 205 THR H C 3217 O O . THR B 217 ? 0.4107 0.5311 0.8209 -0.0285 0.0876 0.2476 205 THR H O 3218 C CB . THR B 217 ? 0.3273 0.5590 0.8520 -0.0202 0.0407 0.2093 205 THR H CB 3219 O OG1 . THR B 217 ? 0.5077 0.8008 1.1021 -0.0289 0.0277 0.1998 205 THR H OG1 3220 C CG2 . THR B 217 ? 0.5626 0.7801 1.0627 -0.0108 0.0122 0.1827 205 THR H CG2 3221 N N . LYS B 218 ? 0.4634 0.5605 0.9189 -0.0489 0.0471 0.2239 206 LYS H N 3222 C CA . LYS B 218 ? 0.4788 0.5490 0.8908 -0.0381 0.0457 0.2254 206 LYS H CA 3223 C C . LYS B 218 ? 0.4923 0.5632 0.9124 -0.0241 0.0216 0.1977 206 LYS H C 3224 O O . LYS B 218 ? 0.5266 0.5832 0.9783 -0.0339 0.0057 0.1846 206 LYS H O 3225 C CB . LYS B 218 ? 0.5840 0.6116 0.9822 -0.0555 0.0508 0.2472 206 LYS H CB 3226 C CG . LYS B 218 ? 0.6498 0.6693 0.9863 -0.0576 0.0694 0.2476 206 LYS H CG 3227 C CD . LYS B 218 ? 0.6723 0.6566 0.9664 -0.0667 0.0631 0.2492 206 LYS H CD 3228 C CE . LYS B 218 ? 0.7448 0.7109 0.9699 -0.0751 0.0801 0.2425 206 LYS H CE 3229 N NZ . LYS B 218 ? 0.8195 0.7510 0.9990 -0.0863 0.0732 0.2476 206 LYS H NZ 3230 N N . VAL B 219 ? 0.4459 0.5258 0.8325 -0.0029 0.0243 0.1876 207 VAL H N 3231 C CA . VAL B 219 ? 0.4181 0.4934 0.8031 0.0122 0.0088 0.1607 207 VAL H CA 3232 C C . VAL B 219 ? 0.4604 0.5236 0.8212 0.0231 0.0184 0.1618 207 VAL H C 3233 O O . VAL B 219 ? 0.4568 0.5277 0.7844 0.0261 0.0379 0.1714 207 VAL H O 3234 C CB . VAL B 219 ? 0.4399 0.5417 0.8073 0.0298 0.0027 0.1406 207 VAL H CB 3235 C CG1 . VAL B 219 ? 0.3817 0.4678 0.7346 0.0437 -0.0084 0.1112 207 VAL H CG1 3236 C CG2 . VAL B 219 ? 0.3616 0.4939 0.7657 0.0188 -0.0123 0.1366 207 VAL H CG2 3237 N N . ASP B 220 ? 0.5263 0.5707 0.9064 0.0284 0.0072 0.1510 208 ASP H N 3238 C CA . ASP B 220 ? 0.4553 0.5015 0.8281 0.0420 0.0150 0.1476 208 ASP H CA 3239 C C . ASP B 220 ? 0.4597 0.4990 0.8257 0.0615 0.0152 0.1164 208 ASP H C 3240 O O . ASP B 220 ? 0.5595 0.5754 0.9428 0.0643 0.0025 0.0999 208 ASP H O 3241 C CB . ASP B 220 ? 0.4794 0.5125 0.8810 0.0398 0.0053 0.1649 208 ASP H CB 3242 C CG . ASP B 220 ? 0.5526 0.5891 0.9432 0.0205 0.0076 0.1957 208 ASP H CG 3243 O OD1 . ASP B 220 ? 0.5673 0.6202 0.9268 0.0111 0.0238 0.2012 208 ASP H OD1 3244 O OD2 . ASP B 220 ? 0.6306 0.6452 1.0355 0.0151 -0.0040 0.2147 208 ASP H OD2 3245 N N . LYS B 221 ? 0.4243 0.4758 0.7575 0.0727 0.0341 0.1072 209 LYS H N 3246 C CA . LYS B 221 ? 0.4760 0.5142 0.7886 0.0912 0.0405 0.0778 209 LYS H CA 3247 C C . LYS B 221 ? 0.5211 0.5664 0.8402 0.1020 0.0621 0.0717 209 LYS H C 3248 O O . LYS B 221 ? 0.5278 0.5917 0.8287 0.0969 0.0830 0.0796 209 LYS H O 3249 C CB . LYS B 221 ? 0.4825 0.5224 0.7407 0.0982 0.0471 0.0691 209 LYS H CB 3250 C CG . LYS B 221 ? 0.5415 0.5592 0.7604 0.1167 0.0540 0.0389 209 LYS H CG 3251 C CD . LYS B 221 ? 0.5859 0.5816 0.8224 0.1156 0.0308 0.0159 209 LYS H CD 3252 C CE . LYS B 221 ? 0.6323 0.6426 0.8760 0.1019 0.0013 0.0169 209 LYS H CE 3253 N NZ . LYS B 221 ? 0.7174 0.7020 0.9728 0.0929 -0.0193 -0.0109 209 LYS H NZ 3254 N N . LYS B 222 ? 0.5159 0.5459 0.8637 0.1158 0.0602 0.0565 210 LYS H N 3255 C CA . LYS B 222 ? 0.4859 0.5302 0.8536 0.1297 0.0825 0.0477 210 LYS H CA 3256 C C . LYS B 222 ? 0.5718 0.6001 0.8875 0.1402 0.1107 0.0216 210 LYS H C 3257 O O . LYS B 222 ? 0.6443 0.6360 0.9248 0.1492 0.1075 -0.0002 210 LYS H O 3258 C CB . LYS B 222 ? 0.4666 0.4955 0.8847 0.1472 0.0752 0.0430 210 LYS H CB 3259 C CG . LYS B 222 ? 0.5135 0.5695 0.9703 0.1660 0.0985 0.0357 210 LYS H CG 3260 C CD . LYS B 222 ? 0.5167 0.5527 1.0244 0.1912 0.0935 0.0348 210 LYS H CD 3261 C CE . LYS B 222 ? 0.5368 0.6127 1.0965 0.2141 0.1181 0.0286 210 LYS H CE 3262 N NZ . LYS B 222 ? 0.5980 0.6543 1.2110 0.2466 0.1162 0.0322 210 LYS H NZ 3263 N N . VAL B 223 ? 0.5520 0.6039 0.8573 0.1364 0.1394 0.0228 211 VAL H N 3264 C CA . VAL B 223 ? 0.5623 0.5908 0.8106 0.1455 0.1741 0.0006 211 VAL H CA 3265 C C . VAL B 223 ? 0.6007 0.6351 0.8845 0.1597 0.2023 -0.0192 211 VAL H C 3266 O O . VAL B 223 ? 0.5579 0.6392 0.8972 0.1535 0.2151 -0.0125 211 VAL H O 3267 C CB . VAL B 223 ? 0.4919 0.5288 0.6959 0.1305 0.1997 0.0114 211 VAL H CB 3268 C CG1 . VAL B 223 ? 0.5461 0.5448 0.6784 0.1419 0.2394 -0.0093 211 VAL H CG1 3269 C CG2 . VAL B 223 ? 0.4700 0.5022 0.6445 0.1213 0.1773 0.0329 211 VAL H CG2 3270 N N . GLU B 224 ? 0.6523 0.6413 0.9044 0.1780 0.2120 -0.0448 212 GLU H N 3271 C CA . GLU B 224 ? 0.6526 0.6374 0.9328 0.1952 0.2460 -0.0663 212 GLU H CA 3272 C C . GLU B 224 ? 0.7268 0.6685 0.9246 0.2008 0.2884 -0.0902 212 GLU H C 3273 O O . GLU B 224 ? 0.7821 0.6813 0.8939 0.2005 0.2799 -0.0947 212 GLU H O 3274 C CB . GLU B 224 ? 0.7369 0.6895 1.0458 0.2135 0.2303 -0.0781 212 GLU H CB 3275 C CG . GLU B 224 ? 0.7604 0.7396 1.1402 0.2117 0.1926 -0.0529 212 GLU H CG 3276 C CD . GLU B 224 ? 0.8611 0.7949 1.2645 0.2316 0.1877 -0.0653 212 GLU H CD 3277 O OE1 . GLU B 224 ? 0.9027 0.8328 1.3410 0.2298 0.1574 -0.0467 212 GLU H OE1 3278 O OE2 . GLU B 224 ? 0.9228 0.8159 1.3033 0.2487 0.2188 -0.0939 212 GLU H OE2 3279 N N . PRO B 225 ? 0.7648 0.7190 0.9885 0.2069 0.3350 -0.1048 213 PRO H N 3280 C CA . PRO B 225 ? 0.9079 0.8149 1.0438 0.2065 0.3727 -0.1250 213 PRO H CA 3281 C C . PRO B 225 ? 1.1016 0.9356 1.1677 0.2252 0.3704 -0.1497 213 PRO H C 3282 O O . PRO B 225 ? 1.0611 0.8826 1.1700 0.2403 0.3583 -0.1597 213 PRO H O 3283 C CB . PRO B 225 ? 0.8233 0.7752 1.0201 0.1987 0.3998 -0.1299 213 PRO H CB 3284 C CG . PRO B 225 ? 0.7237 0.7304 1.0360 0.2117 0.3806 -0.1213 213 PRO H CG 3285 C CD . PRO B 225 ? 0.7130 0.7342 1.0476 0.2097 0.3450 -0.0993 213 PRO H CD 3286 N N . LYS B 226 ? 1.3226 1.1060 1.2792 0.2226 0.3797 -0.1584 214 LYS H N 3287 C CA . LYS B 226 ? 1.4810 1.1946 1.3559 0.2364 0.3742 -0.1836 214 LYS H CA 3288 C C . LYS B 226 ? 1.5854 1.2701 1.4230 0.2349 0.4068 -0.2010 214 LYS H C 3289 O O . LYS B 226 ? 1.6331 1.3230 1.4423 0.2224 0.4297 -0.1921 214 LYS H O 3290 C CB . LYS B 226 ? 1.5292 1.2056 1.2991 0.2403 0.3527 -0.1794 214 LYS H CB 3291 C CG . LYS B 226 ? 1.6564 1.2631 1.3312 0.2524 0.3383 -0.2082 214 LYS H CG 3292 C CD . LYS B 226 ? 1.6965 1.2820 1.2659 0.2592 0.3098 -0.1997 214 LYS H CD 3293 C CE . LYS B 226 ? 1.5688 1.2209 1.2018 0.2476 0.2575 -0.1696 214 LYS H CE 3294 N NZ . LYS B 226 ? 1.5758 1.2241 1.1235 0.2571 0.2267 -0.1561 214 LYS H NZ 3295 N N . SER B 227 ? 1.6190 1.2669 1.4561 0.2468 0.4108 -0.2253 215 SER H N 3296 C CA . SER B 227 ? 1.6532 1.2662 1.4516 0.2479 0.4442 -0.2428 215 SER H CA 3297 C C . SER B 227 ? 1.7150 1.2619 1.4669 0.2591 0.4383 -0.2726 215 SER H C 3298 O O . SER B 227 ? 1.6857 1.2079 1.4210 0.2623 0.4060 -0.2818 215 SER H O 3299 C CB . SER B 227 ? 1.5886 1.2551 1.4864 0.2471 0.4756 -0.2363 215 SER H CB 3300 O OG . SER B 227 ? 1.5400 1.2374 1.5354 0.2608 0.4640 -0.2352 215 SER H OG 3301 N N . ASP C 1 ? 0.5720 0.6744 0.8507 0.0605 -0.0303 -0.0222 1 ASP L N 3302 C CA . ASP C 1 ? 0.6434 0.6987 0.9026 0.0363 -0.0185 -0.0368 1 ASP L CA 3303 C C . ASP C 1 ? 0.6774 0.6941 0.8791 0.0372 -0.0190 -0.0050 1 ASP L C 3304 O O . ASP C 1 ? 0.7015 0.7581 0.8791 0.0523 -0.0329 0.0166 1 ASP L O 3305 C CB . ASP C 1 ? 0.6370 0.7531 0.9215 0.0230 -0.0300 -0.0815 1 ASP L CB 3306 C CG . ASP C 1 ? 0.6727 0.8081 1.0278 0.0123 -0.0211 -0.1195 1 ASP L CG 3307 O OD1 . ASP C 1 ? 0.7168 0.8422 1.1028 0.0212 -0.0113 -0.1094 1 ASP L OD1 3308 O OD2 . ASP C 1 ? 0.6795 0.8393 1.0637 -0.0049 -0.0219 -0.1597 1 ASP L OD2 3309 N N . ILE C 2 ? 0.6807 0.6211 0.8631 0.0234 -0.0023 -0.0027 2 ILE L N 3310 C CA . ILE C 2 ? 0.6668 0.5678 0.8075 0.0208 -0.0018 0.0212 2 ILE L CA 3311 C C . ILE C 2 ? 0.6535 0.5960 0.7764 0.0110 -0.0114 0.0076 2 ILE L C 3312 O O . ILE C 2 ? 0.5625 0.5071 0.6916 -0.0043 -0.0086 -0.0256 2 ILE L O 3313 C CB . ILE C 2 ? 0.6912 0.5050 0.8182 0.0126 0.0146 0.0194 2 ILE L CB 3314 C CG1 . ILE C 2 ? 0.6932 0.4643 0.8322 0.0268 0.0246 0.0331 2 ILE L CG1 3315 C CG2 . ILE C 2 ? 0.6370 0.4175 0.7334 0.0081 0.0124 0.0372 2 ILE L CG2 3316 C CD1 . ILE C 2 ? 0.6331 0.3476 0.7362 0.0244 0.0335 0.0234 2 ILE L CD1 3317 N N . GLN C 3 ? 0.7132 0.6865 0.8136 0.0224 -0.0200 0.0354 3 GLN L N 3318 C CA . GLN C 3 ? 0.7033 0.7196 0.7819 0.0187 -0.0277 0.0283 3 GLN L CA 3319 C C . GLN C 3 ? 0.6565 0.6212 0.7117 0.0069 -0.0174 0.0452 3 GLN L C 3320 O O . GLN C 3 ? 0.6415 0.5654 0.6935 0.0116 -0.0096 0.0787 3 GLN L O 3321 C CB . GLN C 3 ? 0.7820 0.8719 0.8478 0.0446 -0.0408 0.0495 3 GLN L CB 3322 C CG . GLN C 3 ? 0.9132 1.0609 0.9550 0.0475 -0.0505 0.0367 3 GLN L CG 3323 C CD . GLN C 3 ? 0.9586 1.1346 1.0200 0.0320 -0.0602 -0.0186 3 GLN L CD 3324 O OE1 . GLN C 3 ? 0.9587 1.0989 1.0164 0.0101 -0.0521 -0.0378 3 GLN L OE1 3325 N NE2 . GLN C 3 ? 0.9686 1.2093 1.0555 0.0442 -0.0775 -0.0461 3 GLN L NE2 3326 N N . LEU C 4 ? 0.6398 0.6074 0.6843 -0.0083 -0.0175 0.0196 4 LEU L N 3327 C CA . LEU C 4 ? 0.6210 0.5483 0.6489 -0.0195 -0.0097 0.0294 4 LEU L CA 3328 C C . LEU C 4 ? 0.5580 0.5378 0.5655 -0.0165 -0.0131 0.0375 4 LEU L C 3329 O O . LEU C 4 ? 0.5162 0.5404 0.5157 -0.0186 -0.0212 0.0085 4 LEU L O 3330 C CB . LEU C 4 ? 0.6447 0.5233 0.6720 -0.0359 -0.0040 -0.0041 4 LEU L CB 3331 C CG . LEU C 4 ? 0.5878 0.3987 0.6247 -0.0354 0.0046 -0.0081 4 LEU L CG 3332 C CD1 . LEU C 4 ? 0.5626 0.3329 0.5889 -0.0446 0.0121 -0.0392 4 LEU L CD1 3333 C CD2 . LEU C 4 ? 0.5831 0.3488 0.6208 -0.0302 0.0071 0.0221 4 LEU L CD2 3334 N N . THR C 5 ? 0.5476 0.5207 0.5496 -0.0105 -0.0048 0.0769 5 THR L N 3335 C CA . THR C 5 ? 0.5449 0.5631 0.5271 -0.0047 -0.0017 0.0918 5 THR L CA 3336 C C . THR C 5 ? 0.5691 0.5494 0.5547 -0.0239 0.0077 0.0881 5 THR L C 3337 O O . THR C 5 ? 0.5514 0.4850 0.5565 -0.0303 0.0185 0.1111 5 THR L O 3338 C CB . THR C 5 ? 0.5631 0.6056 0.5395 0.0187 0.0075 0.1433 5 THR L CB 3339 O OG1 . THR C 5 ? 0.6131 0.6988 0.5839 0.0413 -0.0045 0.1437 5 THR L OG1 3340 C CG2 . THR C 5 ? 0.5781 0.6678 0.5310 0.0289 0.0156 0.1619 5 THR L CG2 3341 N N . GLN C 6 ? 0.5245 0.5265 0.4953 -0.0324 0.0024 0.0559 6 GLN L N 3342 C CA . GLN C 6 ? 0.4952 0.4695 0.4680 -0.0482 0.0088 0.0467 6 GLN L CA 3343 C C . GLN C 6 ? 0.5097 0.5309 0.4707 -0.0415 0.0177 0.0700 6 GLN L C 3344 O O . GLN C 6 ? 0.5387 0.6197 0.4739 -0.0286 0.0120 0.0625 6 GLN L O 3345 C CB . GLN C 6 ? 0.5022 0.4645 0.4651 -0.0593 0.0011 -0.0013 6 GLN L CB 3346 C CG . GLN C 6 ? 0.4838 0.4106 0.4475 -0.0722 0.0053 -0.0154 6 GLN L CG 3347 C CD . GLN C 6 ? 0.5267 0.4317 0.4774 -0.0781 0.0013 -0.0586 6 GLN L CD 3348 O OE1 . GLN C 6 ? 0.5412 0.4408 0.4924 -0.0762 -0.0011 -0.0763 6 GLN L OE1 3349 N NE2 . GLN C 6 ? 0.5478 0.4400 0.4902 -0.0841 0.0029 -0.0748 6 GLN L NE2 3350 N N . SER C 7 ? 0.4901 0.4850 0.4735 -0.0488 0.0325 0.0969 7 SER L N 3351 C CA . SER C 7 ? 0.5388 0.5734 0.5183 -0.0424 0.0479 0.1246 7 SER L CA 3352 C C . SER C 7 ? 0.5619 0.5663 0.5707 -0.0624 0.0565 0.1176 7 SER L C 3353 O O . SER C 7 ? 0.5600 0.5081 0.6016 -0.0767 0.0543 0.1085 7 SER L O 3354 C CB . SER C 7 ? 0.6387 0.6860 0.6262 -0.0242 0.0658 0.1803 7 SER L CB 3355 O OG . SER C 7 ? 0.7311 0.7173 0.7616 -0.0355 0.0745 0.1987 7 SER L OG 3356 N N . PRO C 8 ? 0.5081 0.5532 0.5061 -0.0607 0.0650 0.1190 8 PRO L N 3357 C CA . PRO C 8 ? 0.5117 0.6257 0.4663 -0.0392 0.0659 0.1255 8 PRO L CA 3358 C C . PRO C 8 ? 0.5218 0.6556 0.4418 -0.0388 0.0430 0.0740 8 PRO L C 3359 O O . PRO C 8 ? 0.5019 0.5938 0.4303 -0.0557 0.0318 0.0375 8 PRO L O 3360 C CB . PRO C 8 ? 0.4849 0.6227 0.4504 -0.0402 0.0870 0.1458 8 PRO L CB 3361 C CG . PRO C 8 ? 0.4874 0.5766 0.4926 -0.0669 0.0840 0.1198 8 PRO L CG 3362 C CD . PRO C 8 ? 0.4961 0.5243 0.5282 -0.0775 0.0745 0.1143 8 PRO L CD 3363 N N . SER C 9 ? 0.5636 0.7602 0.4460 -0.0170 0.0372 0.0711 9 SER L N 3364 C CA . SER C 9 ? 0.5555 0.7757 0.4134 -0.0161 0.0163 0.0200 9 SER L CA 3365 C C . SER C 9 ? 0.5051 0.7207 0.3574 -0.0287 0.0174 -0.0092 9 SER L C 3366 O O . SER C 9 ? 0.4813 0.6789 0.3300 -0.0393 0.0052 -0.0536 9 SER L O 3367 C CB . SER C 9 ? 0.6964 0.9914 0.5186 0.0146 0.0066 0.0207 9 SER L CB 3368 O OG . SER C 9 ? 0.7706 1.0901 0.5792 0.0138 -0.0140 -0.0339 9 SER L OG 3369 N N . SER C 10 ? 0.5020 0.7333 0.3559 -0.0260 0.0350 0.0176 10 SER L N 3370 C CA . SER C 10 ? 0.5150 0.7427 0.3681 -0.0366 0.0378 -0.0058 10 SER L CA 3371 C C . SER C 10 ? 0.5252 0.7506 0.4077 -0.0414 0.0615 0.0321 10 SER L C 3372 O O . SER C 10 ? 0.5895 0.8332 0.4809 -0.0297 0.0796 0.0793 10 SER L O 3373 C CB . SER C 10 ? 0.5462 0.8316 0.3572 -0.0196 0.0293 -0.0326 10 SER L CB 3374 O OG . SER C 10 ? 0.5450 0.8912 0.3307 0.0084 0.0383 0.0011 10 SER L OG 3375 N N . LEU C 11 ? 0.5393 0.7419 0.4406 -0.0572 0.0628 0.0114 11 LEU L N 3376 C CA . LEU C 11 ? 0.5926 0.7999 0.5330 -0.0637 0.0848 0.0399 11 LEU L CA 3377 C C . LEU C 11 ? 0.5520 0.7710 0.4894 -0.0686 0.0832 0.0092 11 LEU L C 3378 O O . LEU C 11 ? 0.5604 0.7556 0.4794 -0.0739 0.0645 -0.0353 11 LEU L O 3379 C CB . LEU C 11 ? 0.5781 0.7295 0.5765 -0.0826 0.0887 0.0532 11 LEU L CB 3380 C CG . LEU C 11 ? 0.5991 0.6923 0.6097 -0.0979 0.0674 0.0105 11 LEU L CG 3381 C CD1 . LEU C 11 ? 0.6026 0.6875 0.6456 -0.1090 0.0675 -0.0110 11 LEU L CD1 3382 C CD2 . LEU C 11 ? 0.5973 0.6415 0.6389 -0.1050 0.0647 0.0244 11 LEU L CD2 3383 N N . SER C 12 ? 0.5176 0.7731 0.4735 -0.0644 0.1058 0.0356 12 SER L N 3384 C CA . SER C 12 ? 0.4230 0.6922 0.3868 -0.0690 0.1074 0.0115 12 SER L CA 3385 C C . SER C 12 ? 0.5284 0.7683 0.5664 -0.0897 0.1157 0.0165 12 SER L C 3386 O O . SER C 12 ? 0.4309 0.6675 0.5193 -0.0960 0.1366 0.0568 12 SER L O 3387 C CB . SER C 12 ? 0.4504 0.7858 0.3884 -0.0483 0.1276 0.0334 12 SER L CB 3388 O OG . SER C 12 ? 0.6430 1.0117 0.5153 -0.0253 0.1171 0.0256 12 SER L OG 3389 N N . ALA C 13 ? 0.4718 0.6910 0.5192 -0.0984 0.0995 -0.0260 13 ALA L N 3390 C CA . ALA C 13 ? 0.4383 0.6330 0.5580 -0.1155 0.0998 -0.0334 13 ALA L CA 3391 C C . ALA C 13 ? 0.4623 0.6677 0.5843 -0.1144 0.0895 -0.0734 13 ALA L C 3392 O O . ALA C 13 ? 0.4426 0.6509 0.5046 -0.1024 0.0763 -0.1033 13 ALA L O 3393 C CB . ALA C 13 ? 0.3867 0.5198 0.5218 -0.1248 0.0806 -0.0482 13 ALA L CB 3394 N N . SER C 14 ? 0.4431 0.6550 0.6399 -0.1263 0.0961 -0.0749 14 SER L N 3395 C CA . SER C 14 ? 0.4051 0.6298 0.6138 -0.1236 0.0844 -0.1143 14 SER L CA 3396 C C . SER C 14 ? 0.3957 0.5692 0.6144 -0.1248 0.0536 -0.1588 14 SER L C 3397 O O . SER C 14 ? 0.4333 0.5651 0.6720 -0.1322 0.0451 -0.1557 14 SER L O 3398 C CB . SER C 14 ? 0.3683 0.6374 0.6601 -0.1337 0.1083 -0.0958 14 SER L CB 3399 O OG . SER C 14 ? 0.5979 0.9159 0.8738 -0.1262 0.1406 -0.0521 14 SER L OG 3400 N N . VAL C 15 ? 0.4185 0.5957 0.6196 -0.1131 0.0372 -0.1999 15 VAL L N 3401 C CA . VAL C 15 ? 0.4399 0.5749 0.6476 -0.1060 0.0083 -0.2434 15 VAL L CA 3402 C C . VAL C 15 ? 0.4516 0.5866 0.7598 -0.1216 0.0039 -0.2476 15 VAL L C 3403 O O . VAL C 15 ? 0.4000 0.5796 0.7792 -0.1317 0.0163 -0.2432 15 VAL L O 3404 C CB . VAL C 15 ? 0.4350 0.5790 0.6033 -0.0809 -0.0036 -0.2725 15 VAL L CB 3405 C CG1 . VAL C 15 ? 0.3464 0.4569 0.5204 -0.0565 -0.0242 -0.2736 15 VAL L CG1 3406 C CG2 . VAL C 15 ? 0.3375 0.4603 0.4136 -0.0595 -0.0012 -0.2516 15 VAL L CG2 3407 N N . GLY C 16 ? 0.5097 0.5928 0.8122 -0.1138 -0.0097 -0.2423 16 GLY L N 3408 C CA . GLY C 16 ? 0.3649 0.4397 0.7392 -0.1158 -0.0167 -0.2436 16 GLY L CA 3409 C C . GLY C 16 ? 0.3748 0.4351 0.8067 -0.1384 -0.0018 -0.2114 16 GLY L C 3410 O O . GLY C 16 ? 0.3949 0.4401 0.8738 -0.1358 -0.0093 -0.2145 16 GLY L O 3411 N N . ASP C 17 ? 0.5018 0.5699 0.9296 -0.1576 0.0218 -0.1782 17 ASP L N 3412 C CA . ASP C 17 ? 0.6200 0.6747 1.0970 -0.1728 0.0419 -0.1356 17 ASP L CA 3413 C C . ASP C 17 ? 0.5264 0.5287 0.9498 -0.1638 0.0294 -0.1279 17 ASP L C 3414 O O . ASP C 17 ? 0.4956 0.4748 0.8413 -0.1467 0.0102 -0.1489 17 ASP L O 3415 C CB . ASP C 17 ? 0.7134 0.8146 1.2100 -0.1859 0.0837 -0.0840 17 ASP L CB 3416 C CG . ASP C 17 ? 0.7373 0.8570 1.1271 -0.1675 0.0849 -0.0757 17 ASP L CG 3417 O OD1 . ASP C 17 ? 0.8351 0.9204 1.1555 -0.1567 0.0640 -0.0932 17 ASP L OD1 3418 O OD2 . ASP C 17 ? 0.6879 0.8575 1.0670 -0.1631 0.1078 -0.0528 17 ASP L OD2 3419 N N . ARG C 18 ? 0.5427 0.5273 1.0044 -0.1715 0.0427 -0.0948 18 ARG L N 3420 C CA . ARG C 18 ? 0.5013 0.4410 0.9225 -0.1624 0.0321 -0.0863 18 ARG L CA 3421 C C . ARG C 18 ? 0.4168 0.3577 0.7992 -0.1684 0.0493 -0.0547 18 ARG L C 3422 O O . ARG C 18 ? 0.5267 0.5012 0.9323 -0.1782 0.0812 -0.0125 18 ARG L O 3423 C CB . ARG C 18 ? 0.5875 0.5101 1.0667 -0.1659 0.0393 -0.0683 18 ARG L CB 3424 C CG . ARG C 18 ? 0.6111 0.4945 1.0542 -0.1571 0.0321 -0.0567 18 ARG L CG 3425 C CD . ARG C 18 ? 0.5783 0.4379 0.9931 -0.1380 0.0021 -0.0939 18 ARG L CD 3426 N NE . ARG C 18 ? 0.6152 0.4761 1.1012 -0.1392 -0.0009 -0.1059 18 ARG L NE 3427 C CZ . ARG C 18 ? 0.6913 0.5313 1.2063 -0.1398 0.0024 -0.0944 18 ARG L CZ 3428 N NH1 . ARG C 18 ? 0.5953 0.4120 1.0702 -0.1380 0.0086 -0.0690 18 ARG L NH1 3429 N NH2 . ARG C 18 ? 0.7962 0.6401 1.3842 -0.1416 -0.0008 -0.1104 18 ARG L NH2 3430 N N . VAL C 19 ? 0.3490 0.6707 1.0780 -0.1274 0.1330 0.0720 19 VAL L N 3431 C CA . VAL C 19 ? 0.3384 0.6491 0.9728 -0.1163 0.1628 0.0790 19 VAL L CA 3432 C C . VAL C 19 ? 0.4585 0.7466 1.0519 -0.1275 0.1280 0.0540 19 VAL L C 3433 O O . VAL C 19 ? 0.3963 0.6845 0.9837 -0.1358 0.0771 0.0164 19 VAL L O 3434 C CB . VAL C 19 ? 0.4449 0.7704 1.0103 -0.1005 0.1702 0.0663 19 VAL L CB 3435 C CG1 . VAL C 19 ? 0.3310 0.6248 0.7591 -0.0870 0.1724 0.0555 19 VAL L CG1 3436 C CG2 . VAL C 19 ? 0.5288 0.8631 1.1080 -0.0815 0.2152 0.0941 19 VAL L CG2 3437 N N . THR C 20 ? 0.4864 0.7480 1.0309 -0.1201 0.1541 0.0757 20 THR L N 3438 C CA . THR C 20 ? 0.4090 0.6414 0.9054 -0.1244 0.1248 0.0573 20 THR L CA 3439 C C . THR C 20 ? 0.3895 0.6079 0.7591 -0.1044 0.1342 0.0605 20 THR L C 3440 O O . THR C 20 ? 0.4537 0.6688 0.7831 -0.0874 0.1737 0.0926 20 THR L O 3441 C CB . THR C 20 ? 0.3758 0.5877 0.9531 -0.1358 0.1391 0.0808 20 THR L CB 3442 O OG1 . THR C 20 ? 0.4168 0.6346 1.1085 -0.1572 0.1110 0.0631 20 THR L OG1 3443 C CG2 . THR C 20 ? 0.5431 0.7215 1.0622 -0.1334 0.1192 0.0684 20 THR L CG2 3444 N N . ILE C 21 ? 0.3395 0.5508 0.6486 -0.1043 0.0969 0.0277 21 ILE L N 3445 C CA . ILE C 21 ? 0.3809 0.5833 0.5914 -0.0900 0.0954 0.0264 21 ILE L CA 3446 C C . ILE C 21 ? 0.3810 0.5634 0.5793 -0.0919 0.0733 0.0193 21 ILE L C 3447 O O . ILE C 21 ? 0.4201 0.5953 0.6395 -0.0998 0.0445 -0.0070 21 ILE L O 3448 C CB . ILE C 21 ? 0.4224 0.6353 0.5807 -0.0856 0.0784 -0.0006 21 ILE L CB 3449 C CG1 . ILE C 21 ? 0.4495 0.6781 0.6225 -0.0811 0.1018 0.0042 21 ILE L CG1 3450 C CG2 . ILE C 21 ? 0.4104 0.6166 0.4867 -0.0746 0.0728 -0.0034 21 ILE L CG2 3451 C CD1 . ILE C 21 ? 0.4448 0.6792 0.5841 -0.0775 0.0876 -0.0213 21 ILE L CD1 3452 N N . THR C 22 ? 0.3684 0.5414 0.5275 -0.0799 0.0872 0.0435 22 THR L N 3453 C CA . THR C 22 ? 0.3721 0.5266 0.5271 -0.0779 0.0725 0.0432 22 THR L CA 3454 C C . THR C 22 ? 0.4616 0.6243 0.5468 -0.0665 0.0545 0.0350 22 THR L C 3455 O O . THR C 22 ? 0.4948 0.6721 0.5273 -0.0566 0.0583 0.0414 22 THR L O 3456 C CB . THR C 22 ? 0.4994 0.6374 0.6804 -0.0708 0.1007 0.0833 22 THR L CB 3457 O OG1 . THR C 22 ? 0.5465 0.6966 0.6661 -0.0507 0.1234 0.1135 22 THR L OG1 3458 C CG2 . THR C 22 ? 0.4223 0.5511 0.6992 -0.0859 0.1198 0.0938 22 THR L CG2 3459 N N . CYS C 23 ? 0.4620 0.6140 0.5507 -0.0665 0.0345 0.0195 23 CYS L N 3460 C CA . CYS C 23 ? 0.5304 0.6931 0.5784 -0.0561 0.0200 0.0181 23 CYS L CA 3461 C C . CYS C 23 ? 0.5045 0.6502 0.5662 -0.0462 0.0213 0.0342 23 CYS L C 3462 O O . CYS C 23 ? 0.4864 0.6048 0.5805 -0.0488 0.0216 0.0240 23 CYS L O 3463 C CB . CYS C 23 ? 0.5655 0.7349 0.6065 -0.0592 0.0028 -0.0110 23 CYS L CB 3464 S SG . CYS C 23 ? 0.8103 1.0016 0.8255 -0.0512 -0.0116 -0.0105 23 CYS L SG 3465 N N . ARG C 24 ? 0.5423 0.7026 0.5787 -0.0327 0.0198 0.0577 24 ARG L N 3466 C CA . ARG C 24 ? 0.5904 0.7378 0.6433 -0.0190 0.0240 0.0799 24 ARG L CA 3467 C C . ARG C 24 ? 0.5114 0.6843 0.5525 -0.0076 0.0054 0.0828 24 ARG L C 3468 O O . ARG C 24 ? 0.4709 0.6755 0.4843 -0.0048 -0.0109 0.0867 24 ARG L O 3469 C CB . ARG C 24 ? 0.6328 0.7746 0.6841 -0.0077 0.0448 0.1199 24 ARG L CB 3470 C CG . ARG C 24 ? 0.7518 0.8629 0.8494 -0.0189 0.0697 0.1247 24 ARG L CG 3471 C CD . ARG C 24 ? 0.8544 0.9679 0.9435 -0.0075 0.0990 0.1672 24 ARG L CD 3472 N NE . ARG C 24 ? 0.9048 0.9915 1.0637 -0.0214 0.1257 0.1749 24 ARG L NE 3473 C CZ . ARG C 24 ? 0.9773 1.0657 1.1479 -0.0164 0.1599 0.2086 24 ARG L CZ 3474 N NH1 . ARG C 24 ? 0.9916 1.1026 1.0874 0.0067 0.1711 0.2347 24 ARG L NH1 3475 N NH2 . ARG C 24 ? 1.0088 1.0756 1.2676 -0.0327 0.1829 0.2157 24 ARG L NH2 3476 N N . ALA C 25 ? 0.4946 0.6521 0.5612 0.0000 0.0077 0.0795 25 ALA L N 3477 C CA . ALA C 25 ? 0.4241 0.6073 0.5008 0.0119 -0.0036 0.0870 25 ALA L CA 3478 C C . ALA C 25 ? 0.4879 0.6801 0.5784 0.0316 -0.0014 0.1248 25 ALA L C 3479 O O . ALA C 25 ? 0.4827 0.6441 0.5822 0.0395 0.0176 0.1429 25 ALA L O 3480 C CB . ALA C 25 ? 0.3886 0.5509 0.4805 0.0176 0.0053 0.0686 25 ALA L CB 3481 N N . SER C 26 ? 0.4892 0.7244 0.5905 0.0398 -0.0222 0.1381 26 SER L N 3482 C CA . SER C 26 ? 0.4920 0.7463 0.6097 0.0622 -0.0265 0.1771 26 SER L CA 3483 C C . SER C 26 ? 0.5479 0.7759 0.7082 0.0802 -0.0015 0.1918 26 SER L C 3484 O O . SER C 26 ? 0.5625 0.7940 0.7427 0.1021 0.0047 0.2280 26 SER L O 3485 C CB . SER C 26 ? 0.4642 0.7777 0.5937 0.0644 -0.0647 0.1822 26 SER L CB 3486 O OG . SER C 26 ? 0.4485 0.7785 0.6258 0.0569 -0.0686 0.1664 26 SER L OG 3487 N N . GLN C 27 ? 0.5477 0.7470 0.7161 0.0753 0.0140 0.1644 27 GLN L N 3488 C CA . GLN C 27 ? 0.5788 0.7400 0.7711 0.0963 0.0417 0.1698 27 GLN L CA 3489 C C . GLN C 27 ? 0.5778 0.6906 0.7451 0.0901 0.0554 0.1292 27 GLN L C 3490 O O . GLN C 27 ? 0.5933 0.7143 0.7363 0.0709 0.0429 0.1025 27 GLN L O 3491 C CB . GLN C 27 ? 0.6449 0.8441 0.8843 0.1164 0.0429 0.1933 27 GLN L CB 3492 C CG . GLN C 27 ? 0.6312 0.8641 0.8844 0.1061 0.0333 0.1770 27 GLN L CG 3493 C CD . GLN C 27 ? 0.7000 0.9846 1.0245 0.1219 0.0304 0.2083 27 GLN L CD 3494 O OE1 . GLN C 27 ? 0.7556 1.0902 1.1109 0.1205 0.0003 0.2307 27 GLN L OE1 3495 N NE2 . GLN C 27 ? 0.6924 0.9664 1.0446 0.1399 0.0616 0.2115 27 GLN L NE2 3496 N N . GLY C 28 ? 0.5733 0.6340 0.7431 0.1094 0.0793 0.1235 28 GLY L N 3497 C CA . GLY C 28 ? 0.5122 0.5208 0.6475 0.1096 0.0861 0.0808 28 GLY L CA 3498 C C . GLY C 28 ? 0.5150 0.5431 0.6273 0.1141 0.0854 0.0644 28 GLY L C 3499 O O . GLY C 28 ? 0.5297 0.5868 0.6649 0.1323 0.0984 0.0872 28 GLY L O 3500 N N . ILE C 29 ? 0.5131 0.5274 0.5886 0.0989 0.0719 0.0292 29 ILE L N 3501 C CA . ILE C 29 ? 0.4935 0.5223 0.5430 0.1061 0.0743 0.0172 29 ILE L CA 3502 C C . ILE C 29 ? 0.5924 0.5701 0.5849 0.1166 0.0715 -0.0244 29 ILE L C 3503 O O . ILE C 29 ? 0.6249 0.6122 0.5858 0.1192 0.0672 -0.0380 29 ILE L O 3504 C CB . ILE C 29 ? 0.4722 0.5519 0.5332 0.0785 0.0545 0.0200 29 ILE L CB 3505 C CG1 . ILE C 29 ? 0.4455 0.5168 0.4954 0.0511 0.0338 0.0001 29 ILE L CG1 3506 C CG2 . ILE C 29 ? 0.4310 0.5628 0.5411 0.0728 0.0498 0.0542 29 ILE L CG2 3507 C CD1 . ILE C 29 ? 0.3832 0.4960 0.4368 0.0280 0.0185 0.0003 29 ILE L CD1 3508 N N . ARG C 30 ? 0.6352 0.5573 0.6165 0.1240 0.0716 -0.0452 30 ARG L N 3509 C CA . ARG C 30 ? 0.6966 0.5638 0.6221 0.1362 0.0597 -0.0929 30 ARG L CA 3510 C C . ARG C 30 ? 0.6661 0.5520 0.5824 0.1092 0.0271 -0.1180 30 ARG L C 3511 O O . ARG C 30 ? 0.6626 0.5618 0.6229 0.0763 0.0105 -0.1176 30 ARG L O 3512 C CB . ARG C 30 ? 0.7857 0.6316 0.6507 0.1815 0.0844 -0.0966 30 ARG L CB 3513 C CG . ARG C 30 ? 0.8903 0.7247 0.7750 0.2122 0.1235 -0.0650 30 ARG L CG 3514 C CD . ARG C 30 ? 1.0132 0.8294 0.8406 0.2618 0.1583 -0.0609 30 ARG L CD 3515 N NE . ARG C 30 ? 1.1672 0.9123 0.9010 0.2898 0.1493 -0.1130 30 ARG L NE 3516 C CZ . ARG C 30 ? 1.3078 0.9818 1.0053 0.3197 0.1623 -0.1377 30 ARG L CZ 3517 N NH1 . ARG C 30 ? 1.3427 1.0094 1.0962 0.3264 0.1904 -0.1085 30 ARG L NH1 3518 N NH2 . ARG C 30 ? 1.4105 1.0189 1.0141 0.3454 0.1451 -0.1933 30 ARG L NH2 3519 N N . ASN C 31 ? 0.7086 0.5965 0.5698 0.1271 0.0223 -0.1347 31 ASN L N 3520 C CA . ASN C 31 ? 0.6888 0.6007 0.5444 0.1067 -0.0066 -0.1528 31 ASN L CA 3521 C C . ASN C 31 ? 0.6065 0.5680 0.4578 0.1097 0.0067 -0.1257 31 ASN L C 3522 O O . ASN C 31 ? 0.6126 0.5870 0.4395 0.1097 -0.0086 -0.1386 31 ASN L O 3523 C CB . ASN C 31 ? 0.8210 0.6892 0.6154 0.1254 -0.0343 -0.2018 31 ASN L CB 3524 C CG . ASN C 31 ? 0.9761 0.7980 0.7983 0.1089 -0.0602 -0.2380 31 ASN L CG 3525 O OD1 . ASN C 31 ? 1.0005 0.8367 0.8980 0.0730 -0.0650 -0.2265 31 ASN L OD1 3526 N ND2 . ASN C 31 ? 1.0513 0.8137 0.8128 0.1372 -0.0757 -0.2821 31 ASN L ND2 3527 N N . ASP C 32 ? 0.5613 0.5509 0.4450 0.1123 0.0336 -0.0879 32 ASP L N 3528 C CA . ASP C 32 ? 0.5445 0.5759 0.4403 0.1142 0.0482 -0.0625 32 ASP L CA 3529 C C . ASP C 32 ? 0.5141 0.5876 0.4553 0.0758 0.0314 -0.0554 32 ASP L C 3530 O O . ASP C 32 ? 0.4832 0.5901 0.4682 0.0644 0.0383 -0.0305 32 ASP L O 3531 C CB . ASP C 32 ? 0.4913 0.5359 0.4163 0.1347 0.0819 -0.0268 32 ASP L CB 3532 C CG . ASP C 32 ? 0.6216 0.6218 0.4949 0.1809 0.1091 -0.0298 32 ASP L CG 3533 O OD1 . ASP C 32 ? 0.7269 0.7183 0.6247 0.1954 0.1300 -0.0117 32 ASP L OD1 3534 O OD2 . ASP C 32 ? 0.6744 0.6473 0.4776 0.2069 0.1100 -0.0497 32 ASP L OD2 3535 N N . LEU C 33 ? 0.5257 0.5971 0.4570 0.0582 0.0079 -0.0787 33 LEU L N 3536 C CA . LEU C 33 ? 0.4251 0.5301 0.3892 0.0278 -0.0025 -0.0735 33 LEU L CA 3537 C C . LEU C 33 ? 0.4322 0.5471 0.3803 0.0275 -0.0110 -0.0858 33 LEU L C 3538 O O . LEU C 33 ? 0.4801 0.5757 0.3963 0.0408 -0.0244 -0.1071 33 LEU L O 3539 C CB . LEU C 33 ? 0.4535 0.5527 0.4418 0.0051 -0.0152 -0.0789 33 LEU L CB 3540 C CG . LEU C 33 ? 0.4578 0.5888 0.4701 -0.0187 -0.0173 -0.0675 33 LEU L CG 3541 C CD1 . LEU C 33 ? 0.5261 0.6736 0.5531 -0.0210 -0.0108 -0.0431 33 LEU L CD1 3542 C CD2 . LEU C 33 ? 0.4364 0.5618 0.4680 -0.0361 -0.0258 -0.0766 33 LEU L CD2 3543 N N . GLY C 34 ? 0.3769 0.5209 0.3476 0.0138 -0.0059 -0.0740 34 GLY L N 3544 C CA . GLY C 34 ? 0.3501 0.5046 0.3148 0.0137 -0.0096 -0.0805 34 GLY L CA 3545 C C . GLY C 34 ? 0.3634 0.5362 0.3554 -0.0130 -0.0167 -0.0836 34 GLY L C 3546 O O . GLY C 34 ? 0.3308 0.5129 0.3398 -0.0285 -0.0140 -0.0758 34 GLY L O 3547 N N . TRP C 35 ? 0.3806 0.5589 0.3735 -0.0142 -0.0255 -0.0939 35 TRP L N 3548 C CA . TRP C 35 ? 0.3784 0.5728 0.3967 -0.0333 -0.0241 -0.0940 35 TRP L CA 3549 C C . TRP C 35 ? 0.3426 0.5476 0.3636 -0.0268 -0.0145 -0.0906 35 TRP L C 3550 O O . TRP C 35 ? 0.3532 0.5576 0.3610 -0.0077 -0.0177 -0.0908 35 TRP L O 3551 C CB . TRP C 35 ? 0.3149 0.5105 0.3561 -0.0425 -0.0387 -0.1043 35 TRP L CB 3552 C CG . TRP C 35 ? 0.3251 0.5072 0.3800 -0.0530 -0.0417 -0.1036 35 TRP L CG 3553 C CD1 . TRP C 35 ? 0.3541 0.5138 0.4072 -0.0478 -0.0567 -0.1163 35 TRP L CD1 3554 C CD2 . TRP C 35 ? 0.2935 0.4790 0.3635 -0.0667 -0.0275 -0.0885 35 TRP L CD2 3555 N NE1 . TRP C 35 ? 0.3278 0.4763 0.4056 -0.0600 -0.0501 -0.1075 35 TRP L NE1 3556 C CE2 . TRP C 35 ? 0.2932 0.4595 0.3790 -0.0699 -0.0313 -0.0872 35 TRP L CE2 3557 C CE3 . TRP C 35 ? 0.2980 0.4967 0.3626 -0.0726 -0.0112 -0.0767 35 TRP L CE3 3558 C CZ2 . TRP C 35 ? 0.3217 0.4856 0.4219 -0.0774 -0.0161 -0.0669 35 TRP L CZ2 3559 C CZ3 . TRP C 35 ? 0.3503 0.5465 0.4158 -0.0775 0.0008 -0.0602 35 TRP L CZ3 3560 C CH2 . TRP C 35 ? 0.3195 0.5004 0.4048 -0.0792 -0.0000 -0.0518 35 TRP L CH2 3561 N N . TYR C 36 ? 0.3293 0.5405 0.3629 -0.0395 -0.0028 -0.0880 36 TYR L N 3562 C CA . TYR C 36 ? 0.3058 0.5197 0.3491 -0.0347 0.0100 -0.0859 36 TYR L CA 3563 C C . TYR C 36 ? 0.3005 0.5199 0.3562 -0.0442 0.0172 -0.0911 36 TYR L C 3564 O O . TYR C 36 ? 0.3054 0.5255 0.3574 -0.0557 0.0177 -0.0936 36 TYR L O 3565 C CB . TYR C 36 ? 0.2940 0.5018 0.3465 -0.0376 0.0205 -0.0817 36 TYR L CB 3566 C CG . TYR C 36 ? 0.3521 0.5568 0.4040 -0.0229 0.0247 -0.0684 36 TYR L CG 3567 C CD1 . TYR C 36 ? 0.3752 0.5799 0.4218 -0.0250 0.0174 -0.0657 36 TYR L CD1 3568 C CD2 . TYR C 36 ? 0.3617 0.5623 0.4186 -0.0021 0.0417 -0.0535 36 TYR L CD2 3569 C CE1 . TYR C 36 ? 0.3396 0.5402 0.3870 -0.0069 0.0284 -0.0506 36 TYR L CE1 3570 C CE2 . TYR C 36 ? 0.3059 0.5020 0.3590 0.0177 0.0547 -0.0358 36 TYR L CE2 3571 C CZ . TYR C 36 ? 0.2812 0.4773 0.3302 0.0151 0.0486 -0.0354 36 TYR L CZ 3572 O OH . TYR C 36 ? 0.3543 0.5447 0.4006 0.0392 0.0681 -0.0150 36 TYR L OH 3573 N N . GLN C 37 ? 0.3289 0.5508 0.3982 -0.0348 0.0278 -0.0886 37 GLN L N 3574 C CA . GLN C 37 ? 0.2736 0.4973 0.3565 -0.0381 0.0427 -0.0916 37 GLN L CA 3575 C C . GLN C 37 ? 0.2539 0.4598 0.3399 -0.0356 0.0603 -0.0957 37 GLN L C 3576 O O . GLN C 37 ? 0.2712 0.4724 0.3681 -0.0254 0.0646 -0.0872 37 GLN L O 3577 C CB . GLN C 37 ? 0.2379 0.4823 0.3498 -0.0277 0.0390 -0.0841 37 GLN L CB 3578 C CG . GLN C 37 ? 0.2455 0.4951 0.3819 -0.0265 0.0609 -0.0814 37 GLN L CG 3579 C CD . GLN C 37 ? 0.3775 0.6542 0.5575 -0.0129 0.0551 -0.0701 37 GLN L CD 3580 O OE1 . GLN C 37 ? 0.2479 0.5274 0.4295 0.0046 0.0526 -0.0630 37 GLN L OE1 3581 N NE2 . GLN C 37 ? 0.3297 0.6289 0.5519 -0.0190 0.0529 -0.0650 37 GLN L NE2 3582 N N . GLN C 38 ? 0.3828 0.5748 0.4584 -0.0426 0.0725 -0.1087 38 GLN L N 3583 C CA . GLN C 38 ? 0.3749 0.5415 0.4572 -0.0420 0.0866 -0.1207 38 GLN L CA 3584 C C . GLN C 38 ? 0.3711 0.5230 0.4451 -0.0358 0.1090 -0.1309 38 GLN L C 3585 O O . GLN C 38 ? 0.4145 0.5638 0.4552 -0.0376 0.1125 -0.1388 38 GLN L O 3586 C CB . GLN C 38 ? 0.3645 0.5161 0.4349 -0.0570 0.0714 -0.1380 38 GLN L CB 3587 C CG . GLN C 38 ? 0.3466 0.4688 0.4412 -0.0609 0.0795 -0.1550 38 GLN L CG 3588 C CD . GLN C 38 ? 0.3880 0.4994 0.4783 -0.0783 0.0551 -0.1789 38 GLN L CD 3589 O OE1 . GLN C 38 ? 0.4334 0.5561 0.4845 -0.0832 0.0353 -0.1853 38 GLN L OE1 3590 N NE2 . GLN C 38 ? 0.3908 0.4814 0.5295 -0.0869 0.0552 -0.1904 38 GLN L NE2 3591 N N . LYS C 39 ? 0.3975 0.4376 0.4719 0.0847 0.0009 0.0246 39 LYS L N 3592 C CA . LYS C 39 ? 0.4321 0.4582 0.5095 0.0986 0.0022 0.0096 39 LYS L CA 3593 C C . LYS C 39 ? 0.4955 0.4741 0.5332 0.0837 0.0071 0.0184 39 LYS L C 3594 O O . LYS C 39 ? 0.5696 0.5190 0.5711 0.0696 0.0027 0.0368 39 LYS L O 3595 C CB . LYS C 39 ? 0.4530 0.4680 0.5319 0.1313 -0.0157 0.0011 39 LYS L CB 3596 C CG . LYS C 39 ? 0.4576 0.5189 0.5695 0.1440 -0.0238 -0.0060 39 LYS L CG 3597 C CD . LYS C 39 ? 0.4351 0.5488 0.5942 0.1501 -0.0141 -0.0300 39 LYS L CD 3598 C CE . LYS C 39 ? 0.4450 0.5945 0.6317 0.1748 -0.0293 -0.0419 39 LYS L CE 3599 N NZ . LYS C 39 ? 0.4895 0.6449 0.6659 0.1669 -0.0384 -0.0280 39 LYS L NZ 3600 N N . PRO C 40 ? 0.5325 0.5054 0.5747 0.0837 0.0173 0.0034 40 PRO L N 3601 C CA . PRO C 40 ? 0.5527 0.4777 0.5538 0.0673 0.0231 0.0087 40 PRO L CA 3602 C C . PRO C 40 ? 0.5861 0.4473 0.5402 0.0779 0.0081 0.0188 40 PRO L C 3603 O O . PRO C 40 ? 0.6104 0.4520 0.5669 0.1098 -0.0051 0.0091 40 PRO L O 3604 C CB . PRO C 40 ? 0.5242 0.4570 0.5436 0.0749 0.0353 -0.0170 40 PRO L CB 3605 C CG . PRO C 40 ? 0.4522 0.4501 0.5219 0.0772 0.0415 -0.0297 40 PRO L CG 3606 C CD . PRO C 40 ? 0.4773 0.4921 0.5616 0.0943 0.0261 -0.0214 40 PRO L CD 3607 N N . GLY C 41 ? 0.5540 0.3840 0.4643 0.0501 0.0086 0.0387 41 GLY L N 3608 C CA . GLY C 41 ? 0.5797 0.3415 0.4336 0.0505 -0.0047 0.0502 41 GLY L CA 3609 C C . GLY C 41 ? 0.6570 0.4162 0.4990 0.0573 -0.0216 0.0645 41 GLY L C 3610 O O . GLY C 41 ? 0.8184 0.5168 0.6105 0.0599 -0.0366 0.0745 41 GLY L O 3611 N N . LYS C 42 ? 0.5609 0.3811 0.4434 0.0581 -0.0197 0.0655 42 LYS L N 3612 C CA . LYS C 42 ? 0.5626 0.3864 0.4335 0.0603 -0.0331 0.0769 42 LYS L CA 3613 C C . LYS C 42 ? 0.4958 0.3678 0.3801 0.0350 -0.0226 0.0861 42 LYS L C 3614 O O . LYS C 42 ? 0.4737 0.3835 0.3881 0.0233 -0.0078 0.0831 42 LYS L O 3615 C CB . LYS C 42 ? 0.6185 0.4666 0.5256 0.0944 -0.0454 0.0646 42 LYS L CB 3616 C CG . LYS C 42 ? 0.7707 0.5705 0.6629 0.1260 -0.0626 0.0574 42 LYS L CG 3617 C CD . LYS C 42 ? 0.8513 0.6834 0.7781 0.1574 -0.0787 0.0485 42 LYS L CD 3618 C CE . LYS C 42 ? 1.0340 0.8154 0.9439 0.1931 -0.1016 0.0445 42 LYS L CE 3619 N NZ . LYS C 42 ? 1.1789 0.8786 1.0150 0.1829 -0.1191 0.0671 42 LYS L NZ 3620 N N . ALA C 43 ? 0.4655 0.3349 0.3262 0.0270 -0.0310 0.0967 43 ALA L N 3621 C CA . ALA C 43 ? 0.4826 0.4001 0.3581 0.0070 -0.0208 0.1015 43 ALA L CA 3622 C C . ALA C 43 ? 0.4505 0.4221 0.3829 0.0239 -0.0160 0.0889 43 ALA L C 3623 O O . ALA C 43 ? 0.5182 0.4913 0.4674 0.0475 -0.0253 0.0794 43 ALA L O 3624 C CB . ALA C 43 ? 0.5024 0.4023 0.3324 -0.0093 -0.0293 0.1131 43 ALA L CB 3625 N N . PRO C 44 ? 0.4497 0.4653 0.4112 0.0118 -0.0026 0.0884 44 PRO L N 3626 C CA . PRO C 44 ? 0.4271 0.4855 0.4352 0.0241 0.0021 0.0770 44 PRO L CA 3627 C C . PRO C 44 ? 0.4426 0.5072 0.4455 0.0327 -0.0066 0.0725 44 PRO L C 3628 O O . PRO C 44 ? 0.4949 0.5393 0.4583 0.0230 -0.0139 0.0809 44 PRO L O 3629 C CB . PRO C 44 ? 0.4008 0.4927 0.4275 0.0087 0.0146 0.0809 44 PRO L CB 3630 C CG . PRO C 44 ? 0.3556 0.4306 0.3585 -0.0096 0.0175 0.0924 44 PRO L CG 3631 C CD . PRO C 44 ? 0.4357 0.4626 0.3883 -0.0133 0.0075 0.0982 44 PRO L CD 3632 N N . LYS C 45 ? 0.4359 0.5272 0.4740 0.0467 -0.0061 0.0597 45 LYS L N 3633 C CA . LYS C 45 ? 0.4071 0.5087 0.4418 0.0530 -0.0144 0.0540 45 LYS L CA 3634 C C . LYS C 45 ? 0.4082 0.5472 0.4748 0.0500 -0.0026 0.0431 45 LYS L C 3635 O O . LYS C 45 ? 0.3751 0.5294 0.4748 0.0539 0.0053 0.0357 45 LYS L O 3636 C CB . LYS C 45 ? 0.3997 0.4953 0.4418 0.0742 -0.0291 0.0469 45 LYS L CB 3637 C CG . LYS C 45 ? 0.4805 0.5945 0.5241 0.0801 -0.0394 0.0403 45 LYS L CG 3638 C CD . LYS C 45 ? 0.4973 0.6135 0.5539 0.1036 -0.0561 0.0331 45 LYS L CD 3639 C CE . LYS C 45 ? 0.5112 0.6484 0.5664 0.1076 -0.0699 0.0284 45 LYS L CE 3640 N NZ . LYS C 45 ? 0.5336 0.6784 0.6032 0.1333 -0.0900 0.0225 45 LYS L NZ 3641 N N . LEU C 46 ? 0.4220 0.5717 0.4748 0.0413 -0.0012 0.0412 46 LEU L N 3642 C CA . LEU C 46 ? 0.3982 0.5773 0.4774 0.0397 0.0106 0.0279 46 LEU L CA 3643 C C . LEU C 46 ? 0.3778 0.5678 0.4750 0.0498 0.0050 0.0150 46 LEU L C 3644 O O . LEU C 46 ? 0.2490 0.4362 0.3289 0.0533 -0.0088 0.0145 46 LEU L O 3645 C CB . LEU C 46 ? 0.3386 0.5287 0.3958 0.0254 0.0161 0.0257 46 LEU L CB 3646 C CG . LEU C 46 ? 0.2925 0.5091 0.3740 0.0249 0.0300 0.0083 46 LEU L CG 3647 C CD1 . LEU C 46 ? 0.2133 0.4393 0.3318 0.0316 0.0421 0.0058 46 LEU L CD1 3648 C CD2 . LEU C 46 ? 0.2816 0.5129 0.3391 0.0088 0.0375 0.0027 46 LEU L CD2 3649 N N . LEU C 47 ? 0.3095 0.5116 0.4390 0.0526 0.0142 0.0054 47 LEU L N 3650 C CA . LEU C 47 ? 0.2864 0.5028 0.4324 0.0562 0.0114 -0.0085 47 LEU L CA 3651 C C . LEU C 47 ? 0.3161 0.5431 0.4660 0.0487 0.0211 -0.0218 47 LEU L C 3652 O O . LEU C 47 ? 0.3013 0.5397 0.4429 0.0453 0.0161 -0.0315 47 LEU L O 3653 C CB . LEU C 47 ? 0.2547 0.4730 0.4264 0.0584 0.0154 -0.0118 47 LEU L CB 3654 C CG . LEU C 47 ? 0.3029 0.5145 0.4761 0.0654 0.0092 -0.0054 47 LEU L CG 3655 C CD1 . LEU C 47 ? 0.3532 0.5703 0.5488 0.0599 0.0173 -0.0109 47 LEU L CD1 3656 C CD2 . LEU C 47 ? 0.1955 0.4159 0.3640 0.0774 -0.0061 -0.0099 47 LEU L CD2 3657 N N . ILE C 48 ? 0.2741 0.4969 0.4366 0.0469 0.0344 -0.0229 48 ILE L N 3658 C CA . ILE C 48 ? 0.2425 0.4684 0.4125 0.0436 0.0456 -0.0383 48 ILE L CA 3659 C C . ILE C 48 ? 0.3144 0.5428 0.4894 0.0454 0.0571 -0.0377 48 ILE L C 3660 O O . ILE C 48 ? 0.3972 0.6223 0.5851 0.0502 0.0585 -0.0264 48 ILE L O 3661 C CB . ILE C 48 ? 0.2657 0.4814 0.4554 0.0433 0.0491 -0.0460 48 ILE L CB 3662 C CG1 . ILE C 48 ? 0.3136 0.5401 0.5013 0.0379 0.0404 -0.0531 48 ILE L CG1 3663 C CG2 . ILE C 48 ? 0.2576 0.4631 0.4534 0.0426 0.0612 -0.0609 48 ILE L CG2 3664 C CD1 . ILE C 48 ? 0.3178 0.5362 0.5187 0.0306 0.0438 -0.0598 48 ILE L CD1 3665 N N . TYR C 49 ? 0.3312 0.5705 0.4966 0.0405 0.0654 -0.0512 49 TYR L N 3666 C CA . TYR C 49 ? 0.2911 0.5426 0.4681 0.0438 0.0791 -0.0576 49 TYR L CA 3667 C C . TYR C 49 ? 0.3430 0.5881 0.5350 0.0492 0.0911 -0.0798 49 TYR L C 3668 O O . TYR C 49 ? 0.3453 0.5778 0.5291 0.0439 0.0892 -0.0902 49 TYR L O 3669 C CB . TYR C 49 ? 0.2692 0.5415 0.4198 0.0307 0.0822 -0.0578 49 TYR L CB 3670 C CG . TYR C 49 ? 0.3589 0.6349 0.4814 0.0174 0.0819 -0.0708 49 TYR L CG 3671 C CD1 . TYR C 49 ? 0.3672 0.6336 0.4641 0.0109 0.0646 -0.0611 49 TYR L CD1 3672 C CD2 . TYR C 49 ? 0.3694 0.6603 0.4912 0.0117 0.0982 -0.0939 49 TYR L CD2 3673 C CE1 . TYR C 49 ? 0.3841 0.6563 0.4538 -0.0026 0.0611 -0.0708 49 TYR L CE1 3674 C CE2 . TYR C 49 ? 0.3472 0.6421 0.4389 -0.0047 0.0978 -0.1057 49 TYR L CE2 3675 C CZ . TYR C 49 ? 0.4302 0.7160 0.4948 -0.0128 0.0780 -0.0926 49 TYR L CZ 3676 O OH . TYR C 49 ? 0.5626 0.8546 0.5957 -0.0305 0.0744 -0.1023 49 TYR L OH 3677 N N . ALA C 50 ? 0.3431 0.5973 0.5571 0.0601 0.1029 -0.0881 50 ALA L N 3678 C CA . ALA C 50 ? 0.3279 0.5691 0.5571 0.0700 0.1148 -0.1111 50 ALA L CA 3679 C C . ALA C 50 ? 0.3350 0.5358 0.5684 0.0736 0.1080 -0.1098 50 ALA L C 3680 O O . ALA C 50 ? 0.4024 0.5827 0.6275 0.0697 0.1140 -0.1286 50 ALA L O 3681 C CB . ALA C 50 ? 0.3200 0.5733 0.5268 0.0567 0.1261 -0.1343 50 ALA L CB 3682 N N . ALA C 51 ? 0.3504 0.5399 0.5920 0.0765 0.0961 -0.0881 51 ALA L N 3683 C CA . ALA C 51 ? 0.3519 0.5047 0.5949 0.0752 0.0890 -0.0834 51 ALA L CA 3684 C C . ALA C 51 ? 0.3453 0.4927 0.5669 0.0567 0.0848 -0.0891 51 ALA L C 3685 O O . ALA C 51 ? 0.3182 0.4552 0.5380 0.0490 0.0765 -0.0787 51 ALA L O 3686 C CB . ALA C 51 ? 0.3363 0.4554 0.5920 0.0889 0.0950 -0.0964 51 ALA L CB 3687 N N . SER C 52 ? 0.3740 0.5333 0.5796 0.0477 0.0905 -0.1064 52 SER L N 3688 C CA . SER C 52 ? 0.3913 0.5511 0.5796 0.0300 0.0857 -0.1140 52 SER L CA 3689 C C . SER C 52 ? 0.4084 0.6019 0.5792 0.0207 0.0803 -0.1154 52 SER L C 3690 O O . SER C 52 ? 0.4733 0.6787 0.6350 0.0089 0.0716 -0.1174 52 SER L O 3691 C CB . SER C 52 ? 0.4037 0.5333 0.5825 0.0222 0.0951 -0.1360 52 SER L CB 3692 O OG . SER C 52 ? 0.3937 0.5279 0.5671 0.0258 0.1078 -0.1544 52 SER L OG 3693 N N . SER C 53 ? 0.4492 0.6597 0.6143 0.0246 0.0842 -0.1142 53 SER L N 3694 C CA . SER C 53 ? 0.4351 0.6696 0.5753 0.0132 0.0772 -0.1141 53 SER L CA 3695 C C . SER C 53 ? 0.4468 0.6915 0.5839 0.0166 0.0594 -0.0925 53 SER L C 3696 O O . SER C 53 ? 0.4554 0.6973 0.6000 0.0256 0.0576 -0.0768 53 SER L O 3697 C CB . SER C 53 ? 0.4698 0.7174 0.5980 0.0105 0.0883 -0.1209 53 SER L CB 3698 O OG . SER C 53 ? 0.5394 0.7796 0.6696 0.0083 0.1058 -0.1461 53 SER L OG 3699 N N . LEU C 54 ? 0.4295 0.6869 0.5560 0.0097 0.0460 -0.0930 54 LEU L N 3700 C CA . LEU C 54 ? 0.3600 0.6259 0.4854 0.0172 0.0278 -0.0761 54 LEU L CA 3701 C C . LEU C 54 ? 0.4064 0.6734 0.5028 0.0156 0.0187 -0.0640 54 LEU L C 3702 O O . LEU C 54 ? 0.3711 0.6454 0.4425 0.0025 0.0192 -0.0711 54 LEU L O 3703 C CB . LEU C 54 ? 0.3342 0.6205 0.4637 0.0131 0.0151 -0.0830 54 LEU L CB 3704 C CG . LEU C 54 ? 0.4191 0.7191 0.5650 0.0250 -0.0000 -0.0743 54 LEU L CG 3705 C CD1 . LEU C 54 ? 0.4551 0.7404 0.6229 0.0322 0.0087 -0.0686 54 LEU L CD1 3706 C CD2 . LEU C 54 ? 0.3919 0.7233 0.5471 0.0168 -0.0076 -0.0883 54 LEU L CD2 3707 N N . GLN C 55 ? 0.4367 0.6930 0.5316 0.0254 0.0110 -0.0460 55 GLN L N 3708 C CA . GLN C 55 ? 0.4282 0.6760 0.4883 0.0216 -0.0007 -0.0316 55 GLN L CA 3709 C C . GLN C 55 ? 0.4445 0.6983 0.4862 0.0229 -0.0241 -0.0279 55 GLN L C 3710 O O . GLN C 55 ? 0.4489 0.7150 0.5130 0.0344 -0.0341 -0.0312 55 GLN L O 3711 C CB . GLN C 55 ? 0.4385 0.6669 0.4987 0.0303 -0.0035 -0.0141 55 GLN L CB 3712 C CG . GLN C 55 ? 0.5291 0.7367 0.5471 0.0260 -0.0195 0.0033 55 GLN L CG 3713 C CD . GLN C 55 ? 0.5604 0.7695 0.5441 0.0041 -0.0113 0.0035 55 GLN L CD 3714 O OE1 . GLN C 55 ? 0.5932 0.8225 0.5908 -0.0042 0.0086 -0.0113 55 GLN L OE1 3715 N NE2 . GLN C 55 ? 0.5686 0.7548 0.5056 -0.0060 -0.0266 0.0192 55 GLN L NE2 3716 N N . SER C 56 ? 0.4600 0.7083 0.4606 0.0097 -0.0333 -0.0215 56 SER L N 3717 C CA . SER C 56 ? 0.5054 0.7569 0.4823 0.0103 -0.0598 -0.0147 56 SER L CA 3718 C C . SER C 56 ? 0.4994 0.7386 0.4867 0.0352 -0.0820 -0.0009 56 SER L C 3719 O O . SER C 56 ? 0.5165 0.7245 0.4897 0.0419 -0.0856 0.0141 56 SER L O 3720 C CB . SER C 56 ? 0.5827 0.8193 0.5040 -0.0111 -0.0671 -0.0048 56 SER L CB 3721 O OG . SER C 56 ? 0.7442 0.9810 0.6383 -0.0114 -0.0965 0.0044 56 SER L OG 3722 N N . GLY C 57 ? 0.4539 0.7198 0.4668 0.0481 -0.0958 -0.0082 57 GLY L N 3723 C CA . GLY C 57 ? 0.4490 0.7120 0.4789 0.0754 -0.1162 -0.0006 57 GLY L CA 3724 C C . GLY C 57 ? 0.4297 0.7121 0.5097 0.0886 -0.1024 -0.0132 57 GLY L C 3725 O O . GLY C 57 ? 0.5021 0.8054 0.6088 0.1089 -0.1161 -0.0176 57 GLY L O 3726 N N . VAL C 58 ? 0.3831 0.6604 0.4755 0.0768 -0.0759 -0.0196 58 VAL L N 3727 C CA . VAL C 58 ? 0.3404 0.6309 0.4723 0.0827 -0.0619 -0.0297 58 VAL L CA 3728 C C . VAL C 58 ? 0.3528 0.6867 0.5123 0.0772 -0.0610 -0.0487 58 VAL L C 3729 O O . VAL C 58 ? 0.3765 0.7210 0.5275 0.0594 -0.0547 -0.0578 58 VAL L O 3730 C CB . VAL C 58 ? 0.3286 0.6000 0.4629 0.0705 -0.0375 -0.0293 58 VAL L CB 3731 C CG1 . VAL C 58 ? 0.2547 0.5343 0.4221 0.0728 -0.0258 -0.0367 58 VAL L CG1 3732 C CG2 . VAL C 58 ? 0.3211 0.5580 0.4278 0.0710 -0.0375 -0.0119 58 VAL L CG2 3733 N N . PRO C 59 ? 0.3407 0.7016 0.5319 0.0903 -0.0663 -0.0567 59 PRO L N 3734 C CA . PRO C 59 ? 0.3033 0.7141 0.5217 0.0825 -0.0664 -0.0758 59 PRO L CA 3735 C C . PRO C 59 ? 0.2597 0.6690 0.4789 0.0555 -0.0441 -0.0876 59 PRO L C 3736 O O . PRO C 59 ? 0.2487 0.6242 0.4632 0.0497 -0.0273 -0.0827 59 PRO L O 3737 C CB . PRO C 59 ? 0.2598 0.6934 0.5124 0.0989 -0.0673 -0.0830 59 PRO L CB 3738 C CG . PRO C 59 ? 0.2932 0.6924 0.5325 0.1237 -0.0800 -0.0669 59 PRO L CG 3739 C CD . PRO C 59 ? 0.3606 0.7086 0.5623 0.1121 -0.0719 -0.0501 59 PRO L CD 3740 N N . SER C 60 ? 0.2297 0.6733 0.4533 0.0392 -0.0455 -0.1027 60 SER L N 3741 C CA . SER C 60 ? 0.2508 0.6835 0.4676 0.0124 -0.0261 -0.1149 60 SER L CA 3742 C C . SER C 60 ? 0.2869 0.7223 0.5242 0.0022 -0.0117 -0.1232 60 SER L C 3743 O O . SER C 60 ? 0.3391 0.7577 0.5680 -0.0205 0.0027 -0.1323 60 SER L O 3744 C CB . SER C 60 ? 0.2523 0.7181 0.4606 -0.0067 -0.0323 -0.1292 60 SER L CB 3745 O OG . SER C 60 ? 0.3520 0.8766 0.5875 -0.0057 -0.0445 -0.1398 60 SER L OG 3746 N N . ARG C 61 ? 0.2940 0.7462 0.5541 0.0174 -0.0156 -0.1206 61 ARG L N 3747 C CA . ARG C 61 ? 0.2769 0.7343 0.5525 0.0039 -0.0018 -0.1286 61 ARG L CA 3748 C C . ARG C 61 ? 0.3291 0.7293 0.5902 0.0008 0.0120 -0.1152 61 ARG L C 3749 O O . ARG C 61 ? 0.3535 0.7418 0.6152 -0.0174 0.0240 -0.1186 61 ARG L O 3750 C CB . ARG C 61 ? 0.2080 0.6909 0.5027 0.0200 -0.0083 -0.1305 61 ARG L CB 3751 C CG . ARG C 61 ? 0.3073 0.7574 0.6000 0.0438 -0.0106 -0.1146 61 ARG L CG 3752 C CD . ARG C 61 ? 0.2861 0.7497 0.5900 0.0597 -0.0165 -0.1183 61 ARG L CD 3753 N NE . ARG C 61 ? 0.3983 0.8807 0.7063 0.0826 -0.0372 -0.1172 61 ARG L NE 3754 C CZ . ARG C 61 ? 0.3927 0.8549 0.6980 0.1101 -0.0499 -0.1066 61 ARG L CZ 3755 N NH1 . ARG C 61 ? 0.2107 0.6371 0.5097 0.1167 -0.0423 -0.0979 61 ARG L NH1 3756 N NH2 . ARG C 61 ? 0.4635 0.9399 0.7704 0.1300 -0.0715 -0.1043 61 ARG L NH2 3757 N N . PHE C 62 ? 0.2899 0.6569 0.5362 0.0166 0.0090 -0.0996 62 PHE L N 3758 C CA . PHE C 62 ? 0.2194 0.5396 0.4545 0.0155 0.0199 -0.0870 62 PHE L CA 3759 C C . PHE C 62 ? 0.2821 0.5767 0.5016 0.0028 0.0286 -0.0919 62 PHE L C 3760 O O . PHE C 62 ? 0.2663 0.5656 0.4737 0.0037 0.0252 -0.0962 62 PHE L O 3761 C CB . PHE C 62 ? 0.2878 0.5903 0.5145 0.0353 0.0140 -0.0701 62 PHE L CB 3762 C CG . PHE C 62 ? 0.2413 0.5530 0.4788 0.0487 0.0078 -0.0650 62 PHE L CG 3763 C CD1 . PHE C 62 ? 0.2374 0.5311 0.4784 0.0459 0.0163 -0.0578 62 PHE L CD1 3764 C CD2 . PHE C 62 ? 0.2939 0.6303 0.5367 0.0648 -0.0074 -0.0681 62 PHE L CD2 3765 C CE1 . PHE C 62 ? 0.2796 0.5793 0.5280 0.0568 0.0129 -0.0564 62 PHE L CE1 3766 C CE2 . PHE C 62 ? 0.2662 0.6063 0.5193 0.0804 -0.0123 -0.0665 62 PHE L CE2 3767 C CZ . PHE C 62 ? 0.2380 0.5594 0.4932 0.0754 -0.0006 -0.0620 62 PHE L CZ 3768 N N . SER C 63 ? 0.3677 0.6319 0.5849 -0.0089 0.0391 -0.0915 63 SER L N 3769 C CA . SER C 63 ? 0.3499 0.5825 0.5531 -0.0181 0.0475 -0.0986 63 SER L CA 3770 C C . SER C 63 ? 0.3438 0.5331 0.5465 -0.0115 0.0539 -0.0868 63 SER L C 3771 O O . SER C 63 ? 0.3535 0.5269 0.5586 -0.0187 0.0546 -0.0793 63 SER L O 3772 C CB . SER C 63 ? 0.3589 0.5940 0.5547 -0.0441 0.0512 -0.1150 63 SER L CB 3773 O OG . SER C 63 ? 0.4063 0.5996 0.5844 -0.0525 0.0596 -0.1231 63 SER L OG 3774 N N . GLY C 64 ? 0.3594 0.5334 0.5591 0.0013 0.0579 -0.0857 64 GLY L N 3775 C CA . GLY C 64 ? 0.3702 0.5105 0.5748 0.0115 0.0622 -0.0764 64 GLY L CA 3776 C C . GLY C 64 ? 0.3309 0.4351 0.5271 0.0086 0.0699 -0.0902 64 GLY L C 3777 O O . GLY C 64 ? 0.4081 0.5178 0.5943 0.0042 0.0751 -0.1071 64 GLY L O 3778 N N . SER C 65 ? 0.3621 0.4254 0.5590 0.0104 0.0695 -0.0832 65 SER L N 3779 C CA . SER C 65 ? 0.4212 0.4382 0.6093 0.0128 0.0753 -0.0957 65 SER L CA 3780 C C . SER C 65 ? 0.4513 0.4355 0.6527 0.0335 0.0716 -0.0822 65 SER L C 3781 O O . SER C 65 ? 0.4281 0.4280 0.6431 0.0408 0.0647 -0.0625 65 SER L O 3782 C CB . SER C 65 ? 0.4508 0.4362 0.6141 -0.0147 0.0752 -0.1049 65 SER L CB 3783 O OG . SER C 65 ? 0.5541 0.5244 0.7127 -0.0276 0.0675 -0.0885 65 SER L OG 3784 N N . GLY C 66 ? 0.4567 0.3950 0.6538 0.0435 0.0754 -0.0936 66 GLY L N 3785 C CA . GLY C 66 ? 0.4918 0.3961 0.7036 0.0669 0.0686 -0.0819 66 GLY L CA 3786 C C . GLY C 66 ? 0.5442 0.4650 0.7820 0.0976 0.0770 -0.0947 66 GLY L C 3787 O O . GLY C 66 ? 0.5573 0.5266 0.8025 0.0986 0.0873 -0.1062 66 GLY L O 3788 N N . SER C 67 ? 0.5937 0.4749 0.8447 0.1224 0.0719 -0.0931 67 SER L N 3789 C CA . SER C 67 ? 0.5804 0.4810 0.8622 0.1547 0.0809 -0.1094 67 SER L CA 3790 C C . SER C 67 ? 0.6374 0.5099 0.9445 0.1863 0.0671 -0.0962 67 SER L C 3791 O O . SER C 67 ? 0.7398 0.5411 1.0301 0.1892 0.0556 -0.0905 67 SER L O 3792 C CB . SER C 67 ? 0.6151 0.4897 0.8826 0.1547 0.0970 -0.1431 67 SER L CB 3793 O OG . SER C 67 ? 0.7131 0.6107 1.0122 0.1858 0.1085 -0.1634 67 SER L OG 3794 N N . GLY C 68 ? 0.5866 0.5153 0.9320 0.2085 0.0667 -0.0906 68 GLY L N 3795 C CA . GLY C 68 ? 0.5947 0.5118 0.9717 0.2418 0.0517 -0.0783 68 GLY L CA 3796 C C . GLY C 68 ? 0.5851 0.5227 0.9670 0.2337 0.0330 -0.0428 68 GLY L C 3797 O O . GLY C 68 ? 0.5563 0.5603 0.9623 0.2388 0.0339 -0.0355 68 GLY L O 3798 N N . THR C 69 ? 0.6441 0.5246 0.9951 0.2156 0.0168 -0.0211 69 THR L N 3799 C CA . THR C 69 ? 0.5054 0.3969 0.8548 0.2043 -0.0014 0.0122 69 THR L CA 3800 C C . THR C 69 ? 0.6027 0.4906 0.9138 0.1616 0.0004 0.0229 69 THR L C 3801 O O . THR C 69 ? 0.4557 0.3891 0.7693 0.1471 -0.0003 0.0373 69 THR L O 3802 C CB . THR C 69 ? 0.6583 0.4867 1.0052 0.2208 -0.0266 0.0325 69 THR L CB 3803 O OG1 . THR C 69 ? 0.7709 0.6254 1.1535 0.2611 -0.0316 0.0270 69 THR L OG1 3804 C CG2 . THR C 69 ? 0.6603 0.4881 0.9894 0.1963 -0.0450 0.0671 69 THR L CG2 3805 N N . ASP C 70 ? 0.5988 0.4336 0.8747 0.1411 0.0034 0.0140 70 ASP L N 3806 C CA . ASP C 70 ? 0.5637 0.3962 0.8062 0.1012 0.0046 0.0214 70 ASP L CA 3807 C C . ASP C 70 ? 0.5150 0.3914 0.7546 0.0872 0.0235 0.0001 70 ASP L C 3808 O O . ASP C 70 ? 0.5622 0.4251 0.7953 0.0888 0.0343 -0.0230 70 ASP L O 3809 C CB . ASP C 70 ? 0.6696 0.4243 0.8718 0.0800 -0.0041 0.0252 70 ASP L CB 3810 C CG . ASP C 70 ? 0.7944 0.4937 0.9927 0.0941 -0.0271 0.0486 70 ASP L CG 3811 O OD1 . ASP C 70 ? 0.9591 0.5823 1.1328 0.0960 -0.0347 0.0457 70 ASP L OD1 3812 O OD2 . ASP C 70 ? 0.7208 0.4498 0.9378 0.1026 -0.0390 0.0706 70 ASP L OD2 3813 N N . PHE C 71 ? 0.4064 0.3325 0.6487 0.0733 0.0260 0.0082 71 PHE L N 3814 C CA . PHE C 71 ? 0.3734 0.3396 0.6117 0.0615 0.0389 -0.0080 71 PHE L CA 3815 C C . PHE C 71 ? 0.3987 0.3765 0.6190 0.0326 0.0374 -0.0014 71 PHE L C 3816 O O . PHE C 71 ? 0.3632 0.3350 0.5784 0.0225 0.0290 0.0173 71 PHE L O 3817 C CB . PHE C 71 ? 0.4045 0.4246 0.6658 0.0781 0.0449 -0.0096 71 PHE L CB 3818 C CG . PHE C 71 ? 0.4156 0.4387 0.6987 0.1051 0.0501 -0.0214 71 PHE L CG 3819 C CD1 . PHE C 71 ? 0.3975 0.4247 0.6780 0.1086 0.0631 -0.0466 71 PHE L CD1 3820 C CD2 . PHE C 71 ? 0.4368 0.4635 0.7443 0.1264 0.0421 -0.0089 71 PHE L CD2 3821 C CE1 . PHE C 71 ? 0.4102 0.4442 0.7122 0.1329 0.0707 -0.0618 71 PHE L CE1 3822 C CE2 . PHE C 71 ? 0.4344 0.4723 0.7681 0.1537 0.0480 -0.0235 71 PHE L CE2 3823 C CZ . PHE C 71 ? 0.4294 0.4706 0.7603 0.1570 0.0637 -0.0514 71 PHE L CZ 3824 N N . THR C 72 ? 0.4418 0.4399 0.6532 0.0192 0.0455 -0.0183 72 THR L N 3825 C CA . THR C 72 ? 0.4400 0.4555 0.6393 -0.0062 0.0456 -0.0183 72 THR L CA 3826 C C . THR C 72 ? 0.4449 0.5107 0.6519 -0.0045 0.0508 -0.0303 72 THR L C 3827 O O . THR C 72 ? 0.4402 0.5155 0.6476 0.0016 0.0555 -0.0453 72 THR L O 3828 C CB . THR C 72 ? 0.4994 0.4793 0.6739 -0.0324 0.0462 -0.0275 72 THR L CB 3829 O OG1 . THR C 72 ? 0.5546 0.4840 0.7142 -0.0397 0.0373 -0.0107 72 THR L OG1 3830 C CG2 . THR C 72 ? 0.5530 0.5690 0.7212 -0.0582 0.0499 -0.0361 72 THR L CG2 3831 N N . LEU C 73 ? 0.4463 0.5415 0.6574 -0.0094 0.0489 -0.0235 73 LEU L N 3832 C CA . LEU C 73 ? 0.4067 0.5439 0.6232 -0.0072 0.0501 -0.0337 73 LEU L CA 3833 C C . LEU C 73 ? 0.4283 0.5833 0.6412 -0.0289 0.0514 -0.0448 73 LEU L C 3834 O O . LEU C 73 ? 0.3980 0.5550 0.6094 -0.0413 0.0516 -0.0389 73 LEU L O 3835 C CB . LEU C 73 ? 0.4036 0.5599 0.6271 0.0060 0.0471 -0.0215 73 LEU L CB 3836 C CG . LEU C 73 ? 0.4053 0.5962 0.6317 0.0109 0.0445 -0.0300 73 LEU L CG 3837 C CD1 . LEU C 73 ? 0.4373 0.6393 0.6610 0.0191 0.0432 -0.0402 73 LEU L CD1 3838 C CD2 . LEU C 73 ? 0.2836 0.4801 0.5096 0.0206 0.0413 -0.0176 73 LEU L CD2 3839 N N . THR C 74 ? 0.4242 0.5967 0.6354 -0.0360 0.0529 -0.0623 74 THR L N 3840 C CA . THR C 74 ? 0.3820 0.5826 0.5932 -0.0585 0.0548 -0.0763 74 THR L CA 3841 C C . THR C 74 ? 0.3655 0.6208 0.5943 -0.0469 0.0504 -0.0865 74 THR L C 3842 O O . THR C 74 ? 0.4029 0.6701 0.6332 -0.0332 0.0458 -0.0904 74 THR L O 3843 C CB . THR C 74 ? 0.4753 0.6578 0.6694 -0.0811 0.0586 -0.0900 74 THR L CB 3844 O OG1 . THR C 74 ? 0.5755 0.6977 0.7506 -0.0894 0.0598 -0.0796 74 THR L OG1 3845 C CG2 . THR C 74 ? 0.4130 0.6342 0.6075 -0.1093 0.0614 -0.1060 74 THR L CG2 3846 N N . ILE C 75 ? 0.3342 0.6219 0.5752 -0.0519 0.0512 -0.0912 75 ILE L N 3847 C CA . ILE C 75 ? 0.3156 0.6567 0.5773 -0.0381 0.0451 -0.1031 75 ILE L CA 3848 C C . ILE C 75 ? 0.3409 0.7276 0.6123 -0.0622 0.0491 -0.1245 75 ILE L C 3849 O O . ILE C 75 ? 0.3721 0.7662 0.6432 -0.0815 0.0570 -0.1291 75 ILE L O 3850 C CB . ILE C 75 ? 0.2921 0.6400 0.5648 -0.0192 0.0431 -0.0958 75 ILE L CB 3851 C CG1 . ILE C 75 ? 0.2642 0.5652 0.5223 -0.0064 0.0420 -0.0737 75 ILE L CG1 3852 C CG2 . ILE C 75 ? 0.3182 0.7007 0.6047 0.0048 0.0316 -0.1031 75 ILE L CG2 3853 C CD1 . ILE C 75 ? 0.2667 0.5648 0.5274 0.0067 0.0410 -0.0657 75 ILE L CD1 3854 N N . SER C 76 ? 0.5376 0.6473 0.6568 -0.1740 0.0508 -0.0114 76 SER L N 3855 C CA . SER C 76 ? 0.5974 0.7276 0.7638 -0.2038 0.0561 -0.0232 76 SER L CA 3856 C C . SER C 76 ? 0.6879 0.8841 0.9222 -0.2093 0.0677 -0.0321 76 SER L C 3857 O O . SER C 76 ? 0.8579 1.0684 1.1225 -0.2321 0.0942 -0.0303 76 SER L O 3858 C CB . SER C 76 ? 0.6075 0.7345 0.7830 -0.2105 0.0232 -0.0418 76 SER L CB 3859 O OG . SER C 76 ? 0.6187 0.7850 0.8124 -0.1892 -0.0058 -0.0501 76 SER L OG 3860 N N . SER C 77 ? 0.5501 0.7843 0.8105 -0.1855 0.0492 -0.0398 77 SER L N 3861 C CA . SER C 77 ? 0.5242 0.8234 0.8547 -0.1842 0.0606 -0.0520 77 SER L CA 3862 C C . SER C 77 ? 0.4440 0.7539 0.7730 -0.1500 0.0546 -0.0521 77 SER L C 3863 O O . SER C 77 ? 0.4067 0.7278 0.7538 -0.1291 0.0235 -0.0554 77 SER L O 3864 C CB . SER C 77 ? 0.5396 0.8912 0.9453 -0.1952 0.0355 -0.0719 77 SER L CB 3865 O OG . SER C 77 ? 0.6282 0.9661 1.0125 -0.1779 -0.0087 -0.0749 77 SER L OG 3866 N N . LEU C 78 ? 0.3772 0.6799 0.6823 -0.1439 0.0834 -0.0486 78 LEU L N 3867 C CA . LEU C 78 ? 0.3636 0.6616 0.6607 -0.1144 0.0786 -0.0522 78 LEU L CA 3868 C C . LEU C 78 ? 0.3280 0.6693 0.6927 -0.0929 0.0618 -0.0678 78 LEU L C 3869 O O . LEU C 78 ? 0.2664 0.6639 0.6934 -0.0964 0.0736 -0.0838 78 LEU L O 3870 C CB . LEU C 78 ? 0.4610 0.7592 0.7302 -0.1125 0.1113 -0.0564 78 LEU L CB 3871 C CG . LEU C 78 ? 0.5386 0.7850 0.7315 -0.1135 0.1167 -0.0410 78 LEU L CG 3872 C CD1 . LEU C 78 ? 0.6598 0.9167 0.8281 -0.1017 0.1388 -0.0527 78 LEU L CD1 3873 C CD2 . LEU C 78 ? 0.4571 0.6655 0.6302 -0.0993 0.0877 -0.0327 78 LEU L CD2 3874 N N . GLN C 79 ? 0.2275 0.5424 0.5840 -0.0695 0.0361 -0.0610 79 GLN L N 3875 C CA . GLN C 79 ? 0.3003 0.6414 0.7154 -0.0426 0.0182 -0.0710 79 GLN L CA 3876 C C . GLN C 79 ? 0.2673 0.5891 0.6805 -0.0230 0.0294 -0.0814 79 GLN L C 3877 O O . GLN C 79 ? 0.2803 0.5642 0.6413 -0.0294 0.0400 -0.0762 79 GLN L O 3878 C CB . GLN C 79 ? 0.2864 0.6065 0.6941 -0.0291 -0.0199 -0.0520 79 GLN L CB 3879 C CG . GLN C 79 ? 0.2998 0.6402 0.7067 -0.0456 -0.0385 -0.0503 79 GLN L CG 3880 C CD . GLN C 79 ? 0.3861 0.7983 0.8748 -0.0501 -0.0411 -0.0731 79 GLN L CD 3881 O OE1 . GLN C 79 ? 0.4516 0.8890 0.9560 -0.0798 -0.0243 -0.0836 79 GLN L OE1 3882 N NE2 . GLN C 79 ? 0.3396 0.7849 0.8878 -0.0206 -0.0614 -0.0798 79 GLN L NE2 3883 N N . PRO C 80 ? 0.2769 0.6261 0.7517 0.0021 0.0253 -0.1002 80 PRO L N 3884 C CA . PRO C 80 ? 0.2527 0.5802 0.7347 0.0231 0.0318 -0.1183 80 PRO L CA 3885 C C . PRO C 80 ? 0.3102 0.5714 0.7491 0.0235 0.0182 -0.1000 80 PRO L C 3886 O O . PRO C 80 ? 0.2947 0.5343 0.7123 0.0238 0.0288 -0.1155 80 PRO L O 3887 C CB . PRO C 80 ? 0.2660 0.6181 0.8259 0.0545 0.0147 -0.1305 80 PRO L CB 3888 C CG . PRO C 80 ? 0.2548 0.6698 0.8581 0.0473 0.0103 -0.1303 80 PRO L CG 3889 C CD . PRO C 80 ? 0.3114 0.7240 0.8611 0.0104 0.0191 -0.1137 80 PRO L CD 3890 N N . GLU C 81 ? 0.2729 0.5065 0.6994 0.0232 -0.0047 -0.0685 81 GLU L N 3891 C CA . GLU C 81 ? 0.2750 0.4518 0.6733 0.0230 -0.0135 -0.0464 81 GLU L CA 3892 C C . GLU C 81 ? 0.3224 0.4816 0.6601 -0.0006 -0.0005 -0.0373 81 GLU L C 3893 O O . GLU C 81 ? 0.3008 0.4227 0.6232 -0.0034 -0.0025 -0.0240 81 GLU L O 3894 C CB . GLU C 81 ? 0.3237 0.4796 0.7224 0.0344 -0.0376 -0.0119 81 GLU L CB 3895 C CG . GLU C 81 ? 0.4352 0.6180 0.8062 0.0251 -0.0480 0.0008 81 GLU L CG 3896 C CD . GLU C 81 ? 0.6085 0.8459 1.0333 0.0373 -0.0618 -0.0160 81 GLU L CD 3897 O OE1 . GLU C 81 ? 0.5359 0.7996 1.0166 0.0503 -0.0537 -0.0417 81 GLU L OE1 3898 O OE2 . GLU C 81 ? 0.7591 1.0170 1.1734 0.0349 -0.0818 -0.0069 81 GLU L OE2 3899 N N . ASP C 82 ? 0.3575 0.5436 0.6679 -0.0173 0.0135 -0.0437 82 ASP L N 3900 C CA . ASP C 82 ? 0.3532 0.5203 0.6074 -0.0353 0.0240 -0.0337 82 ASP L CA 3901 C C . ASP C 82 ? 0.3922 0.5570 0.6288 -0.0361 0.0379 -0.0532 82 ASP L C 3902 O O . ASP C 82 ? 0.4433 0.5906 0.6374 -0.0450 0.0420 -0.0453 82 ASP L O 3903 C CB . ASP C 82 ? 0.2982 0.4833 0.5301 -0.0533 0.0317 -0.0287 82 ASP L CB 3904 C CG . ASP C 82 ? 0.3279 0.5159 0.5668 -0.0528 0.0117 -0.0148 82 ASP L CG 3905 O OD1 . ASP C 82 ? 0.3275 0.4919 0.5618 -0.0398 -0.0042 0.0021 82 ASP L OD1 3906 O OD2 . ASP C 82 ? 0.3296 0.5433 0.5777 -0.0659 0.0118 -0.0208 82 ASP L OD2 3907 N N . PHE C 83 ? 0.3292 0.5131 0.5965 -0.0232 0.0431 -0.0811 83 PHE L N 3908 C CA . PHE C 83 ? 0.3277 0.5125 0.5690 -0.0201 0.0530 -0.1055 83 PHE L CA 3909 C C . PHE C 83 ? 0.3619 0.5124 0.6111 -0.0149 0.0351 -0.1108 83 PHE L C 3910 O O . PHE C 83 ? 0.4608 0.5984 0.7577 -0.0023 0.0240 -0.1256 83 PHE L O 3911 C CB . PHE C 83 ? 0.2962 0.5160 0.5634 -0.0059 0.0679 -0.1393 83 PHE L CB 3912 C CG . PHE C 83 ? 0.3454 0.6078 0.6102 -0.0158 0.0929 -0.1358 83 PHE L CG 3913 C CD1 . PHE C 83 ? 0.3225 0.6146 0.6450 -0.0137 0.0906 -0.1327 83 PHE L CD1 3914 C CD2 . PHE C 83 ? 0.4025 0.6752 0.6105 -0.0280 0.1176 -0.1330 83 PHE L CD2 3915 C CE1 . PHE C 83 ? 0.3952 0.7322 0.7312 -0.0276 0.1137 -0.1314 83 PHE L CE1 3916 C CE2 . PHE C 83 ? 0.4666 0.7760 0.6808 -0.0424 0.1454 -0.1259 83 PHE L CE2 3917 C CZ . PHE C 83 ? 0.4524 0.7967 0.7368 -0.0443 0.1440 -0.1271 83 PHE L CZ 3918 N N . ALA C 84 ? 0.3162 0.4517 0.5257 -0.0248 0.0319 -0.0985 84 ALA L N 3919 C CA . ALA C 84 ? 0.3424 0.4541 0.5694 -0.0246 0.0151 -0.1029 84 ALA L CA 3920 C C . ALA C 84 ? 0.3748 0.4871 0.5543 -0.0305 0.0128 -0.0984 84 ALA L C 3921 O O . ALA C 84 ? 0.3391 0.4638 0.4657 -0.0317 0.0247 -0.0946 84 ALA L O 3922 C CB . ALA C 84 ? 0.2818 0.3688 0.5455 -0.0289 0.0082 -0.0730 84 ALA L CB 3923 N N . THR C 85 ? 0.3146 0.4136 0.5184 -0.0337 -0.0022 -0.0966 85 THR L N 3924 C CA . THR C 85 ? 0.3394 0.4427 0.5103 -0.0355 -0.0087 -0.0900 85 THR L CA 3925 C C . THR C 85 ? 0.3480 0.4404 0.5189 -0.0433 -0.0006 -0.0522 85 THR L C 3926 O O . THR C 85 ? 0.3375 0.4179 0.5484 -0.0485 0.0024 -0.0359 85 THR L O 3927 C CB . THR C 85 ? 0.3666 0.4739 0.5727 -0.0334 -0.0324 -0.1181 85 THR L CB 3928 O OG1 . THR C 85 ? 0.4166 0.5321 0.6143 -0.0231 -0.0410 -0.1602 85 THR L OG1 3929 C CG2 . THR C 85 ? 0.3968 0.5163 0.5732 -0.0303 -0.0441 -0.1121 85 THR L CG2 3930 N N . TYR C 86 ? 0.3589 0.4518 0.4803 -0.0421 0.0044 -0.0377 86 TYR L N 3931 C CA . TYR C 86 ? 0.3395 0.4210 0.4550 -0.0456 0.0129 -0.0088 86 TYR L CA 3932 C C . TYR C 86 ? 0.4110 0.4988 0.5275 -0.0390 0.0033 -0.0065 86 TYR L C 3933 O O . TYR C 86 ? 0.3671 0.4621 0.4529 -0.0300 -0.0083 -0.0177 86 TYR L O 3934 C CB . TYR C 86 ? 0.3355 0.4060 0.4028 -0.0492 0.0273 0.0058 86 TYR L CB 3935 C CG . TYR C 86 ? 0.3443 0.4182 0.4252 -0.0551 0.0336 0.0040 86 TYR L CG 3936 C CD1 . TYR C 86 ? 0.3712 0.4604 0.4502 -0.0548 0.0374 -0.0141 86 TYR L CD1 3937 C CD2 . TYR C 86 ? 0.2928 0.3587 0.3884 -0.0576 0.0352 0.0198 86 TYR L CD2 3938 C CE1 . TYR C 86 ? 0.3941 0.4944 0.4980 -0.0569 0.0413 -0.0176 86 TYR L CE1 3939 C CE2 . TYR C 86 ? 0.3516 0.4249 0.4631 -0.0587 0.0343 0.0180 86 TYR L CE2 3940 C CZ . TYR C 86 ? 0.3617 0.4541 0.4839 -0.0583 0.0366 -0.0014 86 TYR L CZ 3941 O OH . TYR C 86 ? 0.2906 0.3979 0.4401 -0.0563 0.0341 -0.0049 86 TYR L OH 3942 N N . TYR C 87 ? 0.3887 0.4771 0.5404 -0.0411 0.0087 0.0089 87 TYR L N 3943 C CA . TYR C 87 ? 0.3895 0.4936 0.5613 -0.0333 0.0008 0.0099 87 TYR L CA 3944 C C . TYR C 87 ? 0.4203 0.5144 0.5700 -0.0268 0.0176 0.0327 87 TYR L C 3945 O O . TYR C 87 ? 0.3224 0.4041 0.4678 -0.0320 0.0363 0.0486 87 TYR L O 3946 C CB . TYR C 87 ? 0.3461 0.4703 0.5996 -0.0414 -0.0052 0.0022 87 TYR L CB 3947 C CG . TYR C 87 ? 0.3315 0.4667 0.6152 -0.0444 -0.0298 -0.0310 87 TYR L CG 3948 C CD1 . TYR C 87 ? 0.2766 0.4348 0.5573 -0.0338 -0.0574 -0.0552 87 TYR L CD1 3949 C CD2 . TYR C 87 ? 0.3175 0.4384 0.6316 -0.0547 -0.0282 -0.0404 87 TYR L CD2 3950 C CE1 . TYR C 87 ? 0.3059 0.4741 0.6075 -0.0347 -0.0829 -0.0927 87 TYR L CE1 3951 C CE2 . TYR C 87 ? 0.3076 0.4340 0.6498 -0.0555 -0.0510 -0.0777 87 TYR L CE2 3952 C CZ . TYR C 87 ? 0.3296 0.4806 0.6633 -0.0463 -0.0784 -0.1062 87 TYR L CZ 3953 O OH . TYR C 87 ? 0.3837 0.5401 0.7386 -0.0454 -0.1040 -0.1502 87 TYR L OH 3954 N N . CYS C 88 ? 0.4504 0.5488 0.5829 -0.0118 0.0084 0.0323 88 CYS L N 3955 C CA . CYS C 88 ? 0.4305 0.5217 0.5542 0.0004 0.0213 0.0471 88 CYS L CA 3956 C C . CYS C 88 ? 0.4440 0.5718 0.6417 0.0034 0.0254 0.0474 88 CYS L C 3957 O O . CYS C 88 ? 0.2875 0.4462 0.5414 -0.0012 0.0079 0.0331 88 CYS L O 3958 C CB . CYS C 88 ? 0.3477 0.4235 0.4255 0.0190 0.0080 0.0488 88 CYS L CB 3959 S SG . CYS C 88 ? 1.3227 1.3552 1.3534 0.0306 0.0268 0.0647 88 CYS L SG 3960 N N . GLN C 89 ? 0.5011 0.6278 0.7025 0.0104 0.0495 0.0608 89 GLN L N 3961 C CA . GLN C 89 ? 0.3891 0.5577 0.6650 0.0152 0.0607 0.0631 89 GLN L CA 3962 C C . GLN C 89 ? 0.4077 0.5732 0.6675 0.0358 0.0841 0.0715 89 GLN L C 3963 O O . GLN C 89 ? 0.3425 0.4761 0.5472 0.0359 0.1051 0.0800 89 GLN L O 3964 C CB . GLN C 89 ? 0.3116 0.4941 0.6380 -0.0069 0.0801 0.0730 89 GLN L CB 3965 C CG . GLN C 89 ? 0.3107 0.5436 0.7323 -0.0089 0.0937 0.0756 89 GLN L CG 3966 C CD . GLN C 89 ? 0.4195 0.6546 0.8697 -0.0259 0.1316 0.1003 89 GLN L CD 3967 O OE1 . GLN C 89 ? 0.5124 0.7121 0.8965 -0.0272 0.1496 0.1173 89 GLN L OE1 3968 N NE2 . GLN C 89 ? 0.4375 0.7081 0.9743 -0.0382 0.1398 0.1011 89 GLN L NE2 3969 N N . GLN C 90 ? 0.4071 0.6082 0.7176 0.0554 0.0783 0.0654 90 GLN L N 3970 C CA . GLN C 90 ? 0.3482 0.5520 0.6562 0.0801 0.1025 0.0688 90 GLN L CA 3971 C C . GLN C 90 ? 0.3885 0.6391 0.7640 0.0741 0.1401 0.0772 90 GLN L C 3972 O O . GLN C 90 ? 0.3251 0.6226 0.7856 0.0583 0.1377 0.0770 90 GLN L O 3973 C CB . GLN C 90 ? 0.3906 0.6078 0.7185 0.1112 0.0769 0.0594 90 GLN L CB 3974 C CG . GLN C 90 ? 0.3407 0.6270 0.7691 0.1140 0.0544 0.0489 90 GLN L CG 3975 C CD . GLN C 90 ? 0.3344 0.6797 0.8507 0.1282 0.0826 0.0482 90 GLN L CD 3976 O OE1 . GLN C 90 ? 0.3416 0.6724 0.8323 0.1449 0.1172 0.0536 90 GLN L OE1 3977 N NE2 . GLN C 90 ? 0.3007 0.7158 0.9252 0.1214 0.0685 0.0382 90 GLN L NE2 3978 N N . LEU C 91 ? 0.4353 0.5792 0.4551 0.0436 -0.0475 0.0522 91 LEU L N 3979 C CA . LEU C 91 ? 0.4121 0.5273 0.3858 0.0523 -0.0486 0.0598 91 LEU L CA 3980 C C . LEU C 91 ? 0.4691 0.5710 0.4353 0.0287 -0.0445 0.0508 91 LEU L C 3981 O O . LEU C 91 ? 0.5608 0.6394 0.4907 0.0293 -0.0431 0.0530 91 LEU L O 3982 C CB . LEU C 91 ? 0.4745 0.6223 0.4364 0.0761 -0.0687 0.0597 91 LEU L CB 3983 C CG . LEU C 91 ? 0.5816 0.7397 0.5322 0.1133 -0.0765 0.0702 91 LEU L CG 3984 C CD1 . LEU C 91 ? 0.4946 0.6637 0.4826 0.1145 -0.0692 0.0703 91 LEU L CD1 3985 C CD2 . LEU C 91 ? 0.6700 0.8919 0.6286 0.1335 -0.1032 0.0577 91 LEU L CD2 3986 N N . ASN C 92 ? 0.4278 0.5408 0.4246 0.0100 -0.0407 0.0407 92 ASN L N 3987 C CA . ASN C 92 ? 0.4434 0.5523 0.4394 -0.0084 -0.0391 0.0299 92 ASN L CA 3988 C C . ASN C 92 ? 0.5115 0.5867 0.4848 -0.0153 -0.0263 0.0282 92 ASN L C 3989 O O . ASN C 92 ? 0.5322 0.5951 0.4838 -0.0226 -0.0252 0.0230 92 ASN L O 3990 C CB . ASN C 92 ? 0.4442 0.5673 0.4720 -0.0200 -0.0354 0.0210 92 ASN L CB 3991 C CG . ASN C 92 ? 0.4827 0.5983 0.5079 -0.0345 -0.0323 0.0105 92 ASN L CG 3992 O OD1 . ASN C 92 ? 0.5453 0.6413 0.5620 -0.0354 -0.0250 0.0089 92 ASN L OD1 3993 N ND2 . ASN C 92 ? 0.4104 0.5465 0.4447 -0.0445 -0.0376 0.0001 92 ASN L ND2 3994 N N . SER C 93 ? 0.4738 0.5388 0.4534 -0.0142 -0.0155 0.0285 93 SER L N 3995 C CA . SER C 93 ? 0.5346 0.5833 0.5027 -0.0226 -0.0027 0.0172 93 SER L CA 3996 C C . SER C 93 ? 0.5881 0.6205 0.5489 -0.0190 0.0128 0.0183 93 SER L C 3997 O O . SER C 93 ? 0.5758 0.6094 0.5445 -0.0083 0.0127 0.0300 93 SER L O 3998 C CB . SER C 93 ? 0.5054 0.5694 0.4916 -0.0261 -0.0049 0.0054 93 SER L CB 3999 O OG . SER C 93 ? 0.5489 0.6212 0.5416 -0.0308 -0.0137 0.0039 93 SER L OG 4000 N N . TYR C 94 ? 0.5538 0.5735 0.5023 -0.0303 0.0289 0.0019 94 TYR L N 4001 C CA . TYR C 94 ? 0.5093 0.5172 0.4545 -0.0332 0.0494 -0.0060 94 TYR L CA 4002 C C . TYR C 94 ? 0.5023 0.5426 0.4751 -0.0293 0.0452 -0.0160 94 TYR L C 4003 O O . TYR C 94 ? 0.5587 0.6244 0.5443 -0.0272 0.0334 -0.0259 94 TYR L O 4004 C CB . TYR C 94 ? 0.5356 0.5237 0.4615 -0.0518 0.0733 -0.0290 94 TYR L CB 4005 C CG . TYR C 94 ? 0.5868 0.5241 0.4694 -0.0534 0.0879 -0.0173 94 TYR L CG 4006 C CD1 . TYR C 94 ? 0.6103 0.5173 0.4693 -0.0344 0.0884 0.0098 94 TYR L CD1 4007 C CD2 . TYR C 94 ? 0.5509 0.4689 0.4116 -0.0708 0.1021 -0.0338 94 TYR L CD2 4008 C CE1 . TYR C 94 ? 0.6482 0.5033 0.4557 -0.0275 0.1016 0.0229 94 TYR L CE1 4009 C CE2 . TYR C 94 ? 0.5771 0.4391 0.3866 -0.0694 0.1183 -0.0211 94 TYR L CE2 4010 C CZ . TYR C 94 ? 0.6598 0.4886 0.4390 -0.0452 0.1175 0.0087 94 TYR L CZ 4011 O OH . TYR C 94 ? 0.7676 0.5353 0.4842 -0.0358 0.1335 0.0237 94 TYR L OH 4012 N N . PRO C 95 ? 0.5169 0.5535 0.4941 -0.0253 0.0558 -0.0128 95 PRO L N 4013 C CA . PRO C 95 ? 0.4947 0.4956 0.4536 -0.0223 0.0711 0.0017 95 PRO L CA 4014 C C . PRO C 95 ? 0.4674 0.4684 0.4305 -0.0047 0.0537 0.0281 95 PRO L C 4015 O O . PRO C 95 ? 0.4685 0.4970 0.4551 0.0002 0.0371 0.0319 95 PRO L O 4016 C CB . PRO C 95 ? 0.4666 0.4730 0.4360 -0.0264 0.0890 -0.0110 95 PRO L CB 4017 C CG . PRO C 95 ? 0.4174 0.4662 0.4122 -0.0198 0.0710 -0.0170 95 PRO L CG 4018 C CD . PRO C 95 ? 0.4263 0.4920 0.4221 -0.0211 0.0555 -0.0252 95 PRO L CD 4019 N N . LEU C 96 ? 0.5573 0.5274 0.4954 0.0062 0.0597 0.0436 96 LEU L N 4020 C CA . LEU C 96 ? 0.5712 0.5533 0.5167 0.0264 0.0423 0.0624 96 LEU L CA 4021 C C . LEU C 96 ? 0.6529 0.6511 0.6266 0.0316 0.0439 0.0651 96 LEU L C 4022 O O . LEU C 96 ? 0.8661 0.8404 0.8306 0.0353 0.0628 0.0677 96 LEU L O 4023 C CB . LEU C 96 ? 0.6069 0.5512 0.5108 0.0458 0.0488 0.0779 96 LEU L CB 4024 C CG . LEU C 96 ? 0.6178 0.5372 0.4838 0.0413 0.0509 0.0764 96 LEU L CG 4025 C CD1 . LEU C 96 ? 0.6729 0.5414 0.4825 0.0666 0.0621 0.0948 96 LEU L CD1 4026 C CD2 . LEU C 96 ? 0.5883 0.5518 0.4754 0.0384 0.0226 0.0725 96 LEU L CD2 4027 N N . THR C 97 ? 0.5572 0.5905 0.5623 0.0299 0.0284 0.0633 97 THR L N 4028 C CA . THR C 97 ? 0.5198 0.5656 0.5491 0.0312 0.0326 0.0636 97 THR L CA 4029 C C . THR C 97 ? 0.5113 0.5753 0.5597 0.0456 0.0238 0.0722 97 THR L C 4030 O O . THR C 97 ? 0.4799 0.5681 0.5389 0.0489 0.0082 0.0710 97 THR L O 4031 C CB . THR C 97 ? 0.5006 0.5635 0.5443 0.0212 0.0285 0.0545 97 THR L CB 4032 O OG1 . THR C 97 ? 0.6448 0.7024 0.6748 0.0134 0.0350 0.0419 97 THR L OG1 4033 C CG2 . THR C 97 ? 0.5478 0.6173 0.6086 0.0233 0.0350 0.0560 97 THR L CG2 4034 N N . PHE C 98 ? 0.4800 0.5371 0.5352 0.0533 0.0349 0.0767 98 PHE L N 4035 C CA . PHE C 98 ? 0.4033 0.4843 0.4831 0.0675 0.0283 0.0800 98 PHE L CA 4036 C C . PHE C 98 ? 0.4034 0.5039 0.5144 0.0548 0.0324 0.0721 98 PHE L C 4037 O O . PHE C 98 ? 0.3519 0.4384 0.4570 0.0428 0.0432 0.0691 98 PHE L O 4038 C CB . PHE C 98 ? 0.3945 0.4513 0.4606 0.0866 0.0408 0.0901 98 PHE L CB 4039 C CG . PHE C 98 ? 0.5030 0.5346 0.5308 0.1087 0.0386 0.1014 98 PHE L CG 4040 C CD1 . PHE C 98 ? 0.4501 0.5075 0.4802 0.1376 0.0205 0.1063 98 PHE L CD1 4041 C CD2 . PHE C 98 ? 0.3758 0.3582 0.3621 0.1021 0.0566 0.1046 98 PHE L CD2 4042 C CE1 . PHE C 98 ? 0.4823 0.5108 0.4652 0.1652 0.0183 0.1193 98 PHE L CE1 4043 C CE2 . PHE C 98 ? 0.4304 0.3760 0.3700 0.1235 0.0600 0.1169 98 PHE L CE2 4044 C CZ . PHE C 98 ? 0.4998 0.4653 0.4331 0.1578 0.0400 0.1269 98 PHE L CZ 4045 N N . GLY C 99 ? 0.4002 0.5342 0.5420 0.0585 0.0253 0.0660 99 GLY L N 4046 C CA . GLY C 99 ? 0.2847 0.4285 0.4520 0.0456 0.0360 0.0575 99 GLY L CA 4047 C C . GLY C 99 ? 0.3129 0.4457 0.4854 0.0521 0.0496 0.0621 99 GLY L C 4048 O O . GLY C 99 ? 0.3678 0.4871 0.5274 0.0681 0.0512 0.0709 99 GLY L O 4049 N N . GLY C 100 ? 0.2679 0.4002 0.4548 0.0398 0.0631 0.0560 100 GLY L N 4050 C CA . GLY C 100 ? 0.2582 0.3806 0.4508 0.0425 0.0780 0.0582 100 GLY L CA 4051 C C . GLY C 100 ? 0.3543 0.5008 0.5750 0.0591 0.0759 0.0560 100 GLY L C 4052 O O . GLY C 100 ? 0.3782 0.5108 0.5979 0.0676 0.0873 0.0611 100 GLY L O 4053 N N . GLY C 101 ? 0.3158 0.5024 0.5624 0.0652 0.0618 0.0455 101 GLY L N 4054 C CA . GLY C 101 ? 0.3247 0.5470 0.5997 0.0880 0.0550 0.0392 101 GLY L CA 4055 C C . GLY C 101 ? 0.3138 0.5745 0.6362 0.0749 0.0642 0.0164 101 GLY L C 4056 O O . GLY C 101 ? 0.2898 0.5299 0.6137 0.0499 0.0839 0.0121 101 GLY L O 4057 N N . THR C 102 ? 0.3260 0.6442 0.6851 0.0936 0.0510 -0.0007 102 THR L N 4058 C CA . THR C 102 ? 0.2331 0.5978 0.6449 0.0805 0.0617 -0.0301 102 THR L CA 4059 C C . THR C 102 ? 0.2929 0.6946 0.7312 0.1145 0.0541 -0.0355 102 THR L C 4060 O O . THR C 102 ? 0.3391 0.7768 0.7774 0.1510 0.0300 -0.0357 102 THR L O 4061 C CB . THR C 102 ? 0.2260 0.6464 0.6716 0.0633 0.0554 -0.0618 102 THR L CB 4062 O OG1 . THR C 102 ? 0.2222 0.5988 0.6403 0.0322 0.0680 -0.0562 102 THR L OG1 4063 C CG2 . THR C 102 ? 0.2242 0.6977 0.7295 0.0467 0.0715 -0.0999 102 THR L CG2 4064 N N . LYS C 103 ? 0.3547 0.8295 0.3257 -0.0494 -0.0568 -0.0664 103 LYS L N 4065 C CA . LYS C 103 ? 0.3949 0.8708 0.3444 -0.0677 -0.0451 -0.0546 103 LYS L CA 4066 C C . LYS C 103 ? 0.3577 0.8085 0.3678 -0.0479 -0.0460 -0.0612 103 LYS L C 4067 O O . LYS C 103 ? 0.3420 0.7533 0.3783 -0.0499 -0.0394 -0.0588 103 LYS L O 4068 C CB . LYS C 103 ? 0.4284 0.8547 0.3232 -0.1011 -0.0183 -0.0390 103 LYS L CB 4069 C CG . LYS C 103 ? 0.5468 0.9138 0.4281 -0.1125 0.0097 -0.0202 103 LYS L CG 4070 C CD . LYS C 103 ? 0.6735 1.0552 0.5352 -0.1141 0.0160 -0.0105 103 LYS L CD 4071 C CE . LYS C 103 ? 0.7389 1.0522 0.5750 -0.1290 0.0428 0.0073 103 LYS L CE 4072 N NZ . LYS C 103 ? 0.7214 1.0086 0.5332 -0.1621 0.0585 0.0073 103 LYS L NZ 4073 N N . VAL C 104 ? 0.2605 0.7322 0.2963 -0.0241 -0.0494 -0.0704 104 VAL L N 4074 C CA . VAL C 104 ? 0.2503 0.7023 0.3545 -0.0027 -0.0469 -0.0888 104 VAL L CA 4075 C C . VAL C 104 ? 0.3571 0.7462 0.4253 -0.0138 -0.0166 -0.0730 104 VAL L C 4076 O O . VAL C 104 ? 0.3829 0.7795 0.4143 0.0002 -0.0133 -0.0691 104 VAL L O 4077 C CB . VAL C 104 ? 0.2652 0.7801 0.4257 0.0452 -0.0734 -0.1244 104 VAL L CB 4078 C CG1 . VAL C 104 ? 0.2196 0.7130 0.4576 0.0654 -0.0688 -0.1547 104 VAL L CG1 4079 C CG2 . VAL C 104 ? 0.2853 0.7816 0.4479 0.0529 -0.0881 -0.1292 104 VAL L CG2 4080 N N . GLU C 105 ? 0.3362 0.6651 0.4108 -0.0350 0.0054 -0.0621 105 GLU L N 4081 C CA . GLU C 105 ? 0.4243 0.7006 0.4700 -0.0438 0.0286 -0.0536 105 GLU L CA 4082 C C . GLU C 105 ? 0.4628 0.7372 0.5818 -0.0227 0.0319 -0.0846 105 GLU L C 4083 O O . GLU C 105 ? 0.2847 0.5905 0.4886 -0.0070 0.0211 -0.1107 105 GLU L O 4084 C CB . GLU C 105 ? 0.4896 0.7167 0.4927 -0.0755 0.0505 -0.0260 105 GLU L CB 4085 C CG . GLU C 105 ? 0.5402 0.7471 0.5918 -0.0778 0.0650 -0.0219 105 GLU L CG 4086 C CD . GLU C 105 ? 0.5256 0.6907 0.5426 -0.0929 0.0910 -0.0015 105 GLU L CD 4087 O OE1 . GLU C 105 ? 0.5066 0.6620 0.4613 -0.1048 0.0923 0.0080 105 GLU L OE1 4088 O OE2 . GLU C 105 ? 0.5190 0.6663 0.5791 -0.0918 0.1109 0.0029 105 GLU L OE2 4089 N N . ILE C 106 ? 0.4307 0.6706 0.5238 -0.0223 0.0459 -0.0879 106 ILE L N 4090 C CA . ILE C 106 ? 0.3911 0.6337 0.5502 -0.0034 0.0512 -0.1263 106 ILE L CA 4091 C C . ILE C 106 ? 0.4004 0.6056 0.5919 -0.0316 0.0783 -0.1142 106 ILE L C 4092 O O . ILE C 106 ? 0.4271 0.5943 0.5566 -0.0550 0.0935 -0.0822 106 ILE L O 4093 C CB . ILE C 106 ? 0.4526 0.6811 0.5618 0.0184 0.0501 -0.1426 106 ILE L CB 4094 C CG1 . ILE C 106 ? 0.4100 0.6617 0.4605 0.0461 0.0338 -0.1344 106 ILE L CG1 4095 C CG2 . ILE C 106 ? 0.3422 0.5949 0.5281 0.0478 0.0497 -0.2006 106 ILE L CG2 4096 C CD1 . ILE C 106 ? 0.4276 0.6444 0.4061 0.0671 0.0369 -0.1349 106 ILE L CD1 4097 N N . LYS C 107 ? 0.4329 0.6536 0.7281 -0.0262 0.0858 -0.1412 107 LYS L N 4098 C CA . LYS C 107 ? 0.4656 0.6524 0.8008 -0.0506 0.1202 -0.1252 107 LYS L CA 4099 C C . LYS C 107 ? 0.4911 0.6737 0.8408 -0.0482 0.1347 -0.1563 107 LYS L C 4100 O O . LYS C 107 ? 0.5532 0.7698 0.9713 -0.0237 0.1254 -0.2147 107 LYS L O 4101 C CB . LYS C 107 ? 0.4601 0.6565 0.9126 -0.0508 0.1286 -0.1369 107 LYS L CB 4102 C CG . LYS C 107 ? 0.5130 0.6708 1.0167 -0.0751 0.1741 -0.1126 107 LYS L CG 4103 C CD . LYS C 107 ? 0.5803 0.7338 1.2061 -0.0767 0.1852 -0.1187 107 LYS L CD 4104 C CE . LYS C 107 ? 0.6250 0.8263 1.3763 -0.0547 0.1653 -0.1975 107 LYS L CE 4105 N NZ . LYS C 107 ? 0.6856 0.8600 1.5374 -0.0540 0.1667 -0.2060 107 LYS L NZ 4106 N N . ARG C 108 ? 0.4667 0.6179 0.7531 -0.0679 0.1538 -0.1251 108 ARG L N 4107 C CA . ARG C 108 ? 0.4838 0.6360 0.7827 -0.0681 0.1674 -0.1545 108 ARG L CA 4108 C C . ARG C 108 ? 0.4641 0.5992 0.7706 -0.0934 0.2060 -0.1165 108 ARG L C 4109 O O . ARG C 108 ? 0.4791 0.5978 0.7833 -0.1051 0.2240 -0.0676 108 ARG L O 4110 C CB . ARG C 108 ? 0.4908 0.6337 0.6920 -0.0548 0.1435 -0.1646 108 ARG L CB 4111 C CG . ARG C 108 ? 0.4949 0.6097 0.6016 -0.0721 0.1419 -0.1142 108 ARG L CG 4112 C CD . ARG C 108 ? 0.4769 0.5778 0.5188 -0.0652 0.1286 -0.1303 108 ARG L CD 4113 N NE . ARG C 108 ? 0.4948 0.6096 0.5651 -0.0709 0.1463 -0.1468 108 ARG L NE 4114 C CZ . ARG C 108 ? 0.4539 0.5695 0.4908 -0.0597 0.1328 -0.1795 108 ARG L CZ 4115 N NH1 . ARG C 108 ? 0.4762 0.5674 0.4481 -0.0402 0.1031 -0.1954 108 ARG L NH1 4116 N NH2 . ARG C 108 ? 0.4574 0.5979 0.5250 -0.0664 0.1504 -0.1953 108 ARG L NH2 4117 N N . THR C 109 ? 0.4632 0.6076 0.7734 -0.0959 0.2182 -0.1400 109 THR L N 4118 C CA . THR C 109 ? 0.4489 0.5916 0.7643 -0.1142 0.2570 -0.1047 109 THR L CA 4119 C C . THR C 109 ? 0.4668 0.6021 0.6735 -0.1134 0.2494 -0.0571 109 THR L C 4120 O O . THR C 109 ? 0.5142 0.6433 0.6473 -0.1043 0.2141 -0.0659 109 THR L O 4121 C CB . THR C 109 ? 0.4802 0.6507 0.8381 -0.1159 0.2700 -0.1537 109 THR L CB 4122 O OG1 . THR C 109 ? 0.4739 0.6511 0.7517 -0.0977 0.2310 -0.1891 109 THR L OG1 4123 C CG2 . THR C 109 ? 0.4345 0.6242 0.9213 -0.1148 0.2817 -0.2134 109 THR L CG2 4124 N N . VAL C 110 ? 0.5788 0.7177 0.7820 -0.1191 0.2850 -0.0084 110 VAL L N 4125 C CA . VAL C 110 ? 0.5700 0.7202 0.6834 -0.1082 0.2792 0.0289 110 VAL L CA 4126 C C . VAL C 110 ? 0.5804 0.7566 0.6464 -0.1013 0.2542 -0.0032 110 VAL L C 4127 O O . VAL C 110 ? 0.6387 0.8422 0.7313 -0.1032 0.2707 -0.0193 110 VAL L O 4128 C CB . VAL C 110 ? 0.5963 0.7564 0.7160 -0.1024 0.3272 0.0872 110 VAL L CB 4129 C CG1 . VAL C 110 ? 0.6716 0.8643 0.7025 -0.0778 0.3169 0.1130 110 VAL L CG1 4130 C CG2 . VAL C 110 ? 0.5787 0.7024 0.7343 -0.1034 0.3416 0.1194 110 VAL L CG2 4131 N N . ALA C 111 ? 0.5837 0.7518 0.5843 -0.0940 0.2147 -0.0146 111 ALA L N 4132 C CA . ALA C 111 ? 0.5647 0.7475 0.5226 -0.0856 0.1845 -0.0479 111 ALA L CA 4133 C C . ALA C 111 ? 0.6204 0.8309 0.5247 -0.0717 0.1718 -0.0290 111 ALA L C 4134 O O . ALA C 111 ? 0.7037 0.9024 0.5821 -0.0705 0.1620 -0.0131 111 ALA L O 4135 C CB . ALA C 111 ? 0.5743 0.7198 0.5114 -0.0847 0.1491 -0.0848 111 ALA L CB 4136 N N . ALA C 112 ? 0.6142 0.8728 0.5087 -0.0580 0.1704 -0.0382 112 ALA L N 4137 C CA . ALA C 112 ? 0.5970 0.9021 0.4525 -0.0347 0.1529 -0.0334 112 ALA L CA 4138 C C . ALA C 112 ? 0.6313 0.9111 0.4586 -0.0358 0.1048 -0.0704 112 ALA L C 4139 O O . ALA C 112 ? 0.6821 0.9220 0.5059 -0.0455 0.0834 -0.1023 112 ALA L O 4140 C CB . ALA C 112 ? 0.5853 0.9620 0.4429 -0.0147 0.1610 -0.0375 112 ALA L CB 4141 N N . PRO C 113 ? 0.6254 0.9277 0.4356 -0.0224 0.0900 -0.0685 113 PRO L N 4142 C CA . PRO C 113 ? 0.6332 0.9089 0.4333 -0.0272 0.0503 -0.1028 113 PRO L CA 4143 C C . PRO C 113 ? 0.6919 1.0050 0.4895 -0.0080 0.0141 -0.1438 113 PRO L C 4144 O O . PRO C 113 ? 0.7195 1.1134 0.5201 0.0203 0.0150 -0.1462 113 PRO L O 4145 C CB . PRO C 113 ? 0.5661 0.8696 0.3671 -0.0178 0.0525 -0.0948 113 PRO L CB 4146 C CG . PRO C 113 ? 0.5386 0.9148 0.3351 0.0143 0.0788 -0.0683 113 PRO L CG 4147 C CD . PRO C 113 ? 0.6170 0.9689 0.4211 0.0006 0.1124 -0.0372 113 PRO L CD 4148 N N . SER C 114 ? 0.5054 0.6880 0.4362 0.0589 0.1036 -0.0660 114 SER L N 4149 C CA . SER C 114 ? 0.5290 0.6909 0.4564 0.0721 0.1067 -0.0531 114 SER L CA 4150 C C . SER C 114 ? 0.5563 0.6894 0.4812 0.0745 0.1010 -0.0663 114 SER L C 4151 O O . SER C 114 ? 0.5138 0.6583 0.4500 0.0632 0.0978 -0.0695 114 SER L O 4152 C CB . SER C 114 ? 0.5659 0.7524 0.5101 0.0658 0.1099 -0.0277 114 SER L CB 4153 O OG . SER C 114 ? 0.6334 0.8502 0.5804 0.0595 0.1123 -0.0119 114 SER L OG 4154 N N . VAL C 115 ? 0.5668 0.6640 0.4726 0.0838 0.0996 -0.0741 115 VAL L N 4155 C CA . VAL C 115 ? 0.5719 0.6407 0.4696 0.0812 0.0913 -0.0856 115 VAL L CA 4156 C C . VAL C 115 ? 0.6238 0.6660 0.5144 0.0864 0.1014 -0.0813 115 VAL L C 4157 O O . VAL C 115 ? 0.5869 0.6076 0.4647 0.0939 0.1147 -0.0812 115 VAL L O 4158 C CB . VAL C 115 ? 0.5557 0.5980 0.4310 0.0785 0.0788 -0.0954 115 VAL L CB 4159 C CG1 . VAL C 115 ? 0.5398 0.5585 0.4100 0.0707 0.0649 -0.1034 115 VAL L CG1 4160 C CG2 . VAL C 115 ? 0.5375 0.6006 0.4288 0.0757 0.0678 -0.0981 115 VAL L CG2 4161 N N . PHE C 116 ? 0.6209 0.6640 0.5225 0.0804 0.0973 -0.0802 116 PHE L N 4162 C CA . PHE C 116 ? 0.5630 0.5757 0.4615 0.0837 0.1049 -0.0769 116 PHE L CA 4163 C C . PHE C 116 ? 0.5814 0.5699 0.4627 0.0731 0.0946 -0.0899 116 PHE L C 4164 O O . PHE C 116 ? 0.6007 0.6081 0.4886 0.0635 0.0805 -0.0970 116 PHE L O 4165 C CB . PHE C 116 ? 0.5578 0.5912 0.4850 0.0823 0.1059 -0.0560 116 PHE L CB 4166 C CG . PHE C 116 ? 0.5779 0.6454 0.5259 0.0859 0.1094 -0.0378 116 PHE L CG 4167 C CD1 . PHE C 116 ? 0.6434 0.7017 0.6050 0.1024 0.1229 -0.0303 116 PHE L CD1 4168 C CD2 . PHE C 116 ? 0.5531 0.6634 0.5079 0.0693 0.1012 -0.0300 116 PHE L CD2 4169 C CE1 . PHE C 116 ? 0.6353 0.7287 0.6193 0.1041 0.1237 -0.0105 116 PHE L CE1 4170 C CE2 . PHE C 116 ? 0.5553 0.6972 0.5235 0.0670 0.1026 -0.0111 116 PHE L CE2 4171 C CZ . PHE C 116 ? 0.5669 0.7014 0.5509 0.0854 0.1115 0.0011 116 PHE L CZ 4172 N N . ILE C 117 ? 0.5849 0.5324 0.4493 0.0735 0.1030 -0.0941 117 ILE L N 4173 C CA . ILE C 117 ? 0.6341 0.5566 0.4773 0.0597 0.0928 -0.1042 117 ILE L CA 4174 C C . ILE C 117 ? 0.7230 0.6199 0.5697 0.0586 0.1007 -0.0998 117 ILE L C 4175 O O . ILE C 117 ? 0.7146 0.5927 0.5740 0.0706 0.1181 -0.0945 117 ILE L O 4176 C CB . ILE C 117 ? 0.6036 0.4905 0.4049 0.0502 0.0915 -0.1179 117 ILE L CB 4177 C CG1 . ILE C 117 ? 0.6417 0.5134 0.4245 0.0309 0.0724 -0.1235 117 ILE L CG1 4178 C CG2 . ILE C 117 ? 0.6005 0.4471 0.3805 0.0536 0.1184 -0.1263 117 ILE L CG2 4179 C CD1 . ILE C 117 ? 0.6732 0.5130 0.4103 0.0117 0.0632 -0.1308 117 ILE L CD1 4180 N N . PHE C 118 ? 0.7281 0.6252 0.5707 0.0441 0.0874 -0.1013 118 PHE L N 4181 C CA . PHE C 118 ? 0.5560 0.4273 0.3996 0.0392 0.0906 -0.0954 118 PHE L CA 4182 C C . PHE C 118 ? 0.6160 0.4497 0.4235 0.0225 0.0856 -0.1093 118 PHE L C 4183 O O . PHE C 118 ? 0.5856 0.4385 0.3878 0.0082 0.0680 -0.1138 118 PHE L O 4184 C CB . PHE C 118 ? 0.5298 0.4403 0.3991 0.0294 0.0788 -0.0798 118 PHE L CB 4185 C CG . PHE C 118 ? 0.6175 0.5661 0.5161 0.0367 0.0807 -0.0626 118 PHE L CG 4186 C CD1 . PHE C 118 ? 0.6671 0.6067 0.5901 0.0445 0.0848 -0.0401 118 PHE L CD1 4187 C CD2 . PHE C 118 ? 0.5332 0.5262 0.4394 0.0338 0.0771 -0.0676 118 PHE L CD2 4188 C CE1 . PHE C 118 ? 0.6001 0.5775 0.5493 0.0462 0.0823 -0.0194 118 PHE L CE1 4189 C CE2 . PHE C 118 ? 0.5348 0.5621 0.4606 0.0348 0.0790 -0.0519 118 PHE L CE2 4190 C CZ . PHE C 118 ? 0.5526 0.5739 0.4973 0.0394 0.0801 -0.0260 118 PHE L CZ 4191 N N . PRO C 119 ? 0.6452 0.4253 0.4318 0.0226 0.1026 -0.1173 119 PRO L N 4192 C CA . PRO C 119 ? 0.7433 0.4827 0.4895 0.0012 0.0995 -0.1297 119 PRO L CA 4193 C C . PRO C 119 ? 0.7792 0.5263 0.5356 -0.0104 0.0851 -0.1195 119 PRO L C 4194 O O . PRO C 119 ? 0.6681 0.4367 0.4592 -0.0024 0.0833 -0.1027 119 PRO L O 4195 C CB . PRO C 119 ? 0.7491 0.4300 0.4800 0.0051 0.1296 -0.1438 119 PRO L CB 4196 C CG . PRO C 119 ? 0.8327 0.5296 0.5896 0.0270 0.1464 -0.1432 119 PRO L CG 4197 C CD . PRO C 119 ? 0.7294 0.4844 0.5310 0.0408 0.1287 -0.1194 119 PRO L CD 4198 N N . PRO C 120 ? 0.8319 0.5632 0.5559 -0.0338 0.0729 -0.1272 120 PRO L N 4199 C CA . PRO C 120 ? 0.7170 0.4563 0.4467 -0.0490 0.0599 -0.1190 120 PRO L CA 4200 C C . PRO C 120 ? 0.7572 0.4514 0.4901 -0.0459 0.0728 -0.1121 120 PRO L C 4201 O O . PRO C 120 ? 0.8099 0.4494 0.5260 -0.0412 0.0934 -0.1238 120 PRO L O 4202 C CB . PRO C 120 ? 0.7446 0.4704 0.4367 -0.0751 0.0457 -0.1294 120 PRO L CB 4203 C CG . PRO C 120 ? 0.9078 0.5920 0.5605 -0.0780 0.0574 -0.1428 120 PRO L CG 4204 C CD . PRO C 120 ? 0.7491 0.4552 0.4274 -0.0527 0.0682 -0.1412 120 PRO L CD 4205 N N . SER C 121 ? 0.7970 0.5136 0.5540 -0.0516 0.0612 -0.0937 121 SER L N 4206 C CA . SER C 121 ? 0.8874 0.5616 0.6562 -0.0511 0.0655 -0.0801 121 SER L CA 4207 C C . SER C 121 ? 1.0311 0.6482 0.7589 -0.0706 0.0683 -0.0935 121 SER L C 4208 O O . SER C 121 ? 1.0787 0.7059 0.7716 -0.0921 0.0576 -0.1048 121 SER L O 4209 C CB . SER C 121 ? 0.8152 0.5297 0.6096 -0.0636 0.0459 -0.0534 121 SER L CB 4210 O OG . SER C 121 ? 0.7891 0.5361 0.5611 -0.0921 0.0303 -0.0585 121 SER L OG 4211 N N . ASP C 122 ? 1.1026 0.6594 0.8404 -0.0641 0.0824 -0.0917 122 ASP L N 4212 C CA . ASP C 122 ? 1.2050 0.7004 0.9038 -0.0852 0.0876 -0.1049 122 ASP L CA 4213 C C . ASP C 122 ? 1.1888 0.7043 0.8725 -0.1136 0.0601 -0.0891 122 ASP L C 4214 O O . ASP C 122 ? 1.2123 0.7009 0.8509 -0.1395 0.0563 -0.1008 122 ASP L O 4215 C CB . ASP C 122 ? 1.3732 0.7991 1.1022 -0.0696 0.1107 -0.1070 122 ASP L CB 4216 C CG . ASP C 122 ? 1.4816 0.8799 1.2178 -0.0491 0.1465 -0.1335 122 ASP L CG 4217 O OD1 . ASP C 122 ? 1.5369 0.9220 1.3357 -0.0213 0.1623 -0.1265 122 ASP L OD1 4218 O OD2 . ASP C 122 ? 1.5098 0.9010 1.1911 -0.0642 0.1577 -0.1600 122 ASP L OD2 4219 N N . GLU C 123 ? 1.1541 0.7187 0.8723 -0.1137 0.0414 -0.0626 123 GLU L N 4220 C CA . GLU C 123 ? 1.1133 0.7063 0.8178 -0.1459 0.0174 -0.0485 123 GLU L CA 4221 C C . GLU C 123 ? 1.0474 0.6857 0.7224 -0.1655 0.0098 -0.0669 123 GLU L C 4222 O O . GLU C 123 ? 1.0418 0.6779 0.6889 -0.1949 -0.0019 -0.0690 123 GLU L O 4223 C CB . GLU C 123 ? 1.0741 0.7174 0.8156 -0.1492 0.0015 -0.0188 123 GLU L CB 4224 C CG . GLU C 123 ? 1.0995 0.7771 0.8235 -0.1901 -0.0206 -0.0056 123 GLU L CG 4225 C CD . GLU C 123 ? 1.1959 0.9228 0.9460 -0.2034 -0.0355 0.0234 123 GLU L CD 4226 O OE1 . GLU C 123 ? 1.2115 0.9364 0.9978 -0.1791 -0.0328 0.0401 123 GLU L OE1 4227 O OE2 . GLU C 123 ? 1.2614 1.0312 0.9944 -0.2425 -0.0494 0.0291 123 GLU L OE2 4228 N N . GLN C 124 ? 1.0158 0.6953 0.7032 -0.1495 0.0149 -0.0788 124 GLN L N 4229 C CA . GLN C 124 ? 0.9943 0.7189 0.6731 -0.1637 0.0051 -0.0934 124 GLN L CA 4230 C C . GLN C 124 ? 1.0775 0.7571 0.7139 -0.1731 0.0069 -0.1093 124 GLN L C 4231 O O . GLN C 124 ? 1.1347 0.8315 0.7558 -0.1976 -0.0078 -0.1143 124 GLN L O 4232 C CB . GLN C 124 ? 0.9158 0.6970 0.6295 -0.1442 0.0073 -0.0981 124 GLN L CB 4233 C CG . GLN C 124 ? 0.8603 0.6929 0.5873 -0.1564 -0.0049 -0.1109 124 GLN L CG 4234 C CD . GLN C 124 ? 0.8014 0.6786 0.5660 -0.1354 -0.0022 -0.1168 124 GLN L CD 4235 O OE1 . GLN C 124 ? 0.7668 0.6244 0.5303 -0.1120 0.0084 -0.1146 124 GLN L OE1 4236 N NE2 . GLN C 124 ? 0.7937 0.7309 0.5966 -0.1443 -0.0101 -0.1260 124 GLN L NE2 4237 N N . LEU C 125 ? 1.0863 0.7104 0.7043 -0.1578 0.0255 -0.1176 125 LEU L N 4238 C CA . LEU C 125 ? 1.1272 0.7047 0.6940 -0.1748 0.0304 -0.1343 125 LEU L CA 4239 C C . LEU C 125 ? 1.1887 0.7276 0.7154 -0.2072 0.0236 -0.1357 125 LEU L C 4240 O O . LEU C 125 ? 1.2333 0.7636 0.7197 -0.2348 0.0131 -0.1432 125 LEU L O 4241 C CB . LEU C 125 ? 1.1557 0.6766 0.7091 -0.1580 0.0600 -0.1482 125 LEU L CB 4242 C CG . LEU C 125 ? 1.1079 0.6588 0.6830 -0.1337 0.0674 -0.1511 125 LEU L CG 4243 C CD1 . LEU C 125 ? 1.0546 0.5490 0.6174 -0.1218 0.1017 -0.1688 125 LEU L CD1 4244 C CD2 . LEU C 125 ? 1.1223 0.7072 0.6777 -0.1502 0.0465 -0.1535 125 LEU L CD2 4245 N N . LYS C 126 ? 1.2360 0.7525 0.7742 -0.2073 0.0259 -0.1250 126 LYS L N 4246 C CA . LYS C 126 ? 1.3172 0.7910 0.8164 -0.2386 0.0200 -0.1254 126 LYS L CA 4247 C C . LYS C 126 ? 1.2747 0.8089 0.7780 -0.2643 -0.0072 -0.1147 126 LYS L C 4248 O O . LYS C 126 ? 1.3073 0.8180 0.7788 -0.2944 -0.0163 -0.1126 126 LYS L O 4249 C CB . LYS C 126 ? 1.4177 0.8339 0.9316 -0.2296 0.0318 -0.1164 126 LYS L CB 4250 C CG . LYS C 126 ? 1.5340 0.8942 1.0625 -0.2014 0.0636 -0.1301 126 LYS L CG 4251 C CD . LYS C 126 ? 1.5929 0.9162 1.0677 -0.2147 0.0834 -0.1605 126 LYS L CD 4252 C CE . LYS C 126 ? 1.5632 0.8606 1.0602 -0.1859 0.1165 -0.1772 126 LYS L CE 4253 N NZ . LYS C 126 ? 1.5647 0.8403 1.0027 -0.2065 0.1327 -0.2050 126 LYS L NZ 4254 N N . SER C 127 ? 1.1836 0.7957 0.7285 -0.2540 -0.0174 -0.1106 127 SER L N 4255 C CA . SER C 127 ? 1.0702 0.7484 0.6312 -0.2778 -0.0370 -0.1079 127 SER L CA 4256 C C . SER C 127 ? 1.0364 0.7401 0.5939 -0.2889 -0.0498 -0.1174 127 SER L C 4257 O O . SER C 127 ? 1.0056 0.7599 0.5814 -0.3107 -0.0662 -0.1174 127 SER L O 4258 C CB . SER C 127 ? 1.0257 0.7750 0.6403 -0.2656 -0.0374 -0.1020 127 SER L CB 4259 O OG . SER C 127 ? 1.0265 0.8029 0.6722 -0.2366 -0.0307 -0.1086 127 SER L OG 4260 N N . GLY C 128 ? 1.0845 0.7551 0.6225 -0.2767 -0.0435 -0.1240 128 GLY L N 4261 C CA . GLY C 128 ? 1.1063 0.7933 0.6369 -0.2919 -0.0615 -0.1262 128 GLY L CA 4262 C C . GLY C 128 ? 1.0478 0.7840 0.6279 -0.2672 -0.0672 -0.1257 128 GLY L C 4263 O O . GLY C 128 ? 1.0411 0.7878 0.6208 -0.2785 -0.0863 -0.1224 128 GLY L O 4264 N N . THR C 129 ? 0.7713 0.5827 0.9524 -0.1886 -0.2487 -0.0451 129 THR L N 4265 C CA . THR C 129 ? 0.6859 0.5644 0.8652 -0.1619 -0.2023 -0.0460 129 THR L CA 4266 C C . THR C 129 ? 0.6803 0.5378 0.8736 -0.1162 -0.2230 -0.0481 129 THR L C 4267 O O . THR C 129 ? 0.7489 0.5278 0.9395 -0.1169 -0.2756 -0.0411 129 THR L O 4268 C CB . THR C 129 ? 0.7546 0.6383 0.8775 -0.2190 -0.1709 -0.0196 129 THR L CB 4269 O OG1 . THR C 129 ? 0.8571 0.7621 0.9686 -0.2748 -0.1552 -0.0254 129 THR L OG1 4270 C CG2 . THR C 129 ? 0.6719 0.6348 0.8080 -0.1891 -0.1240 -0.0308 129 THR L CG2 4271 N N . ALA C 130 ? 0.5997 0.5254 0.8096 -0.0783 -0.1868 -0.0613 130 ALA L N 4272 C CA . ALA C 130 ? 0.5980 0.5229 0.8224 -0.0427 -0.1958 -0.0696 130 ALA L CA 4273 C C . ALA C 130 ? 0.5509 0.5035 0.7467 -0.0444 -0.1575 -0.0507 130 ALA L C 4274 O O . ALA C 130 ? 0.5104 0.5189 0.7049 -0.0370 -0.1208 -0.0538 130 ALA L O 4275 C CB . ALA C 130 ? 0.5814 0.5636 0.8545 0.0008 -0.1941 -0.1117 130 ALA L CB 4276 N N . SER C 131 ? 0.5542 0.4616 0.7294 -0.0522 -0.1737 -0.0332 131 SER L N 4277 C CA . SER C 131 ? 0.5470 0.4766 0.6993 -0.0535 -0.1417 -0.0183 131 SER L CA 4278 C C . SER C 131 ? 0.5506 0.4833 0.7251 -0.0219 -0.1513 -0.0327 131 SER L C 4279 O O . SER C 131 ? 0.6128 0.4960 0.7985 -0.0165 -0.1945 -0.0384 131 SER L O 4280 C CB . SER C 131 ? 0.6067 0.4940 0.7067 -0.1013 -0.1434 0.0134 131 SER L CB 4281 O OG . SER C 131 ? 0.6420 0.5527 0.7257 -0.1383 -0.1220 0.0161 131 SER L OG 4282 N N . VAL C 132 ? 0.4652 0.4538 0.6468 -0.0034 -0.1159 -0.0415 132 VAL L N 4283 C CA . VAL C 132 ? 0.5010 0.5071 0.7009 0.0159 -0.1146 -0.0585 132 VAL L CA 4284 C C . VAL C 132 ? 0.5068 0.5073 0.6773 0.0047 -0.0926 -0.0339 132 VAL L C 4285 O O . VAL C 132 ? 0.4167 0.4368 0.5663 -0.0032 -0.0637 -0.0185 132 VAL L O 4286 C CB . VAL C 132 ? 0.5346 0.6062 0.7529 0.0326 -0.0918 -0.0870 132 VAL L CB 4287 C CG1 . VAL C 132 ? 0.5321 0.6345 0.7738 0.0421 -0.0879 -0.1148 132 VAL L CG1 4288 C CG2 . VAL C 132 ? 0.5737 0.6617 0.8221 0.0431 -0.1103 -0.1161 132 VAL L CG2 4289 N N . VAL C 133 ? 0.4778 0.4512 0.6534 0.0071 -0.1126 -0.0359 133 VAL L N 4290 C CA . VAL C 133 ? 0.5044 0.4714 0.6547 -0.0037 -0.0956 -0.0159 133 VAL L CA 4291 C C . VAL C 133 ? 0.5337 0.5372 0.7077 0.0124 -0.0804 -0.0368 133 VAL L C 4292 O O . VAL C 133 ? 0.5874 0.6028 0.8008 0.0289 -0.1012 -0.0705 133 VAL L O 4293 C CB . VAL C 133 ? 0.5170 0.4200 0.6400 -0.0227 -0.1307 0.0033 133 VAL L CB 4294 C CG1 . VAL C 133 ? 0.4735 0.3802 0.5695 -0.0358 -0.1093 0.0198 133 VAL L CG1 4295 C CG2 . VAL C 133 ? 0.5719 0.4375 0.6600 -0.0545 -0.1447 0.0249 133 VAL L CG2 4296 N N . CYS C 134 ? 0.5099 0.5338 0.6646 0.0056 -0.0468 -0.0225 134 CYS L N 4297 C CA . CYS C 134 ? 0.4815 0.5344 0.6469 0.0085 -0.0288 -0.0358 134 CYS L CA 4298 C C . CYS C 134 ? 0.4655 0.4955 0.6190 0.0019 -0.0277 -0.0208 134 CYS L C 4299 O O . CYS C 134 ? 0.4182 0.4345 0.5469 -0.0084 -0.0176 0.0017 134 CYS L O 4300 C CB . CYS C 134 ? 0.3855 0.4653 0.5301 0.0010 -0.0001 -0.0284 134 CYS L CB 4301 S SG . CYS C 134 ? 0.4645 0.5767 0.6046 -0.0141 0.0246 -0.0405 134 CYS L SG 4302 N N . LEU C 135 ? 0.4616 0.4959 0.6398 0.0088 -0.0398 -0.0417 135 LEU L N 4303 C CA . LEU C 135 ? 0.3922 0.4049 0.5597 0.0036 -0.0437 -0.0309 135 LEU L CA 4304 C C . LEU C 135 ? 0.3675 0.4133 0.5492 0.0009 -0.0178 -0.0437 135 LEU L C 4305 O O . LEU C 135 ? 0.3571 0.4413 0.5734 0.0050 -0.0147 -0.0781 135 LEU L O 4306 C CB . LEU C 135 ? 0.3990 0.3739 0.5783 0.0123 -0.0914 -0.0418 135 LEU L CB 4307 C CG . LEU C 135 ? 0.4087 0.3657 0.5805 0.0095 -0.1024 -0.0390 135 LEU L CG 4308 C CD1 . LEU C 135 ? 0.3605 0.2986 0.4796 -0.0152 -0.0853 -0.0036 135 LEU L CD1 4309 C CD2 . LEU C 135 ? 0.4045 0.3148 0.5901 0.0228 -0.1648 -0.0540 135 LEU L CD2 4310 N N . LEU C 136 ? 0.3599 0.3958 0.5188 -0.0092 0.0003 -0.0219 136 LEU L N 4311 C CA . LEU C 136 ? 0.3688 0.4208 0.5364 -0.0163 0.0191 -0.0290 136 LEU L CA 4312 C C . LEU C 136 ? 0.4288 0.4651 0.6011 -0.0134 0.0048 -0.0315 136 LEU L C 4313 O O . LEU C 136 ? 0.5080 0.5255 0.6575 -0.0189 0.0048 -0.0135 136 LEU L O 4314 C CB . LEU C 136 ? 0.3705 0.4130 0.5143 -0.0270 0.0386 -0.0068 136 LEU L CB 4315 C CG . LEU C 136 ? 0.4515 0.5003 0.5758 -0.0382 0.0499 0.0003 136 LEU L CG 4316 C CD1 . LEU C 136 ? 0.4726 0.5274 0.5930 -0.0290 0.0415 0.0001 136 LEU L CD1 4317 C CD2 . LEU C 136 ? 0.4769 0.4924 0.5784 -0.0442 0.0494 0.0235 136 LEU L CD2 4318 N N . ASN C 137 ? 0.4294 0.4812 0.6346 -0.0057 -0.0086 -0.0607 137 ASN L N 4319 C CA . ASN C 137 ? 0.4386 0.4682 0.6450 -0.0001 -0.0349 -0.0645 137 ASN L CA 4320 C C . ASN C 137 ? 0.4559 0.5062 0.6803 -0.0052 -0.0176 -0.0777 137 ASN L C 4321 O O . ASN C 137 ? 0.4152 0.5058 0.6746 -0.0090 -0.0006 -0.1060 137 ASN L O 4322 C CB . ASN C 137 ? 0.4830 0.5031 0.7209 0.0193 -0.0809 -0.0935 137 ASN L CB 4323 C CG . ASN C 137 ? 0.6361 0.6019 0.8472 0.0212 -0.1268 -0.0811 137 ASN L CG 4324 O OD1 . ASN C 137 ? 0.7075 0.6389 0.8602 0.0009 -0.1258 -0.0440 137 ASN L OD1 4325 N ND2 . ASN C 137 ? 0.6939 0.6555 0.9464 0.0421 -0.1699 -0.1168 137 ASN L ND2 4326 N N . ASN C 138 ? 0.4881 0.5170 0.6874 -0.0109 -0.0201 -0.0609 138 ASN L N 4327 C CA . ASN C 138 ? 0.4542 0.4963 0.6712 -0.0134 -0.0125 -0.0751 138 ASN L CA 4328 C C . ASN C 138 ? 0.3905 0.4573 0.6271 -0.0259 0.0226 -0.0812 138 ASN L C 4329 O O . ASN C 138 ? 0.3727 0.4706 0.6438 -0.0308 0.0303 -0.1098 138 ASN L O 4330 C CB . ASN C 138 ? 0.5035 0.5509 0.7534 0.0015 -0.0459 -0.1074 138 ASN L CB 4331 C CG . ASN C 138 ? 0.6693 0.6674 0.8853 0.0083 -0.0961 -0.0943 138 ASN L CG 4332 O OD1 . ASN C 138 ? 0.6856 0.6540 0.8451 -0.0087 -0.0975 -0.0616 138 ASN L OD1 4333 N ND2 . ASN C 138 ? 0.7860 0.7752 1.0362 0.0293 -0.1415 -0.1237 138 ASN L ND2 4334 N N . PHE C 139 ? 0.4258 0.4769 0.6400 -0.0344 0.0390 -0.0572 139 PHE L N 4335 C CA . PHE C 139 ? 0.3651 0.4133 0.5816 -0.0517 0.0591 -0.0525 139 PHE L CA 4336 C C . PHE C 139 ? 0.3644 0.3911 0.5825 -0.0510 0.0575 -0.0466 139 PHE L C 4337 O O . PHE C 139 ? 0.3666 0.3943 0.5820 -0.0394 0.0486 -0.0483 139 PHE L O 4338 C CB . PHE C 139 ? 0.3588 0.3956 0.5496 -0.0608 0.0662 -0.0327 139 PHE L CB 4339 C CG . PHE C 139 ? 0.3736 0.3911 0.5470 -0.0459 0.0556 -0.0147 139 PHE L CG 4340 C CD1 . PHE C 139 ? 0.3664 0.3930 0.5334 -0.0356 0.0474 -0.0145 139 PHE L CD1 4341 C CD2 . PHE C 139 ? 0.3844 0.3767 0.5547 -0.0429 0.0497 -0.0047 139 PHE L CD2 4342 C CE1 . PHE C 139 ? 0.3994 0.4173 0.5522 -0.0294 0.0417 -0.0028 139 PHE L CE1 4343 C CE2 . PHE C 139 ? 0.4479 0.4397 0.6151 -0.0301 0.0415 -0.0018 139 PHE L CE2 4344 C CZ . PHE C 139 ? 0.4285 0.4368 0.5844 -0.0268 0.0417 -0.0000 139 PHE L CZ 4345 N N . TYR C 140 ? 0.3718 0.3811 0.5936 -0.0687 0.0644 -0.0435 140 TYR L N 4346 C CA . TYR C 140 ? 0.3594 0.3408 0.5928 -0.0655 0.0544 -0.0433 140 TYR L CA 4347 C C . TYR C 140 ? 0.4701 0.4034 0.6858 -0.0914 0.0501 -0.0238 140 TYR L C 4348 O O . TYR C 140 ? 0.5556 0.4946 0.7576 -0.1236 0.0657 -0.0217 140 TYR L O 4349 C CB . TYR C 140 ? 0.3912 0.3946 0.6547 -0.0612 0.0550 -0.0690 140 TYR L CB 4350 C CG . TYR C 140 ? 0.4007 0.3851 0.6873 -0.0537 0.0424 -0.0798 140 TYR L CG 4351 C CD1 . TYR C 140 ? 0.3599 0.3669 0.6579 -0.0347 0.0352 -0.0971 140 TYR L CD1 4352 C CD2 . TYR C 140 ? 0.3885 0.3351 0.6870 -0.0702 0.0358 -0.0778 140 TYR L CD2 4353 C CE1 . TYR C 140 ? 0.3447 0.3491 0.6789 -0.0247 0.0219 -0.1220 140 TYR L CE1 4354 C CE2 . TYR C 140 ? 0.4124 0.3372 0.7431 -0.0582 0.0152 -0.0946 140 TYR L CE2 4355 C CZ . TYR C 140 ? 0.3844 0.3441 0.7399 -0.0315 0.0083 -0.1216 140 TYR L CZ 4356 O OH . TYR C 140 ? 0.4096 0.3624 0.8119 -0.0165 -0.0137 -0.1532 140 TYR L OH 4357 N N . PRO C 141 ? 0.5078 0.3931 0.7231 -0.0816 0.0246 -0.0134 141 PRO L N 4358 C CA . PRO C 141 ? 0.4443 0.3407 0.6896 -0.0476 0.0083 -0.0318 141 PRO L CA 4359 C C . PRO C 141 ? 0.4364 0.3536 0.6658 -0.0345 0.0110 -0.0252 141 PRO L C 4360 O O . PRO C 141 ? 0.4532 0.3731 0.6502 -0.0473 0.0233 -0.0057 141 PRO L O 4361 C CB . PRO C 141 ? 0.4710 0.3026 0.7304 -0.0433 -0.0293 -0.0299 141 PRO L CB 4362 C CG . PRO C 141 ? 0.5367 0.3066 0.7410 -0.0788 -0.0365 0.0107 141 PRO L CG 4363 C CD . PRO C 141 ? 0.5125 0.3254 0.6975 -0.1095 0.0040 0.0131 141 PRO L CD 4364 N N . ARG C 142 ? 0.4826 0.4231 0.7392 -0.0122 0.0012 -0.0482 142 ARG L N 4365 C CA . ARG C 142 ? 0.5216 0.4912 0.7656 -0.0055 0.0079 -0.0467 142 ARG L CA 4366 C C . ARG C 142 ? 0.5118 0.4422 0.7419 0.0003 -0.0127 -0.0283 142 ARG L C 4367 O O . ARG C 142 ? 0.4935 0.4407 0.7058 0.0015 -0.0056 -0.0201 142 ARG L O 4368 C CB . ARG C 142 ? 0.4955 0.5212 0.7708 0.0042 0.0114 -0.0855 142 ARG L CB 4369 C CG . ARG C 142 ? 0.5512 0.5792 0.8818 0.0254 -0.0143 -0.1232 142 ARG L CG 4370 C CD . ARG C 142 ? 0.6296 0.7379 0.9896 0.0264 -0.0023 -0.1703 142 ARG L CD 4371 N NE . ARG C 142 ? 0.6832 0.8064 1.0224 0.0225 0.0044 -0.1595 142 ARG L NE 4372 C CZ . ARG C 142 ? 0.7016 0.8969 1.0556 0.0120 0.0194 -0.1961 142 ARG L CZ 4373 N NH1 . ARG C 142 ? 0.8125 1.0794 1.1989 0.0015 0.0320 -0.2487 142 ARG L NH1 4374 N NH2 . ARG C 142 ? 0.6029 0.8054 0.9384 0.0066 0.0241 -0.1842 142 ARG L NH2 4375 N N . GLU C 143 ? 0.5253 0.3953 0.7589 0.0022 -0.0441 -0.0204 143 GLU L N 4376 C CA . GLU C 143 ? 0.6246 0.4410 0.8320 0.0044 -0.0749 0.0023 143 GLU L CA 4377 C C . GLU C 143 ? 0.6479 0.4573 0.7920 -0.0248 -0.0529 0.0397 143 GLU L C 4378 O O . GLU C 143 ? 0.6446 0.4414 0.7577 -0.0562 -0.0366 0.0572 143 GLU L O 4379 C CB . GLU C 143 ? 0.7362 0.4663 0.9456 0.0048 -0.1254 0.0107 143 GLU L CB 4380 C CG . GLU C 143 ? 0.8321 0.5709 1.1212 0.0426 -0.1602 -0.0403 143 GLU L CG 4381 C CD . GLU C 143 ? 0.8730 0.6575 1.2031 0.0423 -0.1363 -0.0714 143 GLU L CD 4382 O OE1 . GLU C 143 ? 0.7778 0.5576 1.0730 0.0133 -0.1075 -0.0465 143 GLU L OE1 4383 O OE2 . GLU C 143 ? 0.9496 0.7832 1.3505 0.0699 -0.1465 -0.1274 143 GLU L OE2 4384 N N . ALA C 144 ? 0.6258 0.4544 0.7576 -0.0162 -0.0509 0.0434 144 ALA L N 4385 C CA . ALA C 144 ? 0.6150 0.4526 0.6978 -0.0398 -0.0302 0.0665 144 ALA L CA 4386 C C . ALA C 144 ? 0.6566 0.4865 0.7242 -0.0274 -0.0485 0.0733 144 ALA L C 4387 O O . ALA C 144 ? 0.6834 0.5333 0.7914 0.0018 -0.0612 0.0505 144 ALA L O 4388 C CB . ALA C 144 ? 0.4894 0.3912 0.5875 -0.0416 0.0070 0.0512 144 ALA L CB 4389 N N . LYS C 145 ? 0.7008 0.5106 0.7109 -0.0536 -0.0481 0.0990 145 LYS L N 4390 C CA . LYS C 145 ? 0.7120 0.5154 0.7020 -0.0438 -0.0662 0.1057 145 LYS L CA 4391 C C . LYS C 145 ? 0.6970 0.5582 0.6733 -0.0555 -0.0316 0.1009 145 LYS L C 4392 O O . LYS C 145 ? 0.6543 0.5342 0.6001 -0.0885 -0.0070 0.1051 145 LYS L O 4393 C CB . LYS C 145 ? 0.7778 0.4969 0.7021 -0.0655 -0.1096 0.1400 145 LYS L CB 4394 C CG . LYS C 145 ? 0.7789 0.4865 0.6776 -0.0546 -0.1355 0.1469 145 LYS L CG 4395 C CD . LYS C 145 ? 0.9382 0.5447 0.7563 -0.0805 -0.1908 0.1869 145 LYS L CD 4396 C CE . LYS C 145 ? 1.0209 0.6142 0.7459 -0.1499 -0.1652 0.2204 145 LYS L CE 4397 N NZ . LYS C 145 ? 1.1167 0.5983 0.7379 -0.1906 -0.2232 0.2686 145 LYS L NZ 4398 N N . VAL C 146 ? 0.7199 0.6144 0.7255 -0.0299 -0.0314 0.0848 146 VAL L N 4399 C CA . VAL C 146 ? 0.6918 0.6321 0.6921 -0.0351 -0.0101 0.0764 146 VAL L CA 4400 C C . VAL C 146 ? 0.7272 0.6567 0.7048 -0.0283 -0.0314 0.0826 146 VAL L C 4401 O O . VAL C 146 ? 0.7920 0.7069 0.7935 -0.0031 -0.0568 0.0764 146 VAL L O 4402 C CB . VAL C 146 ? 0.6580 0.6410 0.7067 -0.0178 0.0058 0.0538 146 VAL L CB 4403 C CG1 . VAL C 146 ? 0.6357 0.6538 0.6855 -0.0201 0.0161 0.0421 146 VAL L CG1 4404 C CG2 . VAL C 146 ? 0.7283 0.7175 0.7954 -0.0229 0.0196 0.0475 146 VAL L CG2 4405 N N . GLN C 147 ? 0.7106 0.6562 0.6467 -0.0514 -0.0217 0.0873 147 GLN L N 4406 C CA . GLN C 147 ? 0.7133 0.6532 0.6227 -0.0471 -0.0417 0.0917 147 GLN L CA 4407 C C . GLN C 147 ? 0.6828 0.6848 0.5999 -0.0528 -0.0174 0.0690 147 GLN L C 4408 O O . GLN C 147 ? 0.6955 0.7350 0.6011 -0.0790 0.0085 0.0566 147 GLN L O 4409 C CB . GLN C 147 ? 0.8497 0.7281 0.6772 -0.0777 -0.0702 0.1251 147 GLN L CB 4410 C CG . GLN C 147 ? 1.0047 0.8054 0.8337 -0.0586 -0.1188 0.1424 147 GLN L CG 4411 C CD . GLN C 147 ? 1.2037 0.9182 0.9384 -0.0923 -0.1634 0.1829 147 GLN L CD 4412 O OE1 . GLN C 147 ? 1.3194 1.0318 0.9764 -0.1476 -0.1446 0.2041 147 GLN L OE1 4413 N NE2 . GLN C 147 ? 1.2513 0.8945 0.9907 -0.0630 -0.2270 0.1903 147 GLN L NE2 4414 N N . TRP C 148 ? 0.6723 0.6904 0.6174 -0.0279 -0.0276 0.0558 148 TRP L N 4415 C CA . TRP C 148 ? 0.5917 0.6619 0.5520 -0.0280 -0.0139 0.0304 148 TRP L CA 4416 C C . TRP C 148 ? 0.5945 0.6707 0.4976 -0.0472 -0.0228 0.0348 148 TRP L C 4417 O O . TRP C 148 ? 0.6696 0.7022 0.5368 -0.0431 -0.0532 0.0563 148 TRP L O 4418 C CB . TRP C 148 ? 0.5123 0.5944 0.5275 0.0005 -0.0208 0.0143 148 TRP L CB 4419 C CG . TRP C 148 ? 0.4385 0.5198 0.4951 0.0073 -0.0115 0.0090 148 TRP L CG 4420 C CD1 . TRP C 148 ? 0.4013 0.4627 0.4730 0.0137 -0.0146 0.0168 148 TRP L CD1 4421 C CD2 . TRP C 148 ? 0.4169 0.5169 0.5027 0.0065 -0.0040 -0.0089 148 TRP L CD2 4422 N NE1 . TRP C 148 ? 0.3803 0.4458 0.4748 0.0102 -0.0055 0.0112 148 TRP L NE1 4423 C CE2 . TRP C 148 ? 0.4121 0.4921 0.5146 0.0079 -0.0042 -0.0017 148 TRP L CE2 4424 C CE3 . TRP C 148 ? 0.4644 0.5970 0.5676 0.0057 -0.0028 -0.0364 148 TRP L CE3 4425 C CZ2 . TRP C 148 ? 0.4619 0.5370 0.5855 0.0071 -0.0100 -0.0112 148 TRP L CZ2 4426 C CZ3 . TRP C 148 ? 0.4394 0.5705 0.5803 0.0124 -0.0117 -0.0540 148 TRP L CZ3 4427 C CH2 . TRP C 148 ? 0.4440 0.5384 0.5887 0.0124 -0.0184 -0.0365 148 TRP L CH2 4428 N N . LYS C 149 ? 0.5781 0.7119 0.4756 -0.0683 -0.0003 0.0084 149 LYS L N 4429 C CA . LYS C 149 ? 0.6513 0.8084 0.4914 -0.0938 -0.0030 0.0043 149 LYS L CA 4430 C C . LYS C 149 ? 0.6671 0.8964 0.5593 -0.0801 0.0082 -0.0447 149 LYS L C 4431 O O . LYS C 149 ? 0.6888 0.9748 0.6275 -0.0832 0.0296 -0.0850 149 LYS L O 4432 C CB . LYS C 149 ? 0.7347 0.9032 0.4981 -0.1525 0.0161 0.0133 149 LYS L CB 4433 C CG . LYS C 149 ? 0.8184 0.8966 0.5106 -0.1741 -0.0083 0.0679 149 LYS L CG 4434 C CD . LYS C 149 ? 0.9407 1.0265 0.5387 -0.2483 0.0101 0.0806 149 LYS L CD 4435 C CE . LYS C 149 ? 1.1234 1.0967 0.6398 -0.2737 -0.0280 0.1411 149 LYS L CE 4436 N NZ . LYS C 149 ? 1.3264 1.2965 0.7288 -0.3623 -0.0129 0.1611 149 LYS L NZ 4437 N N . VAL C 150 ? 0.6895 0.9156 0.5819 -0.0618 -0.0123 -0.0467 150 VAL L N 4438 C CA . VAL C 150 ? 0.6491 0.9377 0.5895 -0.0490 -0.0082 -0.0939 150 VAL L CA 4439 C C . VAL C 150 ? 0.6955 1.0293 0.5708 -0.0831 -0.0033 -0.1080 150 VAL L C 4440 O O . VAL C 150 ? 0.7706 1.0661 0.5825 -0.0896 -0.0267 -0.0776 150 VAL L O 4441 C CB . VAL C 150 ? 0.5872 0.8513 0.5776 -0.0103 -0.0317 -0.0940 150 VAL L CB 4442 C CG1 . VAL C 150 ? 0.5601 0.8797 0.5960 0.0004 -0.0337 -0.1417 150 VAL L CG1 4443 C CG2 . VAL C 150 ? 0.5147 0.7430 0.5573 0.0098 -0.0331 -0.0831 150 VAL L CG2 4444 N N . ASP C 151 ? 0.7355 1.1550 0.6287 -0.1060 0.0237 -0.1600 151 ASP L N 4445 C CA . ASP C 151 ? 0.8522 1.3355 0.6742 -0.1552 0.0392 -0.1817 151 ASP L CA 4446 C C . ASP C 151 ? 0.9724 1.4003 0.6686 -0.2098 0.0380 -0.1228 151 ASP L C 4447 O O . ASP C 151 ? 1.1099 1.5194 0.7115 -0.2413 0.0215 -0.0986 151 ASP L O 4448 C CB . ASP C 151 ? 0.8893 1.3885 0.7098 -0.1378 0.0181 -0.1968 151 ASP L CB 4449 C CG . ASP C 151 ? 0.7934 1.3559 0.7293 -0.0976 0.0177 -0.2642 151 ASP L CG 4450 O OD1 . ASP C 151 ? 0.7438 1.3764 0.7419 -0.1007 0.0379 -0.3210 151 ASP L OD1 4451 O OD2 . ASP C 151 ? 0.7644 1.3043 0.7326 -0.0628 -0.0080 -0.2641 151 ASP L OD2 4452 N N . ASN C 152 ? 0.9443 1.3369 0.6374 -0.2215 0.0490 -0.0983 152 ASN L N 4453 C CA . ASN C 152 ? 1.0306 1.3520 0.6114 -0.2731 0.0412 -0.0389 152 ASN L CA 4454 C C . ASN C 152 ? 1.0925 1.2973 0.6171 -0.2520 -0.0142 0.0243 152 ASN L C 4455 O O . ASN C 152 ? 1.2257 1.3539 0.6424 -0.2956 -0.0393 0.0763 152 ASN L O 4456 C CB . ASN C 152 ? 1.1346 1.5206 0.6137 -0.3593 0.0697 -0.0539 152 ASN L CB 4457 C CG . ASN C 152 ? 1.2727 1.5884 0.6777 -0.4154 0.0681 -0.0033 152 ASN L CG 4458 O OD1 . ASN C 152 ? 1.3013 1.5591 0.7161 -0.4011 0.0624 0.0258 152 ASN L OD1 4459 N ND2 . ASN C 152 ? 1.3816 1.7010 0.7162 -0.4814 0.0704 0.0052 152 ASN L ND2 4460 N N . ALA C 153 ? 0.9649 1.1546 0.5652 -0.1874 -0.0382 0.0160 153 ALA L N 4461 C CA . ALA C 153 ? 0.9232 1.0193 0.5013 -0.1569 -0.0926 0.0574 153 ALA L CA 4462 C C . ALA C 153 ? 0.8714 0.9206 0.5238 -0.1132 -0.1016 0.0688 153 ALA L C 4463 O O . ALA C 153 ? 0.7773 0.8672 0.5250 -0.0770 -0.0811 0.0383 153 ALA L O 4464 C CB . ALA C 153 ? 0.8265 0.9484 0.4374 -0.1220 -0.1123 0.0332 153 ALA L CB 4465 N N . LEU C 154 ? 0.9586 0.9190 0.5624 -0.1207 -0.1368 0.1117 154 LEU L N 4466 C CA . LEU C 154 ? 0.9186 0.8413 0.5887 -0.0851 -0.1453 0.1168 154 LEU L CA 4467 C C . LEU C 154 ? 0.8887 0.8269 0.6515 -0.0272 -0.1604 0.0896 154 LEU L C 4468 O O . LEU C 154 ? 0.9579 0.8791 0.7153 -0.0073 -0.1987 0.0863 154 LEU L O 4469 C CB . LEU C 154 ? 1.0415 0.8592 0.6453 -0.1004 -0.1944 0.1618 154 LEU L CB 4470 C CG . LEU C 154 ? 1.0752 0.8577 0.7500 -0.0641 -0.2075 0.1595 154 LEU L CG 4471 C CD1 . LEU C 154 ? 1.0010 0.8337 0.7164 -0.0763 -0.1503 0.1467 154 LEU L CD1 4472 C CD2 . LEU C 154 ? 1.2607 0.9278 0.8746 -0.0738 -0.2727 0.1989 154 LEU L CD2 4473 N N . GLN C 155 ? 0.8134 0.7856 0.6568 -0.0058 -0.1310 0.0684 155 GLN L N 4474 C CA . GLN C 155 ? 0.7036 0.7037 0.6290 0.0325 -0.1342 0.0392 155 GLN L CA 4475 C C . GLN C 155 ? 0.7186 0.6840 0.6835 0.0573 -0.1607 0.0369 155 GLN L C 4476 O O . GLN C 155 ? 0.7753 0.6970 0.7183 0.0484 -0.1689 0.0572 155 GLN L O 4477 C CB . GLN C 155 ? 0.6332 0.6885 0.6118 0.0317 -0.0916 0.0167 155 GLN L CB 4478 C CG . GLN C 155 ? 0.6592 0.7557 0.6815 0.0460 -0.0897 -0.0113 155 GLN L CG 4479 C CD . GLN C 155 ? 0.6596 0.7797 0.6473 0.0367 -0.0929 -0.0192 155 GLN L CD 4480 O OE1 . GLN C 155 ? 0.6915 0.8067 0.6167 0.0119 -0.0903 -0.0055 155 GLN L OE1 4481 N NE2 . GLN C 155 ? 0.7004 0.8515 0.7264 0.0504 -0.0970 -0.0446 155 GLN L NE2 4482 N N . SER C 156 ? 0.7510 0.7439 0.7804 0.0862 -0.1739 0.0047 156 SER L N 4483 C CA . SER C 156 ? 0.7279 0.7101 0.8121 0.1121 -0.2010 -0.0173 156 SER L CA 4484 C C . SER C 156 ? 0.6865 0.7374 0.8535 0.1290 -0.1905 -0.0669 156 SER L C 4485 O O . SER C 156 ? 0.8313 0.9075 1.0100 0.1370 -0.1998 -0.0839 156 SER L O 4486 C CB . SER C 156 ? 0.8168 0.7265 0.8687 0.1296 -0.2699 -0.0055 156 SER L CB 4487 O OG . SER C 156 ? 0.8149 0.7222 0.9405 0.1633 -0.3054 -0.0428 156 SER L OG 4488 N N . GLY C 157 ? 0.5819 0.6681 0.8030 0.1282 -0.1692 -0.0926 157 GLY L N 4489 C CA . GLY C 157 ? 0.5454 0.7061 0.8411 0.1312 -0.1561 -0.1457 157 GLY L CA 4490 C C . GLY C 157 ? 0.5109 0.7140 0.8033 0.0964 -0.1066 -0.1433 157 GLY L C 4491 O O . GLY C 157 ? 0.5456 0.8106 0.8853 0.0808 -0.0872 -0.1823 157 GLY L O 4492 N N . ASN C 158 ? 0.4559 0.6259 0.6930 0.0803 -0.0901 -0.1017 158 ASN L N 4493 C CA . ASN C 158 ? 0.4729 0.6615 0.7051 0.0513 -0.0599 -0.0971 158 ASN L CA 4494 C C . ASN C 158 ? 0.4953 0.6580 0.6976 0.0322 -0.0397 -0.0693 158 ASN L C 4495 O O . ASN C 158 ? 0.5018 0.6519 0.6866 0.0167 -0.0314 -0.0555 158 ASN L O 4496 C CB . ASN C 158 ? 0.4658 0.6484 0.6799 0.0547 -0.0677 -0.0899 158 ASN L CB 4497 C CG . ASN C 158 ? 0.5362 0.6831 0.7008 0.0619 -0.0752 -0.0615 158 ASN L CG 4498 O OD1 . ASN C 158 ? 0.5716 0.6899 0.7113 0.0663 -0.0821 -0.0441 158 ASN L OD1 4499 N ND2 . ASN C 158 ? 0.5336 0.6872 0.6851 0.0583 -0.0737 -0.0616 158 ASN L ND2 4500 N N . SER C 159 ? 0.5152 0.6678 0.7181 0.0366 -0.0386 -0.0660 159 SER L N 4501 C CA . SER C 159 ? 0.4870 0.6199 0.6675 0.0201 -0.0216 -0.0453 159 SER L CA 4502 C C . SER C 159 ? 0.5053 0.6617 0.7097 0.0124 -0.0120 -0.0644 159 SER L C 4503 O O . SER C 159 ? 0.5471 0.7236 0.7878 0.0312 -0.0258 -0.0921 159 SER L O 4504 C CB . SER C 159 ? 0.4709 0.5651 0.6175 0.0300 -0.0276 -0.0188 159 SER L CB 4505 O OG . SER C 159 ? 0.5076 0.5822 0.6546 0.0457 -0.0456 -0.0180 159 SER L OG 4506 N N . GLN C 160 ? 0.4573 0.6121 0.6440 -0.0146 0.0060 -0.0547 160 GLN L N 4507 C CA . GLN C 160 ? 0.4143 0.5987 0.6164 -0.0283 0.0190 -0.0748 160 GLN L CA 4508 C C . GLN C 160 ? 0.4588 0.6086 0.6281 -0.0379 0.0250 -0.0478 160 GLN L C 4509 O O . GLN C 160 ? 0.4785 0.5921 0.6165 -0.0453 0.0211 -0.0209 160 GLN L O 4510 C CB . GLN C 160 ? 0.4184 0.6572 0.6281 -0.0688 0.0379 -0.1026 160 GLN L CB 4511 C CG . GLN C 160 ? 0.4491 0.7459 0.7123 -0.0588 0.0347 -0.1487 160 GLN L CG 4512 C CD . GLN C 160 ? 0.5438 0.9114 0.8149 -0.1116 0.0614 -0.1848 160 GLN L CD 4513 O OE1 . GLN C 160 ? 0.6783 1.0288 0.9054 -0.1539 0.0700 -0.1618 160 GLN L OE1 4514 N NE2 . GLN C 160 ? 0.5109 0.9602 0.8392 -0.1139 0.0722 -0.2463 160 GLN L NE2 4515 N N . GLU C 161 ? 0.4259 0.5896 0.6108 -0.0347 0.0298 -0.0621 161 GLU L N 4516 C CA . GLU C 161 ? 0.3776 0.5117 0.5370 -0.0406 0.0336 -0.0408 161 GLU L CA 4517 C C . GLU C 161 ? 0.3799 0.5515 0.5461 -0.0620 0.0480 -0.0645 161 GLU L C 4518 O O . GLU C 161 ? 0.3293 0.5574 0.5351 -0.0639 0.0547 -0.1069 161 GLU L O 4519 C CB . GLU C 161 ? 0.3975 0.4946 0.5609 -0.0115 0.0211 -0.0263 161 GLU L CB 4520 C CG . GLU C 161 ? 0.4311 0.5360 0.6320 0.0088 0.0088 -0.0502 161 GLU L CG 4521 C CD . GLU C 161 ? 0.5349 0.5858 0.7212 0.0240 -0.0084 -0.0264 161 GLU L CD 4522 O OE1 . GLU C 161 ? 0.5944 0.6186 0.7458 0.0198 -0.0082 0.0010 161 GLU L OE1 4523 O OE2 . GLU C 161 ? 0.6293 0.6669 0.8382 0.0353 -0.0228 -0.0384 161 GLU L OE2 4524 N N . SER C 162 ? 0.3841 0.5310 0.5161 -0.0780 0.0506 -0.0442 162 SER L N 4525 C CA . SER C 162 ? 0.4394 0.6199 0.5690 -0.1000 0.0634 -0.0647 162 SER L CA 4526 C C . SER C 162 ? 0.4536 0.5943 0.5672 -0.0906 0.0563 -0.0438 162 SER L C 4527 O O . SER C 162 ? 0.4239 0.5161 0.5152 -0.0829 0.0430 -0.0140 162 SER L O 4528 C CB . SER C 162 ? 0.4618 0.6676 0.5450 -0.1562 0.0757 -0.0668 162 SER L CB 4529 O OG . SER C 162 ? 0.5000 0.6396 0.5244 -0.1738 0.0570 -0.0230 162 SER L OG 4530 N N . VAL C 163 ? 0.4224 0.5922 0.5570 -0.0901 0.0639 -0.0688 163 VAL L N 4531 C CA . VAL C 163 ? 0.3298 0.4709 0.4567 -0.0821 0.0585 -0.0566 163 VAL L CA 4532 C C . VAL C 163 ? 0.4008 0.5663 0.4913 -0.1197 0.0662 -0.0654 163 VAL L C 4533 O O . VAL C 163 ? 0.5002 0.7287 0.5990 -0.1439 0.0833 -0.1014 163 VAL L O 4534 C CB . VAL C 163 ? 0.3599 0.5018 0.5387 -0.0503 0.0542 -0.0759 163 VAL L CB 4535 C CG1 . VAL C 163 ? 0.4088 0.5240 0.5818 -0.0464 0.0511 -0.0651 163 VAL L CG1 4536 C CG2 . VAL C 163 ? 0.3549 0.4638 0.5502 -0.0239 0.0406 -0.0622 163 VAL L CG2 4537 N N . THR C 164 ? 0.2779 0.6297 0.4593 0.0594 0.0141 -0.0496 164 THR L N 4538 C CA . THR C 164 ? 0.2716 0.6490 0.4230 0.0442 0.0170 -0.0563 164 THR L CA 4539 C C . THR C 164 ? 0.2704 0.6650 0.4394 0.0530 0.0155 -0.0907 164 THR L C 4540 O O . THR C 164 ? 0.2859 0.6605 0.4912 0.0714 0.0084 -0.1015 164 THR L O 4541 C CB . THR C 164 ? 0.3257 0.6753 0.4502 0.0368 0.0033 -0.0276 164 THR L CB 4542 O OG1 . THR C 164 ? 0.3394 0.6590 0.4957 0.0521 -0.0066 -0.0247 164 THR L OG1 4543 C CG2 . THR C 164 ? 0.3866 0.7193 0.4907 0.0253 0.0049 0.0025 164 THR L CG2 4544 N N . GLU C 165 ? 0.2578 0.6847 0.3956 0.0373 0.0225 -0.1084 165 GLU L N 4545 C CA . GLU C 165 ? 0.2918 0.7332 0.4400 0.0428 0.0200 -0.1440 165 GLU L CA 4546 C C . GLU C 165 ? 0.3011 0.7076 0.4551 0.0501 -0.0023 -0.1312 165 GLU L C 4547 O O . GLU C 165 ? 0.3327 0.7159 0.4699 0.0453 -0.0145 -0.0980 165 GLU L O 4548 C CB . GLU C 165 ? 0.3597 0.8400 0.4561 0.0180 0.0335 -0.1648 165 GLU L CB 4549 C CG . GLU C 165 ? 0.4526 0.9767 0.5469 0.0032 0.0635 -0.1832 165 GLU L CG 4550 C CD . GLU C 165 ? 0.5683 1.1216 0.7374 0.0253 0.0745 -0.2283 165 GLU L CD 4551 O OE1 . GLU C 165 ? 0.6062 1.1510 0.8088 0.0446 0.0638 -0.2551 165 GLU L OE1 4552 O OE2 . GLU C 165 ? 0.6856 1.2612 0.8820 0.0230 0.0887 -0.2356 165 GLU L OE2 4553 N N . GLN C 166 ? 0.3269 0.7306 0.5127 0.0615 -0.0075 -0.1609 166 GLN L N 4554 C CA . GLN C 166 ? 0.3227 0.6998 0.5242 0.0648 -0.0260 -0.1559 166 GLN L CA 4555 C C . GLN C 166 ? 0.3832 0.7697 0.5403 0.0489 -0.0432 -0.1441 166 GLN L C 4556 O O . GLN C 166 ? 0.3928 0.8063 0.5026 0.0343 -0.0421 -0.1603 166 GLN L O 4557 C CB . GLN C 166 ? 0.3005 0.6745 0.5392 0.0746 -0.0284 -0.1950 166 GLN L CB 4558 C CG . GLN C 166 ? 0.2806 0.6250 0.5493 0.0756 -0.0436 -0.1916 166 GLN L CG 4559 C CD . GLN C 166 ? 0.3927 0.7279 0.6974 0.0819 -0.0465 -0.2306 166 GLN L CD 4560 O OE1 . GLN C 166 ? 0.3860 0.7467 0.6858 0.0836 -0.0417 -0.2676 166 GLN L OE1 4561 N NE2 . GLN C 166 ? 0.4446 0.7422 0.7878 0.0828 -0.0516 -0.2256 166 GLN L NE2 4562 N N . ASP C 167 ? 0.4121 0.7750 0.5840 0.0509 -0.0599 -0.1173 167 ASP L N 4563 C CA . ASP C 167 ? 0.3485 0.7133 0.4895 0.0411 -0.0874 -0.1032 167 ASP L CA 4564 C C . ASP C 167 ? 0.4051 0.7847 0.5450 0.0372 -0.1061 -0.1353 167 ASP L C 4565 O O . ASP C 167 ? 0.4565 0.8315 0.6495 0.0454 -0.1045 -0.1589 167 ASP L O 4566 C CB . ASP C 167 ? 0.3352 0.6760 0.5171 0.0491 -0.1009 -0.0762 167 ASP L CB 4567 C CG . ASP C 167 ? 0.4336 0.7702 0.5866 0.0434 -0.1356 -0.0543 167 ASP L CG 4568 O OD1 . ASP C 167 ? 0.5725 0.8912 0.7146 0.0435 -0.1382 -0.0235 167 ASP L OD1 4569 O OD2 . ASP C 167 ? 0.4619 0.8091 0.6035 0.0392 -0.1644 -0.0682 167 ASP L OD2 4570 N N . SER C 168 ? 0.4337 0.8262 0.5071 0.0214 -0.1247 -0.1360 168 SER L N 4571 C CA . SER C 168 ? 0.4830 0.8905 0.5431 0.0147 -0.1447 -0.1701 168 SER L CA 4572 C C . SER C 168 ? 0.4936 0.8920 0.5974 0.0211 -0.1849 -0.1659 168 SER L C 4573 O O . SER C 168 ? 0.4986 0.9089 0.6026 0.0161 -0.2071 -0.1957 168 SER L O 4574 C CB . SER C 168 ? 0.5660 0.9878 0.5235 -0.0097 -0.1499 -0.1737 168 SER L CB 4575 O OG . SER C 168 ? 0.6322 1.0325 0.5362 -0.0191 -0.1784 -0.1291 168 SER L OG 4576 N N . LYS C 169 ? 0.5153 0.8961 0.6636 0.0318 -0.1938 -0.1344 169 LYS L N 4577 C CA . LYS C 169 ? 0.5641 0.9442 0.7690 0.0387 -0.2321 -0.1337 169 LYS L CA 4578 C C . LYS C 169 ? 0.4800 0.8583 0.7866 0.0487 -0.2131 -0.1488 169 LYS L C 4579 O O . LYS C 169 ? 0.5445 0.9350 0.9054 0.0479 -0.2314 -0.1749 169 LYS L O 4580 C CB . LYS C 169 ? 0.5819 0.9450 0.7740 0.0432 -0.2611 -0.0933 169 LYS L CB 4581 C CG . LYS C 169 ? 0.5946 0.9464 0.6760 0.0277 -0.2833 -0.0700 169 LYS L CG 4582 C CD . LYS C 169 ? 0.6487 1.0125 0.6779 0.0151 -0.3207 -0.0918 169 LYS L CD 4583 C CE . LYS C 169 ? 0.8203 1.1639 0.7216 -0.0070 -0.3420 -0.0641 169 LYS L CE 4584 N NZ . LYS C 169 ? 0.8931 1.1996 0.7869 -0.0000 -0.3823 -0.0160 169 LYS L NZ 4585 N N . ASP C 170 ? 0.3640 0.7253 0.6922 0.0544 -0.1767 -0.1327 170 ASP L N 4586 C CA . ASP C 170 ? 0.3545 0.7054 0.7609 0.0572 -0.1530 -0.1425 170 ASP L CA 4587 C C . ASP C 170 ? 0.4131 0.7448 0.8102 0.0563 -0.1163 -0.1513 170 ASP L C 4588 O O . ASP C 170 ? 0.3500 0.6602 0.7914 0.0543 -0.0935 -0.1535 170 ASP L O 4589 C CB . ASP C 170 ? 0.2932 0.6337 0.7380 0.0632 -0.1454 -0.1179 170 ASP L CB 4590 C CG . ASP C 170 ? 0.3490 0.6728 0.7382 0.0663 -0.1297 -0.0872 170 ASP L CG 4591 O OD1 . ASP C 170 ? 0.3360 0.6526 0.6811 0.0641 -0.1077 -0.0867 170 ASP L OD1 4592 O OD2 . ASP C 170 ? 0.3853 0.7036 0.7831 0.0717 -0.1411 -0.0661 170 ASP L OD2 4593 N N . SER C 171 ? 0.4932 0.8309 0.8321 0.0566 -0.1115 -0.1564 171 SER L N 4594 C CA . SER C 171 ? 0.2783 0.6016 0.6156 0.0604 -0.0870 -0.1718 171 SER L CA 4595 C C . SER C 171 ? 0.3445 0.6374 0.6896 0.0661 -0.0625 -0.1474 171 SER L C 4596 O O . SER C 171 ? 0.2510 0.5171 0.6107 0.0700 -0.0492 -0.1557 171 SER L O 4597 C CB . SER C 171 ? 0.2924 0.6059 0.6748 0.0575 -0.0895 -0.2048 171 SER L CB 4598 O OG . SER C 171 ? 0.3922 0.7340 0.7635 0.0512 -0.1142 -0.2324 171 SER L OG 4599 N N . THR C 172 ? 0.2329 0.5248 0.5643 0.0662 -0.0601 -0.1175 172 THR L N 4600 C CA . THR C 172 ? 0.2485 0.5114 0.5801 0.0690 -0.0387 -0.0961 172 THR L CA 4601 C C . THR C 172 ? 0.3299 0.5998 0.6184 0.0733 -0.0323 -0.0841 172 THR L C 4602 O O . THR C 172 ? 0.3522 0.6513 0.6091 0.0707 -0.0396 -0.0890 172 THR L O 4603 C CB . THR C 172 ? 0.3272 0.5814 0.6832 0.0654 -0.0348 -0.0769 172 THR L CB 4604 O OG1 . THR C 172 ? 0.2994 0.5721 0.6329 0.0672 -0.0506 -0.0608 172 THR L OG1 4605 C CG2 . THR C 172 ? 0.2045 0.4623 0.6185 0.0591 -0.0391 -0.0939 172 THR L CG2 4606 N N . TYR C 173 ? 0.3296 0.5722 0.6151 0.0766 -0.0180 -0.0695 173 TYR L N 4607 C CA . TYR C 173 ? 0.2424 0.4921 0.4990 0.0798 -0.0128 -0.0587 173 TYR L CA 4608 C C . TYR C 173 ? 0.2437 0.4750 0.4910 0.0755 -0.0052 -0.0319 173 TYR L C 4609 O O . TYR C 173 ? 0.3229 0.5297 0.5882 0.0719 0.0019 -0.0254 173 TYR L O 4610 C CB . TYR C 173 ? 0.2746 0.5076 0.5370 0.0901 -0.0106 -0.0696 173 TYR L CB 4611 C CG . TYR C 173 ? 0.3138 0.5648 0.5935 0.0972 -0.0168 -0.1026 173 TYR L CG 4612 C CD1 . TYR C 173 ? 0.2875 0.5795 0.5625 0.1009 -0.0148 -0.1231 173 TYR L CD1 4613 C CD2 . TYR C 173 ? 0.3684 0.5963 0.6730 0.0979 -0.0214 -0.1177 173 TYR L CD2 4614 C CE1 . TYR C 173 ? 0.3337 0.6450 0.6290 0.1074 -0.0167 -0.1610 173 TYR L CE1 4615 C CE2 . TYR C 173 ? 0.4007 0.6423 0.7244 0.1049 -0.0273 -0.1528 173 TYR L CE2 4616 C CZ . TYR C 173 ? 0.3790 0.6631 0.6982 0.1109 -0.0247 -0.1759 173 TYR L CZ 4617 O OH . TYR C 173 ? 0.4261 0.7270 0.7684 0.1179 -0.0268 -0.2182 173 TYR L OH 4618 N N . SER C 174 ? 0.2782 0.5225 0.5005 0.0736 -0.0036 -0.0205 174 SER L N 4619 C CA . SER C 174 ? 0.2723 0.4963 0.4852 0.0697 0.0037 0.0006 174 SER L CA 4620 C C . SER C 174 ? 0.3439 0.5695 0.5387 0.0709 0.0071 0.0034 174 SER L C 4621 O O . SER C 174 ? 0.3971 0.6538 0.5886 0.0717 0.0049 -0.0087 174 SER L O 4622 C CB . SER C 174 ? 0.1860 0.4191 0.3934 0.0635 -0.0036 0.0146 174 SER L CB 4623 O OG . SER C 174 ? 0.1958 0.4261 0.4334 0.0654 -0.0117 0.0108 174 SER L OG 4624 N N . LEU C 175 ? 0.3692 0.5643 0.5547 0.0694 0.0131 0.0153 175 LEU L N 4625 C CA . LEU C 175 ? 0.3712 0.5650 0.5429 0.0711 0.0101 0.0167 175 LEU L CA 4626 C C . LEU C 175 ? 0.3935 0.5772 0.5489 0.0612 0.0161 0.0313 175 LEU L C 4627 O O . LEU C 175 ? 0.3851 0.5432 0.5382 0.0564 0.0250 0.0393 175 LEU L O 4628 C CB . LEU C 175 ? 0.3618 0.5175 0.5265 0.0786 0.0039 0.0153 175 LEU L CB 4629 C CG . LEU C 175 ? 0.3228 0.4754 0.4816 0.0868 -0.0123 0.0123 175 LEU L CG 4630 C CD1 . LEU C 175 ? 0.3312 0.4497 0.4928 0.0994 -0.0285 0.0072 175 LEU L CD1 4631 C CD2 . LEU C 175 ? 0.2920 0.4171 0.4179 0.0776 -0.0115 0.0272 175 LEU L CD2 4632 N N . SER C 176 ? 0.4110 0.6173 0.5620 0.0571 0.0128 0.0303 176 SER L N 4633 C CA . SER C 176 ? 0.4040 0.5984 0.5413 0.0462 0.0166 0.0411 176 SER L CA 4634 C C . SER C 176 ? 0.4301 0.6259 0.5630 0.0476 0.0072 0.0347 176 SER L C 4635 O O . SER C 176 ? 0.3524 0.5844 0.5053 0.0518 -0.0003 0.0210 176 SER L O 4636 C CB . SER C 176 ? 0.3682 0.5855 0.5045 0.0332 0.0200 0.0485 176 SER L CB 4637 O OG . SER C 176 ? 0.3231 0.5258 0.4503 0.0215 0.0226 0.0569 176 SER L OG 4638 N N . SER C 177 ? 0.4488 0.6073 0.5579 0.0439 0.0065 0.0410 177 SER L N 4639 C CA . SER C 177 ? 0.4497 0.6042 0.5488 0.0447 -0.0101 0.0358 177 SER L CA 4640 C C . SER C 177 ? 0.4296 0.5756 0.5152 0.0292 -0.0056 0.0387 177 SER L C 4641 O O . SER C 177 ? 0.4544 0.5696 0.5223 0.0214 0.0092 0.0451 177 SER L O 4642 C CB . SER C 177 ? 0.5234 0.6304 0.5897 0.0521 -0.0222 0.0397 177 SER L CB 4643 O OG . SER C 177 ? 0.6158 0.7157 0.6691 0.0549 -0.0483 0.0360 177 SER L OG 4644 N N . THR C 178 ? 0.4208 0.5965 0.5231 0.0246 -0.0179 0.0294 178 THR L N 4645 C CA . THR C 178 ? 0.4766 0.6472 0.5725 0.0070 -0.0147 0.0291 178 THR L CA 4646 C C . THR C 178 ? 0.5025 0.6616 0.5830 0.0065 -0.0387 0.0196 178 THR L C 4647 O O . THR C 178 ? 0.4945 0.6883 0.6049 0.0135 -0.0605 0.0068 178 THR L O 4648 C CB . THR C 178 ? 0.4730 0.6892 0.6024 -0.0078 -0.0054 0.0259 178 THR L CB 4649 O OG1 . THR C 178 ? 0.5498 0.7686 0.6795 -0.0095 0.0108 0.0379 178 THR L OG1 4650 C CG2 . THR C 178 ? 0.4446 0.6474 0.5691 -0.0287 -0.0021 0.0263 178 THR L CG2 4651 N N . LEU C 179 ? 0.5380 0.6497 0.5740 -0.0020 -0.0358 0.0227 179 LEU L N 4652 C CA . LEU C 179 ? 0.5872 0.6806 0.5939 -0.0072 -0.0607 0.0139 179 LEU L CA 4653 C C . LEU C 179 ? 0.5293 0.6394 0.5558 -0.0265 -0.0577 0.0032 179 LEU L C 4654 O O . LEU C 179 ? 0.5630 0.6536 0.5848 -0.0389 -0.0335 0.0060 179 LEU L O 4655 C CB . LEU C 179 ? 0.6456 0.6749 0.5802 -0.0117 -0.0558 0.0194 179 LEU L CB 4656 C CG . LEU C 179 ? 0.6956 0.6929 0.5755 -0.0188 -0.0861 0.0129 179 LEU L CG 4657 C CD1 . LEU C 179 ? 0.6456 0.6439 0.5225 -0.0007 -0.1292 0.0178 179 LEU L CD1 4658 C CD2 . LEU C 179 ? 0.8021 0.7365 0.6024 -0.0344 -0.0656 0.0141 179 LEU L CD2 4659 N N . THR C 180 ? 0.5599 0.7052 0.6158 -0.0288 -0.0841 -0.0111 180 THR L N 4660 C CA . THR C 180 ? 0.5948 0.7615 0.6794 -0.0512 -0.0803 -0.0234 180 THR L CA 4661 C C . THR C 180 ? 0.6130 0.7665 0.6765 -0.0590 -0.1121 -0.0400 180 THR L C 4662 O O . THR C 180 ? 0.6286 0.8029 0.7054 -0.0468 -0.1497 -0.0500 180 THR L O 4663 C CB . THR C 180 ? 0.5953 0.8318 0.7515 -0.0567 -0.0755 -0.0323 180 THR L CB 4664 O OG1 . THR C 180 ? 0.5800 0.8249 0.7430 -0.0531 -0.0478 -0.0171 180 THR L OG1 4665 C CG2 . THR C 180 ? 0.5631 0.8162 0.7467 -0.0867 -0.0669 -0.0430 180 THR L CG2 4666 N N . LEU C 181 ? 0.6597 0.7768 0.6928 -0.0783 -0.1003 -0.0451 181 LEU L N 4667 C CA . LEU C 181 ? 0.7049 0.8073 0.7129 -0.0909 -0.1288 -0.0645 181 LEU L CA 4668 C C . LEU C 181 ? 0.7163 0.8277 0.7590 -0.1180 -0.1143 -0.0785 181 LEU L C 4669 O O . LEU C 181 ? 0.7255 0.8397 0.7972 -0.1267 -0.0820 -0.0681 181 LEU L O 4670 C CB . LEU C 181 ? 0.8018 0.8356 0.7174 -0.0914 -0.1296 -0.0629 181 LEU L CB 4671 C CG . LEU C 181 ? 0.9413 0.9496 0.8028 -0.0726 -0.1532 -0.0491 181 LEU L CG 4672 C CD1 . LEU C 181 ? 1.0423 0.9794 0.8014 -0.0845 -0.1439 -0.0493 181 LEU L CD1 4673 C CD2 . LEU C 181 ? 1.0208 1.0588 0.9043 -0.0611 -0.2099 -0.0566 181 LEU L CD2 4674 N N . SER C 182 ? 0.7204 0.8312 0.7572 -0.1326 -0.1420 -0.1013 182 SER L N 4675 C CA . SER C 182 ? 0.7144 0.8260 0.7821 -0.1616 -0.1304 -0.1174 182 SER L CA 4676 C C . SER C 182 ? 0.7523 0.7954 0.7661 -0.1709 -0.1054 -0.1201 182 SER L C 4677 O O . SER C 182 ? 0.8008 0.8022 0.7497 -0.1585 -0.1000 -0.1159 182 SER L O 4678 C CB . SER C 182 ? 0.7603 0.9018 0.8511 -0.1748 -0.1721 -0.1464 182 SER L CB 4679 O OG . SER C 182 ? 0.8397 0.9353 0.8512 -0.1713 -0.2021 -0.1573 182 SER L OG 4680 N N . LYS C 183 ? 0.7817 0.8125 0.8266 -0.1945 -0.0885 -0.1296 183 LYS L N 4681 C CA . LYS C 183 ? 0.8331 0.8007 0.8444 -0.2032 -0.0667 -0.1410 183 LYS L CA 4682 C C . LYS C 183 ? 0.9073 0.8416 0.8468 -0.2072 -0.0849 -0.1683 183 LYS L C 4683 O O . LYS C 183 ? 0.9483 0.8354 0.8348 -0.2024 -0.0634 -0.1751 183 LYS L O 4684 C CB . LYS C 183 ? 0.8945 0.8520 0.9564 -0.2305 -0.0558 -0.1491 183 LYS L CB 4685 C CG . LYS C 183 ? 0.9549 0.8470 0.9956 -0.2404 -0.0398 -0.1710 183 LYS L CG 4686 C CD . LYS C 183 ? 0.9633 0.8166 0.9987 -0.2202 -0.0095 -0.1556 183 LYS L CD 4687 C CE . LYS C 183 ? 1.0323 0.8248 1.0774 -0.2300 0.0073 -0.1800 183 LYS L CE 4688 N NZ . LYS C 183 ? 1.0104 0.7904 1.1068 -0.2559 0.0024 -0.1776 183 LYS L NZ 4689 N N . ALA C 184 ? 0.9179 0.8784 0.8556 -0.2176 -0.1246 -0.1862 184 ALA L N 4690 C CA . ALA C 184 ? 1.0053 0.9317 0.8636 -0.2258 -0.1504 -0.2119 184 ALA L CA 4691 C C . ALA C 184 ? 1.0924 0.9961 0.8674 -0.2063 -0.1598 -0.1960 184 ALA L C 4692 O O . ALA C 184 ? 1.2279 1.0781 0.9168 -0.2132 -0.1465 -0.2078 184 ALA L O 4693 C CB . ALA C 184 ? 1.0176 0.9820 0.9040 -0.2404 -0.1994 -0.2343 184 ALA L CB 4694 N N . ASP C 185 ? 1.0294 0.9715 0.8294 -0.1847 -0.1807 -0.1712 185 ASP L N 4695 C CA . ASP C 185 ? 1.0421 0.9574 0.7668 -0.1671 -0.1942 -0.1517 185 ASP L CA 4696 C C . ASP C 185 ? 1.0223 0.9002 0.7131 -0.1616 -0.1416 -0.1374 185 ASP L C 4697 O O . ASP C 185 ? 1.0778 0.9099 0.6792 -0.1621 -0.1376 -0.1317 185 ASP L O 4698 C CB . ASP C 185 ? 1.0038 0.9697 0.7817 -0.1429 -0.2279 -0.1324 185 ASP L CB 4699 C CG . ASP C 185 ? 1.1296 1.1288 0.9320 -0.1437 -0.2904 -0.1501 185 ASP L CG 4700 O OD1 . ASP C 185 ? 1.1591 1.1636 0.9731 -0.1663 -0.3009 -0.1776 185 ASP L OD1 4701 O OD2 . ASP C 185 ? 1.2124 1.2324 1.0290 -0.1210 -0.3318 -0.1391 185 ASP L OD2 4702 N N . TYR C 186 ? 0.9402 0.8362 0.7022 -0.1585 -0.1029 -0.1317 186 TYR L N 4703 C CA . TYR C 186 ? 0.8847 0.7538 0.6364 -0.1511 -0.0565 -0.1226 186 TYR L CA 4704 C C . TYR C 186 ? 0.9854 0.8011 0.6749 -0.1687 -0.0289 -0.1508 186 TYR L C 4705 O O . TYR C 186 ? 1.0047 0.7900 0.6403 -0.1679 -0.0023 -0.1502 186 TYR L O 4706 C CB . TYR C 186 ? 0.7843 0.6795 0.6247 -0.1445 -0.0316 -0.1109 186 TYR L CB 4707 C CG . TYR C 186 ? 0.7728 0.6440 0.6193 -0.1349 0.0095 -0.1059 186 TYR L CG 4708 C CD1 . TYR C 186 ? 0.7435 0.6198 0.5774 -0.1180 0.0191 -0.0859 186 TYR L CD1 4709 C CD2 . TYR C 186 ? 0.8058 0.6497 0.6803 -0.1419 0.0361 -0.1240 186 TYR L CD2 4710 C CE1 . TYR C 186 ? 0.8183 0.6800 0.6699 -0.1098 0.0546 -0.0856 186 TYR L CE1 4711 C CE2 . TYR C 186 ? 0.8283 0.6562 0.7245 -0.1299 0.0690 -0.1243 186 TYR L CE2 4712 C CZ . TYR C 186 ? 0.8874 0.7277 0.7736 -0.1146 0.0784 -0.1057 186 TYR L CZ 4713 O OH . TYR C 186 ? 0.9146 0.7460 0.8337 -0.1033 0.1093 -0.1101 186 TYR L OH 4714 N N . GLU C 187 ? 1.0953 0.9008 0.7945 -0.1872 -0.0326 -0.1795 187 GLU L N 4715 C CA . GLU C 187 ? 1.2061 0.9636 0.8552 -0.2050 -0.0036 -0.2155 187 GLU L CA 4716 C C . GLU C 187 ? 1.3104 1.0327 0.8379 -0.2213 -0.0198 -0.2293 187 GLU L C 4717 O O . GLU C 187 ? 1.3438 1.0247 0.8081 -0.2381 0.0128 -0.2589 187 GLU L O 4718 C CB . GLU C 187 ? 1.2198 0.9727 0.9194 -0.2206 -0.0051 -0.2437 187 GLU L CB 4719 C CG . GLU C 187 ? 1.2038 0.9712 1.0062 -0.2101 0.0133 -0.2290 187 GLU L CG 4720 C CD . GLU C 187 ? 1.3295 1.0777 1.1761 -0.2288 0.0128 -0.2557 187 GLU L CD 4721 O OE1 . GLU C 187 ? 1.4173 1.1635 1.2352 -0.2495 -0.0129 -0.2800 187 GLU L OE1 4722 O OE2 . GLU C 187 ? 1.3521 1.0831 1.2626 -0.2230 0.0345 -0.2523 187 GLU L OE2 4723 N N . LYS C 188 ? 1.3477 1.0843 0.8414 -0.2170 -0.0709 -0.2092 188 LYS L N 4724 C CA . LYS C 188 ? 1.3977 1.0921 0.7645 -0.2319 -0.0986 -0.2133 188 LYS L CA 4725 C C . LYS C 188 ? 1.3812 1.0364 0.6677 -0.2330 -0.0647 -0.1973 188 LYS L C 4726 O O . LYS C 188 ? 1.4809 1.0834 0.6432 -0.2562 -0.0633 -0.2077 188 LYS L O 4727 C CB . LYS C 188 ? 1.3786 1.0977 0.7452 -0.2206 -0.1702 -0.1930 188 LYS L CB 4728 C CG . LYS C 188 ? 1.3816 1.1194 0.7689 -0.2341 -0.2152 -0.2209 188 LYS L CG 4729 C CD . LYS C 188 ? 1.4247 1.1789 0.7967 -0.2225 -0.2916 -0.2059 188 LYS L CD 4730 C CE . LYS C 188 ? 1.5257 1.2971 0.9109 -0.2385 -0.3404 -0.2386 188 LYS L CE 4731 N NZ . LYS C 188 ? 1.5831 1.3821 0.9770 -0.2157 -0.4062 -0.2228 188 LYS L NZ 4732 N N . HIS C 189 ? 1.2647 0.9441 0.6177 -0.2119 -0.0365 -0.1728 189 HIS L N 4733 C CA . HIS C 189 ? 1.3118 0.9607 0.6018 -0.2130 -0.0093 -0.1538 189 HIS L CA 4734 C C . HIS C 189 ? 1.2727 0.9224 0.6049 -0.2148 0.0608 -0.1708 189 HIS L C 4735 O O . HIS C 189 ? 1.2654 0.9396 0.6875 -0.2078 0.0825 -0.1909 189 HIS L O 4736 C CB . HIS C 189 ? 1.2275 0.9011 0.5525 -0.1865 -0.0424 -0.1116 189 HIS L CB 4737 C CG . HIS C 189 ? 1.2656 0.9455 0.5714 -0.1788 -0.1148 -0.0985 189 HIS L CG 4738 N ND1 . HIS C 189 ? 1.3939 1.0192 0.5761 -0.1942 -0.1544 -0.0933 189 HIS L ND1 4739 C CD2 . HIS C 189 ? 1.1744 0.9098 0.5723 -0.1581 -0.1560 -0.0922 189 HIS L CD2 4740 C CE1 . HIS C 189 ? 1.3749 1.0233 0.5834 -0.1787 -0.2229 -0.0847 189 HIS L CE1 4741 N NE2 . HIS C 189 ? 1.2663 0.9859 0.6103 -0.1573 -0.2214 -0.0868 189 HIS L NE2 4742 N N . LYS C 190 ? 1.2625 0.8830 0.5327 -0.2246 0.0935 -0.1625 190 LYS L N 4743 C CA . LYS C 190 ? 1.2313 0.8517 0.5338 -0.2316 0.1623 -0.1879 190 LYS L CA 4744 C C . LYS C 190 ? 1.1651 0.8157 0.5451 -0.2092 0.1798 -0.1619 190 LYS L C 4745 O O . LYS C 190 ? 1.0937 0.7828 0.5878 -0.1882 0.1951 -0.1678 190 LYS L O 4746 C CB . LYS C 190 ? 1.3690 0.9420 0.5579 -0.2664 0.1965 -0.2051 190 LYS L CB 4747 C CG . LYS C 190 ? 1.3911 0.9787 0.6390 -0.2729 0.2656 -0.2321 190 LYS L CG 4748 C CD . LYS C 190 ? 1.5333 1.0881 0.6962 -0.3050 0.2896 -0.2330 190 LYS L CD 4749 C CE . LYS C 190 ? 1.6343 1.1584 0.7076 -0.3256 0.2658 -0.2464 190 LYS L CE 4750 N NZ . LYS C 190 ? 1.7510 1.2351 0.7255 -0.3603 0.2861 -0.2435 190 LYS L NZ 4751 N N . VAL C 191 ? 1.2009 0.8280 0.5141 -0.2149 0.1740 -0.1325 191 VAL L N 4752 C CA . VAL C 191 ? 1.1303 0.7797 0.5047 -0.1993 0.1936 -0.1120 191 VAL L CA 4753 C C . VAL C 191 ? 1.0673 0.7476 0.4956 -0.1679 0.1414 -0.0733 191 VAL L C 4754 O O . VAL C 191 ? 1.0849 0.7471 0.4575 -0.1655 0.0918 -0.0511 191 VAL L O 4755 C CB . VAL C 191 ? 1.1673 0.7692 0.4429 -0.2280 0.2252 -0.1045 191 VAL L CB 4756 C CG1 . VAL C 191 ? 1.0700 0.6991 0.4227 -0.2152 0.2523 -0.0924 191 VAL L CG1 4757 C CG2 . VAL C 191 ? 1.2045 0.7892 0.4500 -0.2576 0.2682 -0.1404 191 VAL L CG2 4758 N N . TYR C 192 ? 0.9797 0.7069 0.5184 -0.1439 0.1516 -0.0685 192 TYR L N 4759 C CA . TYR C 192 ? 0.9290 0.6902 0.5226 -0.1168 0.1131 -0.0380 192 TYR L CA 4760 C C . TYR C 192 ? 0.8904 0.6606 0.5179 -0.1090 0.1356 -0.0252 192 TYR L C 4761 O O . TYR C 192 ? 0.9109 0.7007 0.5999 -0.1071 0.1730 -0.0413 192 TYR L O 4762 C CB . TYR C 192 ? 0.8560 0.6645 0.5424 -0.0987 0.0982 -0.0420 192 TYR L CB 4763 C CG . TYR C 192 ? 0.9039 0.7081 0.5673 -0.1074 0.0712 -0.0539 192 TYR L CG 4764 C CD1 . TYR C 192 ? 0.9886 0.7728 0.6379 -0.1245 0.0941 -0.0849 192 TYR L CD1 4765 C CD2 . TYR C 192 ? 0.8664 0.6890 0.5300 -0.0988 0.0227 -0.0394 192 TYR L CD2 4766 C CE1 . TYR C 192 ? 0.9911 0.7705 0.6209 -0.1348 0.0681 -0.0987 192 TYR L CE1 4767 C CE2 . TYR C 192 ? 0.9427 0.7665 0.5940 -0.1086 -0.0039 -0.0538 192 TYR L CE2 4768 C CZ . TYR C 192 ? 0.9755 0.7759 0.6066 -0.1276 0.0184 -0.0823 192 TYR L CZ 4769 O OH . TYR C 192 ? 0.9916 0.7923 0.6122 -0.1396 -0.0091 -0.0993 192 TYR L OH 4770 N N . ALA C 193 ? 0.8602 0.6153 0.4538 -0.1034 0.1092 0.0014 193 ALA L N 4771 C CA . ALA C 193 ? 0.8524 0.6076 0.4679 -0.1005 0.1289 0.0126 193 ALA L CA 4772 C C . ALA C 193 ? 0.8568 0.6296 0.5034 -0.0758 0.0877 0.0376 193 ALA L C 4773 O O . ALA C 193 ? 0.9301 0.6933 0.5471 -0.0672 0.0428 0.0501 193 ALA L O 4774 C CB . ALA C 193 ? 0.9449 0.6387 0.4621 -0.1324 0.1567 0.0142 193 ALA L CB 4775 N N . CYS C 194 ? 0.7840 0.5849 0.4961 -0.0640 0.1019 0.0405 194 CYS L N 4776 C CA . CYS C 194 ? 0.7344 0.5449 0.4700 -0.0443 0.0706 0.0587 194 CYS L CA 4777 C C . CYS C 194 ? 0.7712 0.5435 0.4795 -0.0572 0.0907 0.0673 194 CYS L C 4778 O O . CYS C 194 ? 0.7928 0.5731 0.5283 -0.0699 0.1330 0.0544 194 CYS L O 4779 C CB . CYS C 194 ? 0.6123 0.4885 0.4438 -0.0207 0.0640 0.0541 194 CYS L CB 4780 S SG . CYS C 194 ? 0.9697 0.8772 0.8724 -0.0216 0.1047 0.0400 194 CYS L SG 4781 N N . GLU C 195 ? 0.8363 0.5650 0.4950 -0.0548 0.0587 0.0879 195 GLU L N 4782 C CA . GLU C 195 ? 0.8864 0.5674 0.5126 -0.0704 0.0742 0.1000 195 GLU L CA 4783 C C . GLU C 195 ? 0.8254 0.5368 0.5269 -0.0452 0.0561 0.1027 195 GLU L C 4784 O O . GLU C 195 ? 0.7797 0.5134 0.5120 -0.0179 0.0140 0.1059 195 GLU L O 4785 C CB . GLU C 195 ? 0.9796 0.5736 0.4894 -0.0879 0.0485 0.1243 195 GLU L CB 4786 C CG . GLU C 195 ? 1.0955 0.6244 0.5537 -0.1143 0.0702 0.1402 195 GLU L CG 4787 C CD . GLU C 195 ? 1.2534 0.6866 0.5882 -0.1312 0.0355 0.1701 195 GLU L CD 4788 O OE1 . GLU C 195 ? 1.2790 0.7021 0.5979 -0.1071 -0.0243 0.1816 195 GLU L OE1 4789 O OE2 . GLU C 195 ? 1.3802 0.7747 0.6674 -0.1627 0.0632 0.1713 195 GLU L OE2 4790 N N . VAL C 196 ? 0.7936 0.5096 0.5292 -0.0558 0.0895 0.0965 196 VAL L N 4791 C CA . VAL C 196 ? 0.6713 0.4210 0.4813 -0.0344 0.0763 0.0927 196 VAL L CA 4792 C C . VAL C 196 ? 0.7430 0.4338 0.5250 -0.0488 0.0788 0.1052 196 VAL L C 4793 O O . VAL C 196 ? 0.8193 0.4798 0.5758 -0.0806 0.1191 0.1040 196 VAL L O 4794 C CB . VAL C 196 ? 0.5847 0.4032 0.4810 -0.0294 0.1043 0.0707 196 VAL L CB 4795 C CG1 . VAL C 196 ? 0.5843 0.4317 0.5443 -0.0128 0.0917 0.0649 196 VAL L CG1 4796 C CG2 . VAL C 196 ? 0.4989 0.3674 0.4237 -0.0145 0.0959 0.0626 196 VAL L CG2 4797 N N . THR C 197 ? 0.8019 0.4761 0.5935 -0.0265 0.0368 0.1145 197 THR L N 4798 C CA . THR C 197 ? 0.8429 0.4566 0.6173 -0.0362 0.0319 0.1264 197 THR L CA 4799 C C . THR C 197 ? 0.7826 0.4476 0.6510 -0.0144 0.0264 0.1066 197 THR L C 4800 O O . THR C 197 ? 0.7161 0.4246 0.6326 0.0181 -0.0054 0.0959 197 THR L O 4801 C CB . THR C 197 ? 0.9414 0.4767 0.6477 -0.0275 -0.0190 0.1525 197 THR L CB 4802 O OG1 . THR C 197 ? 1.0992 0.5823 0.7044 -0.0511 -0.0173 0.1712 197 THR L OG1 4803 C CG2 . THR C 197 ? 0.9869 0.4466 0.6731 -0.0394 -0.0257 0.1676 197 THR L CG2 4804 N N . HIS C 198 ? 0.6716 0.5461 0.6746 -0.0455 0.0023 0.0559 198 HIS L N 4805 C CA . HIS C 198 ? 0.5946 0.5168 0.6565 -0.0336 0.0291 0.0283 198 HIS L CA 4806 C C . HIS C 198 ? 0.5682 0.5031 0.6500 -0.0308 0.0358 0.0290 198 HIS L C 4807 O O . HIS C 198 ? 0.5872 0.4939 0.6063 -0.0400 0.0318 0.0460 198 HIS L O 4808 C CB . HIS C 198 ? 0.5972 0.5322 0.6040 -0.0224 0.0596 0.0108 198 HIS L CB 4809 C CG . HIS C 198 ? 0.5638 0.5502 0.6217 -0.0157 0.0856 -0.0177 198 HIS L CG 4810 N ND1 . HIS C 198 ? 0.5326 0.5422 0.5747 0.0005 0.1076 -0.0323 198 HIS L ND1 4811 C CD2 . HIS C 198 ? 0.5257 0.5518 0.6531 -0.0268 0.0945 -0.0409 198 HIS L CD2 4812 C CE1 . HIS C 198 ? 0.4915 0.5519 0.5862 0.0005 0.1275 -0.0577 198 HIS L CE1 4813 N NE2 . HIS C 198 ? 0.4758 0.5499 0.6225 -0.0193 0.1217 -0.0646 198 HIS L NE2 4814 N N . GLN C 199 ? 0.5508 0.5335 0.7221 -0.0230 0.0491 0.0050 199 GLN L N 4815 C CA . GLN C 199 ? 0.5441 0.5439 0.7544 -0.0198 0.0569 0.0013 199 GLN L CA 4816 C C . GLN C 199 ? 0.5064 0.5098 0.6372 -0.0103 0.0893 -0.0089 199 GLN L C 4817 O O . GLN C 199 ? 0.5344 0.5293 0.6554 -0.0174 0.0940 -0.0049 199 GLN L O 4818 C CB . GLN C 199 ? 0.5020 0.5683 0.8365 -0.0114 0.0696 -0.0331 199 GLN L CB 4819 C CG . GLN C 199 ? 0.5504 0.6387 0.9495 -0.0073 0.0754 -0.0398 199 GLN L CG 4820 C CD . GLN C 199 ? 0.5593 0.7244 1.1023 -0.0009 0.0851 -0.0805 199 GLN L CD 4821 O OE1 . GLN C 199 ? 0.4692 0.6674 1.0736 -0.0072 0.0801 -0.1038 199 GLN L OE1 4822 N NE2 . GLN C 199 ? 0.6130 0.8051 1.1999 0.0072 0.0994 -0.0943 199 GLN L NE2 4823 N N . GLY C 200 ? 0.5151 0.5274 0.5911 0.0033 0.1085 -0.0255 200 GLY L N 4824 C CA . GLY C 200 ? 0.4807 0.4975 0.4952 0.0172 0.1316 -0.0469 200 GLY L CA 4825 C C . GLY C 200 ? 0.6164 0.5904 0.5448 0.0034 0.1214 -0.0365 200 GLY L C 4826 O O . GLY C 200 ? 0.6660 0.6450 0.5510 0.0108 0.1369 -0.0644 200 GLY L O 4827 N N . LEU C 201 ? 0.7057 0.6436 0.6167 -0.0182 0.0940 -0.0035 201 LEU L N 4828 C CA . LEU C 201 ? 0.7268 0.6331 0.5602 -0.0393 0.0840 0.0056 201 LEU L CA 4829 C C . LEU C 201 ? 0.7109 0.5952 0.5303 -0.0733 0.0723 0.0292 201 LEU L C 4830 O O . LEU C 201 ? 0.7063 0.5706 0.5690 -0.0835 0.0450 0.0606 201 LEU L O 4831 C CB . LEU C 201 ? 0.7753 0.6560 0.5865 -0.0431 0.0610 0.0255 201 LEU L CB 4832 C CG . LEU C 201 ? 0.7393 0.6181 0.5101 -0.0270 0.0666 0.0055 201 LEU L CG 4833 C CD1 . LEU C 201 ? 0.6995 0.6019 0.4789 0.0004 0.0871 -0.0276 201 LEU L CD1 4834 C CD2 . LEU C 201 ? 0.7211 0.5817 0.5015 -0.0256 0.0507 0.0237 201 LEU L CD2 4835 N N . SER C 202 ? 0.7580 0.6439 0.5177 -0.0947 0.0900 0.0101 202 SER L N 4836 C CA . SER C 202 ? 0.8546 0.7137 0.5763 -0.1399 0.0823 0.0326 202 SER L CA 4837 C C . SER C 202 ? 0.8613 0.6752 0.5404 -0.1713 0.0412 0.0792 202 SER L C 4838 O O . SER C 202 ? 0.9291 0.7024 0.5937 -0.2047 0.0134 0.1185 202 SER L O 4839 C CB . SER C 202 ? 0.9986 0.8776 0.6582 -0.1654 0.1164 -0.0109 202 SER L CB 4840 O OG . SER C 202 ? 1.0060 0.9277 0.7077 -0.1300 0.1505 -0.0619 202 SER L OG 4841 N N . SER C 203 ? 0.8264 0.6439 0.4857 -0.1605 0.0340 0.0746 203 SER L N 4842 C CA . SER C 203 ? 0.9126 0.6957 0.5380 -0.1838 -0.0035 0.1116 203 SER L CA 4843 C C . SER C 203 ? 0.8396 0.6333 0.4922 -0.1508 -0.0080 0.1028 203 SER L C 4844 O O . SER C 203 ? 0.7969 0.6188 0.4640 -0.1217 0.0177 0.0686 203 SER L O 4845 C CB . SER C 203 ? 1.0807 0.8599 0.6092 -0.2363 0.0007 0.1084 203 SER L CB 4846 O OG . SER C 203 ? 1.0779 0.9014 0.5872 -0.2289 0.0343 0.0545 203 SER L OG 4847 N N . PRO C 204 ? 0.8356 0.6017 0.4953 -0.1561 -0.0440 0.1331 204 PRO L N 4848 C CA . PRO C 204 ? 0.8233 0.5964 0.5048 -0.1314 -0.0459 0.1234 204 PRO L CA 4849 C C . PRO C 204 ? 0.8569 0.6526 0.4901 -0.1307 -0.0232 0.0935 204 PRO L C 4850 O O . PRO C 204 ? 0.9610 0.7620 0.5366 -0.1625 -0.0239 0.0899 204 PRO L O 4851 C CB . PRO C 204 ? 0.8259 0.5655 0.5075 -0.1476 -0.0899 0.1561 204 PRO L CB 4852 C CG . PRO C 204 ? 0.8446 0.5540 0.5459 -0.1644 -0.1194 0.1852 204 PRO L CG 4853 C CD . PRO C 204 ? 0.8408 0.5622 0.4962 -0.1836 -0.0895 0.1767 204 PRO L CD 4854 N N . VAL C 205 ? 0.7785 0.5872 0.4370 -0.0990 -0.0063 0.0700 205 VAL L N 4855 C CA . VAL C 205 ? 0.8152 0.6394 0.4455 -0.0926 0.0060 0.0381 205 VAL L CA 4856 C C . VAL C 205 ? 0.8152 0.6275 0.4497 -0.0859 -0.0069 0.0440 205 VAL L C 4857 O O . VAL C 205 ? 0.8003 0.5961 0.4672 -0.0732 -0.0129 0.0593 205 VAL L O 4858 C CB . VAL C 205 ? 0.8455 0.6809 0.4925 -0.0627 0.0251 0.0080 205 VAL L CB 4859 C CG1 . VAL C 205 ? 0.8424 0.6848 0.4739 -0.0526 0.0245 -0.0278 205 VAL L CG1 4860 C CG2 . VAL C 205 ? 0.8702 0.7238 0.5186 -0.0678 0.0422 -0.0063 205 VAL L CG2 4861 N N . THR C 206 ? 0.8567 0.6837 0.4649 -0.0981 -0.0086 0.0247 206 THR L N 4862 C CA . THR C 206 ? 0.8841 0.7044 0.5004 -0.0924 -0.0188 0.0256 206 THR L CA 4863 C C . THR C 206 ? 0.8807 0.7075 0.5041 -0.0744 -0.0145 -0.0098 206 THR L C 4864 O O . THR C 206 ? 0.9291 0.7856 0.5461 -0.0830 -0.0106 -0.0468 206 THR L O 4865 C CB . THR C 206 ? 0.9045 0.7392 0.4958 -0.1241 -0.0322 0.0337 206 THR L CB 4866 O OG1 . THR C 206 ? 0.9327 0.7447 0.5218 -0.1370 -0.0509 0.0718 206 THR L OG1 4867 C CG2 . THR C 206 ? 0.9053 0.7430 0.5133 -0.1158 -0.0383 0.0250 206 THR L CG2 4868 N N . LYS C 207 ? 0.8664 0.6638 0.5058 -0.0532 -0.0179 -0.0022 207 LYS L N 4869 C CA . LYS C 207 ? 0.9036 0.6906 0.5506 -0.0377 -0.0261 -0.0272 207 LYS L CA 4870 C C . LYS C 207 ? 0.9313 0.7139 0.5898 -0.0435 -0.0330 -0.0221 207 LYS L C 4871 O O . LYS C 207 ? 0.9989 0.7620 0.6605 -0.0462 -0.0300 0.0035 207 LYS L O 4872 C CB . LYS C 207 ? 0.9520 0.6983 0.5943 -0.0160 -0.0281 -0.0199 207 LYS L CB 4873 C CG . LYS C 207 ? 1.0537 0.8088 0.6913 -0.0044 -0.0226 -0.0339 207 LYS L CG 4874 C CD . LYS C 207 ? 1.1324 0.9171 0.7811 -0.0010 -0.0299 -0.0820 207 LYS L CD 4875 C CE . LYS C 207 ? 1.1601 0.9597 0.8088 0.0095 -0.0201 -0.1030 207 LYS L CE 4876 N NZ . LYS C 207 ? 1.1931 1.0308 0.8609 0.0069 -0.0230 -0.1637 207 LYS L NZ 4877 N N . SER C 208 ? 0.8776 0.6850 0.5528 -0.0461 -0.0416 -0.0548 208 SER L N 4878 C CA . SER C 208 ? 0.7668 0.5832 0.4610 -0.0527 -0.0459 -0.0564 208 SER L CA 4879 C C . SER C 208 ? 0.7157 0.5332 0.4463 -0.0406 -0.0609 -0.0920 208 SER L C 4880 O O . SER C 208 ? 0.7140 0.5289 0.4588 -0.0279 -0.0737 -0.1214 208 SER L O 4881 C CB . SER C 208 ? 0.7617 0.6295 0.4477 -0.0816 -0.0422 -0.0606 208 SER L CB 4882 O OG . SER C 208 ? 0.8331 0.7506 0.5202 -0.0989 -0.0400 -0.1019 208 SER L OG 4883 N N . PHE C 209 ? 0.7290 0.5507 0.4838 -0.0432 -0.0629 -0.0934 209 PHE L N 4884 C CA . PHE C 209 ? 0.7513 0.5790 0.5561 -0.0336 -0.0803 -0.1294 209 PHE L CA 4885 C C . PHE C 209 ? 0.7576 0.6268 0.5944 -0.0460 -0.0736 -0.1403 209 PHE L C 4886 O O . PHE C 209 ? 0.7568 0.6274 0.5710 -0.0558 -0.0595 -0.1123 209 PHE L O 4887 C CB . PHE C 209 ? 0.8409 0.5871 0.6393 -0.0130 -0.0974 -0.1100 209 PHE L CB 4888 C CG . PHE C 209 ? 0.8718 0.5744 0.6488 -0.0185 -0.0835 -0.0730 209 PHE L CG 4889 C CD1 . PHE C 209 ? 0.9189 0.6122 0.7308 -0.0183 -0.0881 -0.0824 209 PHE L CD1 4890 C CD2 . PHE C 209 ? 0.8491 0.5256 0.5811 -0.0258 -0.0644 -0.0375 209 PHE L CD2 4891 C CE1 . PHE C 209 ? 0.9246 0.5804 0.7182 -0.0274 -0.0705 -0.0575 209 PHE L CE1 4892 C CE2 . PHE C 209 ? 0.8977 0.5425 0.6192 -0.0360 -0.0487 -0.0182 209 PHE L CE2 4893 C CZ . PHE C 209 ? 0.9124 0.5454 0.6605 -0.0378 -0.0500 -0.0284 209 PHE L CZ 4894 N N . ASN C 210 ? 0.8455 0.7523 0.7449 -0.0443 -0.0868 -0.1872 210 ASN L N 4895 C CA . ASN C 210 ? 0.8270 0.7786 0.7693 -0.0533 -0.0806 -0.2044 210 ASN L CA 4896 C C . ASN C 210 ? 0.8366 0.7360 0.8203 -0.0331 -0.0946 -0.2037 210 ASN L C 4897 O O . ASN C 210 ? 0.9089 0.7550 0.9060 -0.0158 -0.1204 -0.2082 210 ASN L O 4898 C CB . ASN C 210 ? 0.8405 0.8931 0.8349 -0.0753 -0.0810 -0.2674 210 ASN L CB 4899 C CG . ASN C 210 ? 0.8618 0.9647 0.8004 -0.1091 -0.0644 -0.2647 210 ASN L CG 4900 O OD1 . ASN C 210 ? 0.8676 1.0066 0.7798 -0.1328 -0.0529 -0.2507 210 ASN L OD1 4901 N ND2 . ASN C 210 ? 0.8737 0.9748 0.7915 -0.1131 -0.0659 -0.2782 210 ASN L ND2 4902 N N . ARG C 211 ? 0.7870 0.6964 0.7882 -0.0366 -0.0807 -0.1976 211 ARG L N 4903 C CA . ARG C 211 ? 0.8190 0.6820 0.8611 -0.0238 -0.0900 -0.1997 211 ARG L CA 4904 C C . ARG C 211 ? 0.8101 0.7071 0.9428 -0.0151 -0.1193 -0.2544 211 ARG L C 4905 O O . ARG C 211 ? 0.8082 0.7901 1.0130 -0.0227 -0.1143 -0.3004 211 ARG L O 4906 C CB . ARG C 211 ? 0.8246 0.7104 0.8811 -0.0302 -0.0653 -0.1967 211 ARG L CB 4907 C CG . ARG C 211 ? 0.8549 0.6744 0.8484 -0.0333 -0.0451 -0.1519 211 ARG L CG 4908 C CD . ARG C 211 ? 0.8614 0.7148 0.8796 -0.0377 -0.0227 -0.1619 211 ARG L CD 4909 N NE . ARG C 211 ? 0.8962 0.7733 0.9881 -0.0322 -0.0229 -0.1955 211 ARG L NE 4910 C CZ . ARG C 211 ? 0.8965 0.8668 1.0515 -0.0337 -0.0225 -0.2359 211 ARG L CZ 4911 N NH1 . ARG C 211 ? 0.8700 0.9115 1.0081 -0.0461 -0.0228 -0.2433 211 ARG L NH1 4912 N NH2 . ARG C 211 ? 0.9348 0.9275 1.1681 -0.0274 -0.0220 -0.2695 211 ARG L NH2 4913 N N . GLY C 212 ? 0.8600 0.6931 0.9950 0.0003 -0.1537 -0.2538 212 GLY L N 4914 C CA . GLY C 212 ? 0.8633 0.7192 1.0978 0.0127 -0.1938 -0.3121 212 GLY L CA 4915 C C . GLY C 212 ? 0.9008 0.7027 1.1229 0.0289 -0.2331 -0.3168 212 GLY L C 4916 O O . GLY C 212 ? 0.8572 0.7023 1.0575 0.0235 -0.2242 -0.3344 212 GLY L O 4917 N N . VAL D 15 ? 0.8407 1.4509 1.7312 -0.1326 -0.0821 0.6523 381 VAL B N 4918 C CA . VAL D 15 ? 0.8339 1.4278 1.6628 -0.1131 -0.0659 0.6014 381 VAL B CA 4919 C C . VAL D 15 ? 0.8167 1.3060 1.5812 -0.1317 -0.1099 0.5099 381 VAL B C 4920 O O . VAL D 15 ? 0.8516 1.2822 1.5628 -0.1355 -0.1141 0.4702 381 VAL B O 4921 C CB . VAL D 15 ? 0.8602 1.4654 1.5810 -0.0555 0.0077 0.5904 381 VAL B CB 4922 C CG1 . VAL D 15 ? 0.8265 1.4048 1.4787 -0.0325 0.0191 0.5381 381 VAL B CG1 4923 C CG2 . VAL D 15 ? 0.9187 1.6282 1.6897 -0.0259 0.0575 0.6822 381 VAL B CG2 4924 N N . GLU D 16 ? 0.7141 1.1823 1.4834 -0.1404 -0.1416 0.4796 382 GLU B N 4925 C CA . GLU D 16 ? 0.6805 1.0563 1.3882 -0.1512 -0.1810 0.3986 382 GLU B CA 4926 C C . GLU D 16 ? 0.6482 0.9984 1.2599 -0.1189 -0.1491 0.3458 382 GLU B C 4927 O O . GLU D 16 ? 0.6304 1.0266 1.2542 -0.1032 -0.1297 0.3679 382 GLU B O 4928 C CB . GLU D 16 ? 0.7316 1.0858 1.5168 -0.1881 -0.2587 0.4005 382 GLU B CB 4929 C CG . GLU D 16 ? 0.7937 1.0507 1.5109 -0.1927 -0.3017 0.3194 382 GLU B CG 4930 C CD . GLU D 16 ? 0.8554 1.0619 1.6131 -0.2159 -0.3763 0.3139 382 GLU B CD 4931 O OE1 . GLU D 16 ? 0.9105 1.1421 1.7357 -0.2273 -0.3902 0.3709 382 GLU B OE1 4932 O OE2 . GLU D 16 ? 0.8487 0.9745 1.5454 -0.2120 -0.4118 0.2501 382 GLU B OE2 4933 N N . CYS D 17 ? 0.6009 0.8804 1.1243 -0.1093 -0.1446 0.2804 383 CYS B N 4934 C CA . CYS D 17 ? 0.5856 0.8367 1.0235 -0.0814 -0.1186 0.2322 383 CYS B CA 4935 C C . CYS D 17 ? 0.5971 0.8387 1.0470 -0.0881 -0.1535 0.2142 383 CYS B C 4936 O O . CYS D 17 ? 0.6299 0.8375 1.1096 -0.1115 -0.2084 0.1998 383 CYS B O 4937 C CB . CYS D 17 ? 0.5894 0.7704 0.9498 -0.0743 -0.1132 0.1750 383 CYS B CB 4938 S SG . CYS D 17 ? 0.6743 0.8524 1.0042 -0.0624 -0.0759 0.1883 383 CYS B SG 4939 N N . ASP D 18 ? 0.6029 0.8684 1.0238 -0.0646 -0.1248 0.2131 384 ASP B N 4940 C CA . ASP D 18 ? 0.6051 0.8705 1.0405 -0.0686 -0.1553 0.2045 384 ASP B CA 4941 C C . ASP D 18 ? 0.5912 0.7983 0.9412 -0.0525 -0.1564 0.1422 384 ASP B C 4942 O O . ASP D 18 ? 0.5117 0.7179 0.8030 -0.0269 -0.1146 0.1259 384 ASP B O 4943 C CB . ASP D 18 ? 0.5969 0.9333 1.0669 -0.0537 -0.1265 0.2503 384 ASP B CB 4944 C CG . ASP D 18 ? 0.6513 0.9935 1.1547 -0.0631 -0.1653 0.2520 384 ASP B CG 4945 O OD1 . ASP D 18 ? 0.6979 1.0086 1.2388 -0.0896 -0.2257 0.2449 384 ASP B OD1 4946 O OD2 . ASP D 18 ? 0.6695 1.0422 1.1592 -0.0426 -0.1398 0.2591 384 ASP B OD2 4947 N N . PHE D 19 ? 0.6592 0.8170 1.0029 -0.0648 -0.2066 0.1103 385 PHE B N 4948 C CA . PHE D 19 ? 0.6903 0.7988 0.9558 -0.0454 -0.2090 0.0578 385 PHE B CA 4949 C C . PHE D 19 ? 0.7032 0.8183 0.9729 -0.0413 -0.2357 0.0576 385 PHE B C 4950 O O . PHE D 19 ? 0.7253 0.8000 0.9337 -0.0245 -0.2471 0.0183 385 PHE B O 4951 C CB . PHE D 19 ? 0.7623 0.8059 0.9986 -0.0497 -0.2440 0.0178 385 PHE B CB 4952 C CG . PHE D 19 ? 0.7819 0.8127 1.0120 -0.0540 -0.2215 0.0143 385 PHE B CG 4953 C CD1 . PHE D 19 ? 0.7779 0.8261 0.9783 -0.0395 -0.1667 0.0185 385 PHE B CD1 4954 C CD2 . PHE D 19 ? 0.8490 0.8447 1.1026 -0.0718 -0.2607 0.0063 385 PHE B CD2 4955 C CE1 . PHE D 19 ? 0.7747 0.8061 0.9680 -0.0433 -0.1512 0.0152 385 PHE B CE1 4956 C CE2 . PHE D 19 ? 0.8475 0.8310 1.0967 -0.0763 -0.2414 0.0040 385 PHE B CE2 4957 C CZ . PHE D 19 ? 0.7980 0.7997 1.0168 -0.0623 -0.1865 0.0088 385 PHE B CZ 4958 N N . SER D 20 ? 0.6941 0.8629 1.0374 -0.0545 -0.2447 0.1051 386 SER B N 4959 C CA . SER D 20 ? 0.7158 0.8927 1.0789 -0.0555 -0.2787 0.1119 386 SER B CA 4960 C C . SER D 20 ? 0.7168 0.8830 1.0045 -0.0270 -0.2532 0.0812 386 SER B C 4961 O O . SER D 20 ? 0.8038 0.9328 1.0608 -0.0215 -0.2922 0.0551 386 SER B O 4962 C CB . SER D 20 ? 0.6656 0.9185 1.1271 -0.0698 -0.2759 0.1782 386 SER B CB 4963 O OG . SER D 20 ? 0.6718 0.9390 1.2174 -0.0988 -0.3082 0.2156 386 SER B OG 4964 N N . PRO D 21 ? 0.6162 0.8108 0.8720 -0.0070 -0.1920 0.0850 387 PRO B N 4965 C CA . PRO D 21 ? 0.6342 0.8221 0.8311 0.0171 -0.1727 0.0630 387 PRO B CA 4966 C C . PRO D 21 ? 0.6744 0.8013 0.7952 0.0309 -0.1875 0.0136 387 PRO B C 4967 O O . PRO D 21 ? 0.7395 0.8569 0.8194 0.0476 -0.1906 -0.0016 387 PRO B O 4968 C CB . PRO D 21 ? 0.6039 0.8168 0.7782 0.0352 -0.1127 0.0715 387 PRO B CB 4969 C CG . PRO D 21 ? 0.5595 0.8136 0.7937 0.0241 -0.1008 0.1120 387 PRO B CG 4970 C CD . PRO D 21 ? 0.5392 0.7694 0.8087 -0.0024 -0.1435 0.1104 387 PRO B CD 4971 N N . LEU D 22 ? 0.6595 0.7483 0.7619 0.0268 -0.1953 -0.0082 388 LEU B N 4972 C CA . LEU D 22 ? 0.7096 0.7448 0.7412 0.0458 -0.2055 -0.0510 388 LEU B CA 4973 C C . LEU D 22 ? 0.8271 0.8267 0.8418 0.0496 -0.2644 -0.0689 388 LEU B C 4974 O O . LEU D 22 ? 0.8685 0.8379 0.8133 0.0771 -0.2671 -0.0974 388 LEU B O 4975 C CB . LEU D 22 ? 0.7329 0.7380 0.7588 0.0402 -0.2036 -0.0663 388 LEU B CB 4976 C CG . LEU D 22 ? 0.8414 0.8111 0.7996 0.0654 -0.1814 -0.0991 388 LEU B CG 4977 C CD1 . LEU D 22 ? 0.8402 0.7981 0.8137 0.0545 -0.1679 -0.1008 388 LEU B CD1 4978 C CD2 . LEU D 22 ? 0.9274 0.8491 0.8319 0.0865 -0.2205 -0.1325 388 LEU B CD2 4979 N N . LEU D 23 ? 0.8458 0.8484 0.9256 0.0239 -0.3139 -0.0489 389 LEU B N 4980 C CA . LEU D 23 ? 0.9009 0.8546 0.9690 0.0250 -0.3857 -0.0676 389 LEU B CA 4981 C C . LEU D 23 ? 0.9661 0.9398 1.0490 0.0260 -0.4072 -0.0514 389 LEU B C 4982 O O . LEU D 23 ? 1.0746 1.0153 1.1752 0.0180 -0.4768 -0.0537 389 LEU B O 4983 C CB . LEU D 23 ? 0.8145 0.7516 0.9547 -0.0065 -0.4419 -0.0525 389 LEU B CB 4984 C CG . LEU D 23 ? 0.8029 0.7172 0.9364 -0.0109 -0.4293 -0.0667 389 LEU B CG 4985 C CD1 . LEU D 23 ? 0.8805 0.7818 1.0962 -0.0449 -0.4903 -0.0449 389 LEU B CD1 4986 C CD2 . LEU D 23 ? 0.8542 0.7042 0.8847 0.0250 -0.4304 -0.1217 389 LEU B CD2 4987 N N . SER D 24 ? 0.9084 0.9312 0.9852 0.0361 -0.3527 -0.0353 390 SER B N 4988 C CA . SER D 24 ? 0.8758 0.9225 0.9698 0.0375 -0.3682 -0.0176 390 SER B CA 4989 C C . SER D 24 ? 0.8148 0.8784 0.8467 0.0656 -0.3158 -0.0275 390 SER B C 4990 O O . SER D 24 ? 0.7750 0.8521 0.7802 0.0766 -0.2598 -0.0320 390 SER B O 4991 C CB . SER D 24 ? 0.8651 0.9783 1.0692 0.0089 -0.3666 0.0385 390 SER B CB 4992 O OG . SER D 24 ? 0.9411 1.0434 1.2171 -0.0201 -0.4214 0.0570 390 SER B OG 4993 N N . GLY D 25 ? 0.8521 0.9121 0.8653 0.0761 -0.3395 -0.0287 391 GLY B N 4994 C CA . GLY D 25 ? 0.8784 0.9568 0.8421 0.1005 -0.2966 -0.0321 391 GLY B CA 4995 C C . GLY D 25 ? 0.9205 0.9615 0.7894 0.1321 -0.2716 -0.0675 391 GLY B C 4996 O O . GLY D 25 ? 0.9349 0.9286 0.7638 0.1410 -0.2934 -0.0953 391 GLY B O 4997 N N . THR D 26 ? 0.8999 0.9645 0.7374 0.1508 -0.2260 -0.0627 392 THR B N 4998 C CA . THR D 26 ? 0.8801 0.9230 0.6400 0.1823 -0.1968 -0.0838 392 THR B CA 4999 C C . THR D 26 ? 0.7900 0.8494 0.5650 0.1785 -0.1461 -0.0774 392 THR B C 5000 O O . THR D 26 ? 0.7461 0.8417 0.5566 0.1704 -0.1122 -0.0552 392 THR B O 5001 C CB . THR D 26 ? 0.8771 0.9351 0.5980 0.2051 -0.1805 -0.0768 392 THR B CB 5002 O OG1 . THR D 26 ? 0.9613 0.9958 0.6598 0.2112 -0.2328 -0.0854 392 THR B OG1 5003 C CG2 . THR D 26 ? 0.8359 0.8821 0.4874 0.2389 -0.1457 -0.0874 392 THR B CG2 5004 N N . PRO D 27 ? 0.7857 0.8140 0.5323 0.1866 -0.1450 -0.0976 393 PRO B N 5005 C CA . PRO D 27 ? 0.7754 0.8137 0.5349 0.1842 -0.1017 -0.0918 393 PRO B CA 5006 C C . PRO D 27 ? 0.7475 0.8046 0.4813 0.2059 -0.0597 -0.0796 393 PRO B C 5007 O O . PRO D 27 ? 0.7773 0.8273 0.4581 0.2339 -0.0600 -0.0852 393 PRO B O 5008 C CB . PRO D 27 ? 0.7532 0.7506 0.4812 0.1937 -0.1170 -0.1175 393 PRO B CB 5009 C CG . PRO D 27 ? 0.8341 0.7965 0.5026 0.2180 -0.1573 -0.1402 393 PRO B CG 5010 C CD . PRO D 27 ? 0.8344 0.8114 0.5338 0.2010 -0.1884 -0.1277 393 PRO B CD 5011 N N . PRO D 28 ? 0.7154 0.7940 0.4861 0.1949 -0.0271 -0.0608 394 PRO B N 5012 C CA . PRO D 28 ? 0.6827 0.7784 0.4461 0.2102 0.0058 -0.0427 394 PRO B CA 5013 C C . PRO D 28 ? 0.7015 0.7874 0.4373 0.2313 0.0268 -0.0435 394 PRO B C 5014 O O . PRO D 28 ? 0.6750 0.7383 0.3949 0.2349 0.0184 -0.0617 394 PRO B O 5015 C CB . PRO D 28 ? 0.6316 0.7388 0.4428 0.1917 0.0211 -0.0272 394 PRO B CB 5016 C CG . PRO D 28 ? 0.5695 0.6621 0.4013 0.1732 0.0100 -0.0388 394 PRO B CG 5017 C CD . PRO D 28 ? 0.7175 0.8016 0.5381 0.1695 -0.0239 -0.0540 394 PRO B CD 5018 N N . GLN D 29 ? 0.7197 0.8249 0.4552 0.2462 0.0534 -0.0199 395 GLN B N 5019 C CA . GLN D 29 ? 0.6953 0.8035 0.4199 0.2674 0.0789 -0.0080 395 GLN B CA 5020 C C . GLN D 29 ? 0.6884 0.7889 0.4617 0.2478 0.0894 -0.0007 395 GLN B C 5021 O O . GLN D 29 ? 0.7039 0.7949 0.5088 0.2221 0.0780 -0.0060 395 GLN B O 5022 C CB . GLN D 29 ? 0.7107 0.8484 0.4314 0.2882 0.1020 0.0247 395 GLN B CB 5023 C CG . GLN D 29 ? 0.7731 0.9169 0.4402 0.3101 0.0913 0.0190 395 GLN B CG 5024 C CD . GLN D 29 ? 0.9090 1.0288 0.5060 0.3389 0.0778 -0.0094 395 GLN B CD 5025 O OE1 . GLN D 29 ? 0.9281 1.0455 0.5031 0.3634 0.0965 -0.0082 395 GLN B OE1 5026 N NE2 . GLN D 29 ? 0.9852 1.0843 0.5474 0.3383 0.0418 -0.0346 395 GLN B NE2 5027 N N . VAL D 30 ? 0.6922 0.7977 0.4704 0.2634 0.1112 0.0141 396 VAL B N 5028 C CA . VAL D 30 ? 0.6611 0.7542 0.4836 0.2464 0.1164 0.0196 396 VAL B CA 5029 C C . VAL D 30 ? 0.6864 0.7788 0.5609 0.2245 0.1148 0.0413 396 VAL B C 5030 O O . VAL D 30 ? 0.6571 0.7263 0.5575 0.2036 0.1042 0.0335 396 VAL B O 5031 C CB . VAL D 30 ? 0.6830 0.7891 0.5078 0.2715 0.1420 0.0390 396 VAL B CB 5032 C CG1 . VAL D 30 ? 0.6358 0.7801 0.4709 0.2937 0.1671 0.0814 396 VAL B CG1 5033 C CG2 . VAL D 30 ? 0.6639 0.7556 0.5406 0.2521 0.1434 0.0465 396 VAL B CG2 5034 N N . TYR D 31 ? 0.6859 0.7987 0.5706 0.2316 0.1213 0.0672 397 TYR B N 5035 C CA . TYR D 31 ? 0.6098 0.7134 0.5396 0.2161 0.1130 0.0872 397 TYR B CA 5036 C C . TYR D 31 ? 0.6296 0.7183 0.5483 0.2033 0.0941 0.0663 397 TYR B C 5037 O O . TYR D 31 ? 0.6645 0.7336 0.6067 0.1947 0.0822 0.0729 397 TYR B O 5038 C CB . TYR D 31 ? 0.6217 0.7525 0.5753 0.2289 0.1243 0.1283 397 TYR B CB 5039 C CG . TYR D 31 ? 0.6683 0.8260 0.5808 0.2472 0.1312 0.1288 397 TYR B CG 5040 C CD1 . TYR D 31 ? 0.6968 0.8792 0.5715 0.2747 0.1514 0.1341 397 TYR B CD1 5041 C CD2 . TYR D 31 ? 0.6719 0.8281 0.5791 0.2412 0.1167 0.1242 397 TYR B CD2 5042 C CE1 . TYR D 31 ? 0.7019 0.9026 0.5313 0.2942 0.1536 0.1334 397 TYR B CE1 5043 C CE2 . TYR D 31 ? 0.6813 0.8601 0.5528 0.2569 0.1198 0.1255 397 TYR B CE2 5044 C CZ . TYR D 31 ? 0.6811 0.8801 0.5123 0.2826 0.1367 0.1296 397 TYR B CZ 5045 O OH . TYR D 31 ? 0.6832 0.8984 0.4710 0.3009 0.1358 0.1296 397 TYR B OH 5046 N N . ASN D 32 ? 0.6587 0.7553 0.5418 0.2052 0.0890 0.0428 398 ASN B N 5047 C CA . ASN D 32 ? 0.6486 0.7410 0.5288 0.1950 0.0749 0.0289 398 ASN B CA 5048 C C . ASN D 32 ? 0.6364 0.7185 0.5100 0.1825 0.0653 0.0053 398 ASN B C 5049 O O . ASN D 32 ? 0.6372 0.7299 0.5053 0.1778 0.0543 -0.0035 398 ASN B O 5050 C CB . ASN D 32 ? 0.7052 0.8212 0.5666 0.2043 0.0713 0.0313 398 ASN B CB 5051 C CG . ASN D 32 ? 0.7766 0.9023 0.6515 0.2134 0.0767 0.0569 398 ASN B CG 5052 O OD1 . ASN D 32 ? 0.8353 0.9445 0.7381 0.2098 0.0751 0.0704 398 ASN B OD1 5053 N ND2 . ASN D 32 ? 0.8232 0.9712 0.6786 0.2254 0.0779 0.0641 398 ASN B ND2 5054 N N . PHE D 33 ? 0.6044 0.6677 0.4863 0.1762 0.0676 -0.0003 399 PHE B N 5055 C CA . PHE D 33 ? 0.6359 0.6880 0.5149 0.1638 0.0568 -0.0201 399 PHE B CA 5056 C C . PHE D 33 ? 0.6114 0.6651 0.5032 0.1516 0.0482 -0.0217 399 PHE B C 5057 O O . PHE D 33 ? 0.5871 0.6342 0.4870 0.1537 0.0526 -0.0123 399 PHE B O 5058 C CB . PHE D 33 ? 0.7124 0.7426 0.6033 0.1593 0.0615 -0.0226 399 PHE B CB 5059 C CG . PHE D 33 ? 0.7504 0.7608 0.6662 0.1523 0.0630 -0.0107 399 PHE B CG 5060 C CD1 . PHE D 33 ? 0.7204 0.7113 0.6415 0.1399 0.0541 -0.0190 399 PHE B CD1 5061 C CD2 . PHE D 33 ? 0.7669 0.7752 0.7010 0.1597 0.0694 0.0112 399 PHE B CD2 5062 C CE1 . PHE D 33 ? 0.6687 0.6307 0.6007 0.1385 0.0493 -0.0117 399 PHE B CE1 5063 C CE2 . PHE D 33 ? 0.7406 0.7192 0.6969 0.1538 0.0598 0.0205 399 PHE B CE2 5064 C CZ . PHE D 33 ? 0.6905 0.6420 0.6397 0.1449 0.0485 0.0060 399 PHE B CZ 5065 N N . LYS D 34 ? 0.6272 0.6894 0.5209 0.1420 0.0341 -0.0310 400 LYS B N 5066 C CA . LYS D 34 ? 0.6149 0.6896 0.5291 0.1320 0.0295 -0.0238 400 LYS B CA 5067 C C . LYS D 34 ? 0.5989 0.6548 0.5247 0.1196 0.0279 -0.0279 400 LYS B C 5068 O O . LYS D 34 ? 0.6334 0.6729 0.5584 0.1116 0.0183 -0.0408 400 LYS B O 5069 C CB . LYS D 34 ? 0.6542 0.7532 0.5807 0.1252 0.0106 -0.0217 400 LYS B CB 5070 C CG . LYS D 34 ? 0.7921 0.9131 0.7116 0.1368 0.0111 -0.0135 400 LYS B CG 5071 C CD . LYS D 34 ? 0.8495 0.9886 0.7856 0.1283 -0.0159 -0.0109 400 LYS B CD 5072 C CE . LYS D 34 ? 0.8312 0.9883 0.7570 0.1403 -0.0181 -0.0043 400 LYS B CE 5073 N NZ . LYS D 34 ? 0.8565 1.0227 0.7977 0.1317 -0.0529 -0.0029 400 LYS B NZ 5074 N N . ARG D 35 ? 0.6293 0.6853 0.5607 0.1219 0.0366 -0.0173 401 ARG B N 5075 C CA . ARG D 35 ? 0.6233 0.6593 0.5600 0.1133 0.0362 -0.0188 401 ARG B CA 5076 C C . ARG D 35 ? 0.6133 0.6768 0.5720 0.1067 0.0347 -0.0027 401 ARG B C 5077 O O . ARG D 35 ? 0.6242 0.7132 0.5838 0.1204 0.0458 0.0144 401 ARG B O 5078 C CB . ARG D 35 ? 0.6522 0.6563 0.5699 0.1264 0.0442 -0.0184 401 ARG B CB 5079 C CG . ARG D 35 ? 0.6853 0.6659 0.5996 0.1226 0.0427 -0.0184 401 ARG B CG 5080 C CD . ARG D 35 ? 0.7388 0.6717 0.6344 0.1325 0.0384 -0.0235 401 ARG B CD 5081 N NE . ARG D 35 ? 0.7254 0.6399 0.6371 0.1211 0.0327 -0.0303 401 ARG B NE 5082 C CZ . ARG D 35 ? 0.7840 0.6598 0.6980 0.1236 0.0239 -0.0293 401 ARG B CZ 5083 N NH1 . ARG D 35 ? 0.8198 0.6598 0.7121 0.1376 0.0133 -0.0279 401 ARG B NH1 5084 N NH2 . ARG D 35 ? 0.8191 0.6907 0.7576 0.1150 0.0234 -0.0277 401 ARG B NH2 5085 N N . LEU D 36 ? 0.5651 0.6258 0.5450 0.0876 0.0211 -0.0047 402 LEU B N 5086 C CA . LEU D 36 ? 0.5311 0.6195 0.5423 0.0788 0.0195 0.0185 402 LEU B CA 5087 C C . LEU D 36 ? 0.5576 0.6217 0.5565 0.0800 0.0279 0.0197 402 LEU B C 5088 O O . LEU D 36 ? 0.4848 0.5119 0.4752 0.0706 0.0195 0.0008 402 LEU B O 5089 C CB . LEU D 36 ? 0.5030 0.6026 0.5540 0.0548 -0.0095 0.0206 402 LEU B CB 5090 C CG . LEU D 36 ? 0.5683 0.6841 0.6293 0.0532 -0.0280 0.0184 402 LEU B CG 5091 C CD1 . LEU D 36 ? 0.5827 0.6923 0.6785 0.0308 -0.0683 0.0166 402 LEU B CD1 5092 C CD2 . LEU D 36 ? 0.4723 0.6355 0.5531 0.0639 -0.0143 0.0474 402 LEU B CD2 5093 N N . VAL D 37 ? 0.5241 0.6094 0.5192 0.0956 0.0450 0.0433 403 VAL B N 5094 C CA . VAL D 37 ? 0.5467 0.6077 0.5205 0.1026 0.0523 0.0464 403 VAL B CA 5095 C C . VAL D 37 ? 0.5696 0.6708 0.5828 0.0927 0.0543 0.0797 403 VAL B C 5096 O O . VAL D 37 ? 0.7175 0.8722 0.7580 0.1011 0.0659 0.1119 403 VAL B O 5097 C CB . VAL D 37 ? 0.6151 0.6569 0.5354 0.1393 0.0696 0.0461 403 VAL B CB 5098 C CG1 . VAL D 37 ? 0.6082 0.6141 0.4955 0.1502 0.0712 0.0458 403 VAL B CG1 5099 C CG2 . VAL D 37 ? 0.6231 0.6287 0.5184 0.1462 0.0629 0.0209 403 VAL B CG2 5100 N N . PHE D 38 ? 0.5161 0.5949 0.5389 0.0748 0.0429 0.0766 404 PHE B N 5101 C CA . PHE D 38 ? 0.5204 0.6373 0.5904 0.0607 0.0406 0.1123 404 PHE B CA 5102 C C . PHE D 38 ? 0.6030 0.7039 0.6422 0.0753 0.0546 0.1239 404 PHE B C 5103 O O . PHE D 38 ? 0.6946 0.7411 0.7040 0.0704 0.0447 0.0971 404 PHE B O 5104 C CB . PHE D 38 ? 0.4876 0.5956 0.6075 0.0229 0.0062 0.1033 404 PHE B CB 5105 C CG . PHE D 38 ? 0.5202 0.6380 0.6632 0.0121 -0.0137 0.0918 404 PHE B CG 5106 C CD1 . PHE D 38 ? 0.5489 0.7191 0.7482 0.0034 -0.0233 0.1260 404 PHE B CD1 5107 C CD2 . PHE D 38 ? 0.5576 0.6335 0.6672 0.0130 -0.0237 0.0506 404 PHE B CD2 5108 C CE1 . PHE D 38 ? 0.5813 0.7528 0.7961 -0.0050 -0.0476 0.1136 404 PHE B CE1 5109 C CE2 . PHE D 38 ? 0.5823 0.6637 0.7015 0.0087 -0.0423 0.0395 404 PHE B CE2 5110 C CZ . PHE D 38 ? 0.5652 0.6899 0.7335 -0.0006 -0.0568 0.0682 404 PHE B CZ 5111 N N . THR D 39 ? 0.6172 0.7675 0.6636 0.0962 0.0783 0.1670 405 THR B N 5112 C CA . THR D 39 ? 0.6429 0.7870 0.6590 0.1146 0.0933 0.1864 405 THR B CA 5113 C C . THR D 39 ? 0.7099 0.9303 0.7924 0.1086 0.1050 0.2480 405 THR B C 5114 O O . THR D 39 ? 0.8073 1.0903 0.9371 0.1118 0.1152 0.2815 405 THR B O 5115 C CB . THR D 39 ? 0.6530 0.7719 0.5804 0.1681 0.1183 0.1787 405 THR B CB 5116 O OG1 . THR D 39 ? 0.6991 0.8754 0.6320 0.1970 0.1440 0.2070 405 THR B OG1 5117 C CG2 . THR D 39 ? 0.6249 0.6675 0.4991 0.1714 0.1006 0.1253 405 THR B CG2 5118 N N . ASN D 40 ? 0.6697 0.8870 0.7625 0.0991 0.1020 0.2672 406 ASN B N 5119 C CA . ASN D 40 ? 0.7192 1.0111 0.8829 0.0922 0.1125 0.3345 406 ASN B CA 5120 C C . ASN D 40 ? 0.6374 0.9774 0.9096 0.0496 0.0847 0.3601 406 ASN B C 5121 O O . ASN D 40 ? 0.6527 1.0684 0.9822 0.0571 0.1001 0.4134 406 ASN B O 5122 C CB . ASN D 40 ? 0.8419 1.1900 0.9723 0.1471 0.1606 0.3802 406 ASN B CB 5123 C CG . ASN D 40 ? 0.9731 1.2706 0.9932 0.1941 0.1817 0.3623 406 ASN B CG 5124 O OD1 . ASN D 40 ? 1.0357 1.3375 1.0486 0.1994 0.1887 0.3892 406 ASN B OD1 5125 N ND2 . ASN D 40 ? 0.9994 1.2443 0.9326 0.2292 0.1872 0.3176 406 ASN B ND2 5126 N N . CYS D 41 ? 0.5901 0.8833 0.8894 0.0080 0.0410 0.3228 407 CYS B N 5127 C CA . CYS D 41 ? 0.5108 0.8288 0.9026 -0.0316 0.0012 0.3381 407 CYS B CA 5128 C C . CYS D 41 ? 0.5787 0.8365 0.9870 -0.0692 -0.0459 0.3018 407 CYS B C 5129 O O . CYS D 41 ? 0.6006 0.7983 0.9471 -0.0644 -0.0443 0.2586 407 CYS B O 5130 C CB . CYS D 41 ? 0.5217 0.8425 0.9064 -0.0256 -0.0029 0.3150 407 CYS B CB 5131 S SG . CYS D 41 ? 0.5680 0.8017 0.8590 -0.0170 -0.0092 0.2303 407 CYS B SG 5132 N N . ASN D 42 ? 0.5875 0.8588 1.0810 -0.1048 -0.0915 0.3204 408 ASN B N 5133 C CA . ASN D 42 ? 0.5393 0.7500 1.0477 -0.1359 -0.1419 0.2849 408 ASN B CA 5134 C C . ASN D 42 ? 0.5664 0.7350 1.0624 -0.1432 -0.1787 0.2362 408 ASN B C 5135 O O . ASN D 42 ? 0.5393 0.7388 1.0784 -0.1486 -0.1960 0.2552 408 ASN B O 5136 C CB . ASN D 42 ? 0.5254 0.7666 1.1352 -0.1698 -0.1780 0.3394 408 ASN B CB 5137 C CG . ASN D 42 ? 0.5662 0.8470 1.1829 -0.1604 -0.1413 0.3889 408 ASN B CG 5138 O OD1 . ASN D 42 ? 0.6365 0.9926 1.3276 -0.1637 -0.1307 0.4625 408 ASN B OD1 5139 N ND2 . ASN D 42 ? 0.5547 0.7864 1.0947 -0.1465 -0.1218 0.3523 408 ASN B ND2 5140 N N . TYR D 43 ? 0.6076 0.7068 1.0442 -0.1403 -0.1900 0.1761 409 TYR B N 5141 C CA . TYR D 43 ? 0.6159 0.6730 1.0199 -0.1357 -0.2158 0.1271 409 TYR B CA 5142 C C . TYR D 43 ? 0.6988 0.7045 1.1290 -0.1573 -0.2781 0.1032 409 TYR B C 5143 O O . TYR D 43 ? 0.7329 0.7222 1.1936 -0.1755 -0.2979 0.1120 409 TYR B O 5144 C CB . TYR D 43 ? 0.5601 0.5805 0.8753 -0.1083 -0.1802 0.0794 409 TYR B CB 5145 C CG . TYR D 43 ? 0.6122 0.5849 0.8993 -0.1101 -0.1796 0.0530 409 TYR B CG 5146 C CD1 . TYR D 43 ? 0.6500 0.5682 0.9178 -0.1115 -0.2095 0.0099 409 TYR B CD1 5147 C CD2 . TYR D 43 ? 0.6484 0.6289 0.9244 -0.1062 -0.1496 0.0714 409 TYR B CD2 5148 C CE1 . TYR D 43 ? 0.6646 0.5431 0.9133 -0.1121 -0.2081 -0.0111 409 TYR B CE1 5149 C CE2 . TYR D 43 ? 0.6672 0.6029 0.9219 -0.1092 -0.1525 0.0488 409 TYR B CE2 5150 C CZ . TYR D 43 ? 0.6787 0.5663 0.9250 -0.1138 -0.1809 0.0090 409 TYR B CZ 5151 O OH . TYR D 43 ? 0.6722 0.5190 0.9038 -0.1159 -0.1828 -0.0104 409 TYR B OH 5152 N N . ASN D 44 ? 0.6999 0.6758 1.1121 -0.1518 -0.3111 0.0715 410 ASN B N 5153 C CA . ASN D 44 ? 0.7628 0.6758 1.1772 -0.1606 -0.3737 0.0378 410 ASN B CA 5154 C C . ASN D 44 ? 0.8246 0.6888 1.1519 -0.1291 -0.3712 -0.0214 410 ASN B C 5155 O O . ASN D 44 ? 0.8156 0.6728 1.1286 -0.1194 -0.3941 -0.0330 410 ASN B O 5156 C CB . ASN D 44 ? 0.8277 0.7469 1.3047 -0.1766 -0.4228 0.0707 410 ASN B CB 5157 C CG . ASN D 44 ? 0.9761 0.8216 1.4265 -0.1661 -0.4661 0.0435 410 ASN B CG 5158 O OD1 . ASN D 44 ? 0.9895 0.7854 1.3743 -0.1446 -0.4638 -0.0046 410 ASN B OD1 5159 N ND2 . ASN D 44 ? 1.1908 1.0307 1.6962 -0.1788 -0.5061 0.0786 410 ASN B ND2 5160 N N . LEU D 45 ? 0.6656 0.6520 0.8471 -0.0570 -0.1937 -0.0039 411 LEU B N 5161 C CA . LEU D 45 ? 0.6417 0.6276 0.7839 -0.0451 -0.1976 -0.0283 411 LEU B CA 5162 C C . LEU D 45 ? 0.6927 0.6279 0.7950 -0.0496 -0.2294 -0.0452 411 LEU B C 5163 O O . LEU D 45 ? 0.6774 0.6098 0.7553 -0.0464 -0.2407 -0.0574 411 LEU B O 5164 C CB . LEU D 45 ? 0.6931 0.6881 0.8066 -0.0207 -0.1749 -0.0435 411 LEU B CB 5165 C CG . LEU D 45 ? 0.7853 0.7931 0.8687 -0.0074 -0.1711 -0.0616 411 LEU B CG 5166 C CD1 . LEU D 45 ? 0.7844 0.8201 0.8874 -0.0177 -0.1687 -0.0539 411 LEU B CD1 5167 C CD2 . LEU D 45 ? 0.7886 0.8210 0.8614 0.0099 -0.1496 -0.0685 411 LEU B CD2 5168 N N . THR D 46 ? 0.7574 0.6445 0.8456 -0.0554 -0.2435 -0.0454 412 THR B N 5169 C CA . THR D 46 ? 0.7640 0.5828 0.8007 -0.0603 -0.2765 -0.0616 412 THR B CA 5170 C C . THR D 46 ? 0.8445 0.6624 0.9002 -0.0895 -0.3101 -0.0544 412 THR B C 5171 O O . THR D 46 ? 0.9164 0.6914 0.9192 -0.0866 -0.3357 -0.0730 412 THR B O 5172 C CB . THR D 46 ? 0.7727 0.5330 0.7937 -0.0667 -0.2856 -0.0585 412 THR B CB 5173 O OG1 . THR D 46 ? 0.8420 0.6138 0.8539 -0.0389 -0.2536 -0.0604 412 THR B OG1 5174 C CG2 . THR D 46 ? 0.8318 0.5025 0.7750 -0.0642 -0.3171 -0.0802 412 THR B CG2 5175 N N . LYS D 47 ? 0.8401 0.7064 0.9691 -0.1144 -0.3098 -0.0250 413 LYS B N 5176 C CA . LYS D 47 ? 0.8648 0.7475 1.0263 -0.1432 -0.3420 -0.0110 413 LYS B CA 5177 C C . LYS D 47 ? 0.8405 0.7568 0.9881 -0.1276 -0.3369 -0.0209 413 LYS B C 5178 O O . LYS D 47 ? 0.8807 0.7778 1.0053 -0.1373 -0.3702 -0.0289 413 LYS B O 5179 C CB . LYS D 47 ? 0.8525 0.7920 1.1030 -0.1671 -0.3351 0.0303 413 LYS B CB 5180 C CG . LYS D 47 ? 0.9565 0.9220 1.2525 -0.2000 -0.3713 0.0522 413 LYS B CG 5181 C CD . LYS D 47 ? 0.9576 0.9839 1.3425 -0.2167 -0.3555 0.0996 413 LYS B CD 5182 C CE . LYS D 47 ? 1.0163 1.0760 1.4345 -0.2356 -0.3738 0.1244 413 LYS B CE 5183 N NZ . LYS D 47 ? 1.0390 1.1621 1.5424 -0.2459 -0.3545 0.1749 413 LYS B NZ 5184 N N . LEU D 48 ? 0.8149 0.7758 0.9717 -0.1038 -0.2964 -0.0201 414 LEU B N 5185 C CA . LEU D 48 ? 0.7976 0.7880 0.9404 -0.0881 -0.2850 -0.0273 414 LEU B CA 5186 C C . LEU D 48 ? 0.8201 0.7632 0.8881 -0.0693 -0.2973 -0.0582 414 LEU B C 5187 O O . LEU D 48 ? 0.8403 0.7815 0.8872 -0.0669 -0.3130 -0.0637 414 LEU B O 5188 C CB . LEU D 48 ? 0.7541 0.7865 0.9123 -0.0697 -0.2408 -0.0220 414 LEU B CB 5189 C CG . LEU D 48 ? 0.7426 0.8007 0.8854 -0.0550 -0.2245 -0.0273 414 LEU B CG 5190 C CD1 . LEU D 48 ? 0.7275 0.8133 0.9001 -0.0664 -0.2392 -0.0083 414 LEU B CD1 5191 C CD2 . LEU D 48 ? 0.6930 0.7784 0.8441 -0.0427 -0.1856 -0.0228 414 LEU B CD2 5192 N N . LEU D 49 ? 0.7878 0.6933 0.8130 -0.0515 -0.2881 -0.0756 415 LEU B N 5193 C CA . LEU D 49 ? 0.8127 0.6721 0.7623 -0.0254 -0.2932 -0.1006 415 LEU B CA 5194 C C . LEU D 49 ? 0.9046 0.6918 0.8038 -0.0359 -0.3386 -0.1120 415 LEU B C 5195 O O . LEU D 49 ? 1.0218 0.7691 0.8537 -0.0144 -0.3484 -0.1297 415 LEU B O 5196 C CB . LEU D 49 ? 0.8453 0.6891 0.7661 -0.0003 -0.2700 -0.1106 415 LEU B CB 5197 C CG . LEU D 49 ? 0.8073 0.7156 0.7675 0.0093 -0.2311 -0.1024 415 LEU B CG 5198 C CD1 . LEU D 49 ? 0.8500 0.7480 0.7786 0.0367 -0.2135 -0.1115 415 LEU B CD1 5199 C CD2 . LEU D 49 ? 0.7585 0.7103 0.7268 0.0155 -0.2146 -0.1011 415 LEU B CD2 5200 N N . SER D 50 ? 0.8862 0.6531 0.8149 -0.0691 -0.3669 -0.1003 416 SER B N 5201 C CA . SER D 50 ? 0.9588 0.6518 0.8416 -0.0876 -0.4148 -0.1089 416 SER B CA 5202 C C . SER D 50 ? 0.9681 0.6848 0.8573 -0.0949 -0.4292 -0.1022 416 SER B C 5203 O O . SER D 50 ? 1.0473 0.7046 0.8744 -0.0908 -0.4524 -0.1136 416 SER B O 5204 C CB . SER D 50 ? 1.0394 0.7194 0.9674 -0.1240 -0.4304 -0.0885 416 SER B CB 5205 O OG . SER D 50 ? 1.1637 0.8147 1.0799 -0.1146 -0.4155 -0.0941 416 SER B OG 5206 N N . LEU D 51 ? 0.9246 0.7244 0.8844 -0.1032 -0.4153 -0.0828 417 LEU B N 5207 C CA . LEU D 51 ? 0.9110 0.7408 0.8831 -0.1093 -0.4279 -0.0733 417 LEU B CA 5208 C C . LEU D 51 ? 0.9026 0.7209 0.8119 -0.0745 -0.4193 -0.0945 417 LEU B C 5209 O O . LEU D 51 ? 0.9046 0.7309 0.8021 -0.0727 -0.4324 -0.0924 417 LEU B O 5210 C CB . LEU D 51 ? 0.8121 0.7322 0.8781 -0.1256 -0.4132 -0.0407 417 LEU B CB 5211 C CG . LEU D 51 ? 0.8837 0.8279 1.0140 -0.1609 -0.4304 -0.0100 417 LEU B CG 5212 C CD1 . LEU D 51 ? 0.9389 0.8530 1.0406 -0.1747 -0.4681 -0.0124 417 LEU B CD1 5213 C CD2 . LEU D 51 ? 0.9616 0.8736 1.1053 -0.1775 -0.4317 -0.0052 417 LEU B CD2 5214 N N . PHE D 52 ? 0.9141 0.7158 0.7827 -0.0449 -0.3965 -0.1133 418 PHE B N 5215 C CA . PHE D 52 ? 0.9107 0.7087 0.7247 -0.0074 -0.3746 -0.1271 418 PHE B CA 5216 C C . PHE D 52 ? 0.9755 0.6971 0.6964 0.0254 -0.3742 -0.1511 418 PHE B C 5217 O O . PHE D 52 ? 0.9952 0.6715 0.6958 0.0230 -0.3813 -0.1578 418 PHE B O 5218 C CB . PHE D 52 ? 0.8057 0.6765 0.6677 0.0052 -0.3224 -0.1153 418 PHE B CB 5219 C CG . PHE D 52 ? 0.7943 0.7303 0.7250 -0.0135 -0.3159 -0.0921 418 PHE B CG 5220 C CD1 . PHE D 52 ? 0.7103 0.6855 0.7117 -0.0374 -0.3096 -0.0713 418 PHE B CD1 5221 C CD2 . PHE D 52 ? 0.8251 0.7801 0.7441 -0.0021 -0.3135 -0.0888 418 PHE B CD2 5222 C CE1 . PHE D 52 ? 0.6505 0.6828 0.7082 -0.0473 -0.2995 -0.0465 418 PHE B CE1 5223 C CE2 . PHE D 52 ? 0.7430 0.7550 0.7189 -0.0135 -0.3047 -0.0652 418 PHE B CE2 5224 C CZ . PHE D 52 ? 0.6620 0.7125 0.7064 -0.0350 -0.2972 -0.0435 418 PHE B CZ 5225 N N . SER D 53 ? 0.9732 0.6790 0.6340 0.0600 -0.3632 -0.1614 419 SER B N 5226 C CA . SER D 53 ? 1.0387 0.6823 0.6098 0.1027 -0.3512 -0.1785 419 SER B CA 5227 C C . SER D 53 ? 0.9846 0.6903 0.5830 0.1298 -0.2947 -0.1700 419 SER B C 5228 O O . SER D 53 ? 0.9702 0.7057 0.5600 0.1524 -0.2695 -0.1658 419 SER B O 5229 C CB . SER D 53 ? 1.1228 0.7105 0.6139 0.1275 -0.3659 -0.1875 419 SER B CB 5230 O OG . SER D 53 ? 1.2451 0.7704 0.6488 0.1743 -0.3487 -0.1981 419 SER B OG 5231 N N . VAL D 54 ? 0.9599 0.6855 0.5926 0.1256 -0.2768 -0.1657 420 VAL B N 5232 C CA . VAL D 54 ? 0.8705 0.6639 0.5426 0.1416 -0.2302 -0.1550 420 VAL B CA 5233 C C . VAL D 54 ? 0.9769 0.7536 0.5847 0.1917 -0.2045 -0.1581 420 VAL B C 5234 O O . VAL D 54 ? 1.0381 0.7544 0.5806 0.2195 -0.2095 -0.1670 420 VAL B O 5235 C CB . VAL D 54 ? 0.7973 0.6115 0.5148 0.1270 -0.2224 -0.1498 420 VAL B CB 5236 C CG1 . VAL D 54 ? 0.7389 0.6246 0.4964 0.1401 -0.1810 -0.1387 420 VAL B CG1 5237 C CG2 . VAL D 54 ? 0.7189 0.5539 0.5020 0.0825 -0.2412 -0.1412 420 VAL B CG2 5238 N N . ASN D 55 ? 0.9538 0.7832 0.5794 0.2049 -0.1742 -0.1475 421 ASN B N 5239 C CA . ASN D 55 ? 0.9391 0.7667 0.5145 0.2537 -0.1440 -0.1428 421 ASN B CA 5240 C C . ASN D 55 ? 0.8698 0.7729 0.4987 0.2619 -0.1056 -0.1257 421 ASN B C 5241 O O . ASN D 55 ? 0.8703 0.7778 0.4649 0.3047 -0.0801 -0.1171 421 ASN B O 5242 C CB . ASN D 55 ? 0.9250 0.7613 0.4825 0.2660 -0.1333 -0.1380 421 ASN B CB 5243 C CG . ASN D 55 ? 1.0377 0.8028 0.5379 0.2610 -0.1748 -0.1538 421 ASN B CG 5244 O OD1 . ASN D 55 ? 1.0357 0.8235 0.5672 0.2371 -0.1846 -0.1508 421 ASN B OD1 5245 N ND2 . ASN D 55 ? 1.1340 0.8092 0.5457 0.2843 -0.2010 -0.1700 421 ASN B ND2 5246 N N . ASP D 56 ? 0.8108 0.7732 0.5216 0.2223 -0.1024 -0.1188 422 ASP B N 5247 C CA . ASP D 56 ? 0.7950 0.8305 0.5604 0.2219 -0.0740 -0.1032 422 ASP B CA 5248 C C . ASP D 56 ? 0.7220 0.7870 0.5514 0.1805 -0.0841 -0.1033 422 ASP B C 5249 O O . ASP D 56 ? 0.6419 0.7110 0.5022 0.1476 -0.0944 -0.1046 422 ASP B O 5250 C CB . ASP D 56 ? 0.8593 0.9552 0.6545 0.2247 -0.0430 -0.0857 422 ASP B CB 5251 C CG . ASP D 56 ? 0.9138 1.0852 0.7572 0.2297 -0.0162 -0.0661 422 ASP B CG 5252 O OD1 . ASP D 56 ? 0.8396 1.0587 0.7459 0.1929 -0.0162 -0.0609 422 ASP B OD1 5253 O OD2 . ASP D 56 ? 1.0070 1.1896 0.8230 0.2720 0.0042 -0.0542 422 ASP B OD2 5254 N N . PHE D 57 ? 0.7397 0.8238 0.5838 0.1872 -0.0792 -0.1000 423 PHE B N 5255 C CA . PHE D 57 ? 0.6748 0.7816 0.5692 0.1555 -0.0869 -0.0994 423 PHE B CA 5256 C C . PHE D 57 ? 0.7030 0.8775 0.6350 0.1615 -0.0672 -0.0857 423 PHE B C 5257 O O . PHE D 57 ? 0.7406 0.9147 0.6566 0.1870 -0.0645 -0.0839 423 PHE B O 5258 C CB . PHE D 57 ? 0.6781 0.7231 0.5449 0.1550 -0.1109 -0.1110 423 PHE B CB 5259 C CG . PHE D 57 ? 0.6983 0.7531 0.6117 0.1209 -0.1206 -0.1093 423 PHE B CG 5260 C CD1 . PHE D 57 ? 0.7432 0.8544 0.7086 0.0992 -0.1079 -0.1001 423 PHE B CD1 5261 C CD2 . PHE D 57 ? 0.6945 0.6961 0.5946 0.1115 -0.1423 -0.1154 423 PHE B CD2 5262 C CE1 . PHE D 57 ? 0.6517 0.7636 0.6481 0.0752 -0.1140 -0.0972 423 PHE B CE1 5263 C CE2 . PHE D 57 ? 0.6452 0.6571 0.5875 0.0853 -0.1465 -0.1092 423 PHE B CE2 5264 C CZ . PHE D 57 ? 0.5892 0.6552 0.5764 0.0704 -0.1311 -0.1003 423 PHE B CZ 5265 N N . THR D 58 ? 0.6692 0.8998 0.6486 0.1375 -0.0551 -0.0752 424 THR B N 5266 C CA . THR D 58 ? 0.6248 0.9257 0.6468 0.1344 -0.0425 -0.0603 424 THR B CA 5267 C C . THR D 58 ? 0.6041 0.9207 0.6654 0.0946 -0.0524 -0.0617 424 THR B C 5268 O O . THR D 58 ? 0.6191 0.9104 0.6835 0.0691 -0.0576 -0.0672 424 THR B O 5269 C CB . THR D 58 ? 0.6275 0.9823 0.6686 0.1399 -0.0198 -0.0423 424 THR B CB 5270 O OG1 . THR D 58 ? 0.6624 1.0911 0.7568 0.1236 -0.0142 -0.0259 424 THR B OG1 5271 C CG2 . THR D 58 ? 0.6614 0.9988 0.7041 0.1154 -0.0171 -0.0447 424 THR B CG2 5272 N N . CYS D 59 ? 0.5697 0.9252 0.6550 0.0935 -0.0547 -0.0556 425 CYS B N 5273 C CA . CYS D 59 ? 0.4824 0.8430 0.5916 0.0613 -0.0658 -0.0579 425 CYS B CA 5274 C C . CYS D 59 ? 0.5097 0.9397 0.6577 0.0468 -0.0649 -0.0440 425 CYS B C 5275 O O . CYS D 59 ? 0.5340 1.0190 0.6990 0.0661 -0.0554 -0.0294 425 CYS B O 5276 C CB . CYS D 59 ? 0.4199 0.7428 0.5122 0.0704 -0.0781 -0.0669 425 CYS B CB 5277 S SG . CYS D 59 ? 0.6002 0.8439 0.6584 0.0745 -0.0866 -0.0795 425 CYS B SG 5278 N N . SER D 60 ? 0.4574 0.8833 0.6170 0.0133 -0.0758 -0.0467 426 SER B N 5279 C CA . SER D 60 ? 0.3549 0.8377 0.5476 -0.0093 -0.0838 -0.0354 426 SER B CA 5280 C C . SER D 60 ? 0.3506 0.8172 0.5340 -0.0173 -0.1025 -0.0428 426 SER B C 5281 O O . SER D 60 ? 0.4145 0.8224 0.5717 -0.0298 -0.1071 -0.0540 426 SER B O 5282 C CB . SER D 60 ? 0.3627 0.8466 0.5669 -0.0468 -0.0811 -0.0306 426 SER B CB 5283 O OG . SER D 60 ? 0.4500 0.9815 0.6842 -0.0767 -0.0953 -0.0201 426 SER B OG 5284 N N . GLN D 61 ? 0.3800 0.9003 0.5831 -0.0054 -0.1111 -0.0340 427 GLN B N 5285 C CA . GLN D 61 ? 0.4128 0.9238 0.6044 -0.0071 -0.1295 -0.0393 427 GLN B CA 5286 C C . GLN D 61 ? 0.4280 0.8733 0.5819 0.0183 -0.1256 -0.0519 427 GLN B C 5287 O O . GLN D 61 ? 0.4700 0.8840 0.6035 0.0158 -0.1361 -0.0578 427 GLN B O 5288 C CB . GLN D 61 ? 0.4467 0.9361 0.6306 -0.0493 -0.1466 -0.0439 427 GLN B CB 5289 C CG . GLN D 61 ? 0.5068 1.0546 0.7288 -0.0834 -0.1544 -0.0302 427 GLN B CG 5290 C CD . GLN D 61 ? 0.6740 1.1808 0.8734 -0.1269 -0.1743 -0.0372 427 GLN B CD 5291 O OE1 . GLN D 61 ? 0.8369 1.3622 1.0369 -0.1441 -0.2009 -0.0358 427 GLN B OE1 5292 N NE2 . GLN D 61 ? 0.6256 1.0709 0.7978 -0.1431 -0.1627 -0.0445 427 GLN B NE2 5293 N N . ILE D 62 ? 0.4317 0.8536 0.5743 0.0423 -0.1111 -0.0544 428 ILE B N 5294 C CA . ILE D 62 ? 0.4117 0.7739 0.5241 0.0632 -0.1089 -0.0629 428 ILE B CA 5295 C C . ILE D 62 ? 0.4140 0.7649 0.5127 0.0913 -0.0981 -0.0632 428 ILE B C 5296 O O . ILE D 62 ? 0.4136 0.7979 0.5233 0.0951 -0.0895 -0.0571 428 ILE B O 5297 C CB . ILE D 62 ? 0.4302 0.7324 0.5281 0.0425 -0.1093 -0.0702 428 ILE B CB 5298 C CG1 . ILE D 62 ? 0.4214 0.6751 0.4988 0.0579 -0.1102 -0.0725 428 ILE B CG1 5299 C CG2 . ILE D 62 ? 0.4082 0.6917 0.5059 0.0350 -0.1011 -0.0725 428 ILE B CG2 5300 C CD1 . ILE D 62 ? 0.3612 0.5683 0.4307 0.0419 -0.1078 -0.0721 428 ILE B CD1 5301 N N . SER D 63 ? 0.4624 0.7612 0.5321 0.1116 -0.0986 -0.0692 429 SER B N 5302 C CA . SER D 63 ? 0.4737 0.7417 0.5139 0.1383 -0.0928 -0.0722 429 SER B CA 5303 C C . SER D 63 ? 0.5334 0.7320 0.5547 0.1248 -0.0995 -0.0818 429 SER B C 5304 O O . SER D 63 ? 0.5644 0.7401 0.5961 0.1041 -0.1051 -0.0825 429 SER B O 5305 C CB . SER D 63 ? 0.4927 0.7530 0.5062 0.1767 -0.0899 -0.0690 429 SER B CB 5306 O OG . SER D 63 ? 0.5368 0.7450 0.5340 0.1752 -0.0968 -0.0739 429 SER B OG 5307 N N . PRO D 64 ? 0.5670 0.7335 0.5597 0.1377 -0.0994 -0.0870 430 PRO B N 5308 C CA . PRO D 64 ? 0.5884 0.6908 0.5626 0.1243 -0.1121 -0.0949 430 PRO B CA 5309 C C . PRO D 64 ? 0.6245 0.6764 0.5863 0.1238 -0.1216 -0.0958 430 PRO B C 5310 O O . PRO D 64 ? 0.5938 0.6156 0.5681 0.0998 -0.1317 -0.0946 430 PRO B O 5311 C CB . PRO D 64 ? 0.6373 0.7098 0.5664 0.1490 -0.1123 -0.1010 430 PRO B CB 5312 C CG . PRO D 64 ? 0.5870 0.7254 0.5312 0.1637 -0.0942 -0.0924 430 PRO B CG 5313 C CD . PRO D 64 ? 0.5852 0.7789 0.5633 0.1639 -0.0878 -0.0830 430 PRO B CD 5314 N N . ALA D 65 ? 0.6533 0.6992 0.5928 0.1513 -0.1167 -0.0945 431 ALA B N 5315 C CA . ALA D 65 ? 0.6638 0.6603 0.5894 0.1528 -0.1222 -0.0931 431 ALA B CA 5316 C C . ALA D 65 ? 0.6759 0.6990 0.6425 0.1320 -0.1191 -0.0845 431 ALA B C 5317 O O . ALA D 65 ? 0.6799 0.6663 0.6548 0.1157 -0.1240 -0.0792 431 ALA B O 5318 C CB . ALA D 65 ? 0.6326 0.6158 0.5181 0.1932 -0.1144 -0.0924 431 ALA B CB 5319 N N . ALA D 66 ? 0.6189 0.7039 0.6088 0.1326 -0.1114 -0.0811 432 ALA B N 5320 C CA . ALA D 66 ? 0.5865 0.6879 0.5995 0.1180 -0.1093 -0.0746 432 ALA B CA 5321 C C . ALA D 66 ? 0.5473 0.6413 0.5830 0.0878 -0.1100 -0.0715 432 ALA B C 5322 O O . ALA D 66 ? 0.5752 0.6503 0.6188 0.0797 -0.1069 -0.0629 432 ALA B O 5323 C CB . ALA D 66 ? 0.5459 0.7094 0.5708 0.1234 -0.1073 -0.0729 432 ALA B CB 5324 N N . ILE D 67 ? 0.5140 0.6230 0.5576 0.0757 -0.1114 -0.0758 433 ILE B N 5325 C CA . ILE D 67 ? 0.4822 0.5896 0.5446 0.0516 -0.1098 -0.0713 433 ILE B CA 5326 C C . ILE D 67 ? 0.5018 0.5689 0.5718 0.0423 -0.1148 -0.0631 433 ILE B C 5327 O O . ILE D 67 ? 0.5628 0.6291 0.6515 0.0285 -0.1097 -0.0517 433 ILE B O 5328 C CB . ILE D 67 ? 0.5167 0.6457 0.5820 0.0440 -0.1092 -0.0766 433 ILE B CB 5329 C CG1 . ILE D 67 ? 0.4573 0.5894 0.5371 0.0230 -0.1037 -0.0705 433 ILE B CG1 5330 C CG2 . ILE D 67 ? 0.5139 0.6144 0.5621 0.0513 -0.1182 -0.0825 433 ILE B CG2 5331 C CD1 . ILE D 67 ? 0.5152 0.6604 0.5958 0.0157 -0.0968 -0.0670 433 ILE B CD1 5332 N N . ALA D 68 ? 0.4880 0.5202 0.5422 0.0504 -0.1247 -0.0663 434 ALA B N 5333 C CA . ALA D 68 ? 0.5412 0.5365 0.6073 0.0353 -0.1349 -0.0564 434 ALA B CA 5334 C C . ALA D 68 ? 0.5820 0.5498 0.6491 0.0406 -0.1311 -0.0452 434 ALA B C 5335 O O . ALA D 68 ? 0.6283 0.5603 0.7033 0.0279 -0.1415 -0.0359 434 ALA B O 5336 C CB . ALA D 68 ? 0.5583 0.5182 0.5992 0.0341 -0.1540 -0.0674 434 ALA B CB 5337 N N . SER D 69 ? 0.5127 0.4962 0.5716 0.0579 -0.1177 -0.0446 435 SER B N 5338 C CA . SER D 69 ? 0.5335 0.4888 0.5872 0.0683 -0.1112 -0.0332 435 SER B CA 5339 C C . SER D 69 ? 0.5247 0.5013 0.5794 0.0800 -0.0954 -0.0253 435 SER B C 5340 O O . SER D 69 ? 0.6212 0.5778 0.6626 0.0964 -0.0879 -0.0178 435 SER B O 5341 C CB . SER D 69 ? 0.6252 0.5497 0.6397 0.0906 -0.1161 -0.0441 435 SER B CB 5342 O OG . SER D 69 ? 0.6799 0.6418 0.6763 0.1115 -0.1127 -0.0568 435 SER B OG 5343 N N . ASN D 70 ? 0.4653 0.4742 0.5282 0.0725 -0.0910 -0.0270 436 ASN B N 5344 C CA . ASN D 70 ? 0.4773 0.4948 0.5270 0.0830 -0.0806 -0.0225 436 ASN B CA 5345 C C . ASN D 70 ? 0.4844 0.4943 0.5449 0.0750 -0.0675 -0.0053 436 ASN B C 5346 O O . ASN D 70 ? 0.4485 0.4626 0.5335 0.0588 -0.0670 0.0022 436 ASN B O 5347 C CB . ASN D 70 ? 0.4854 0.5395 0.5215 0.0841 -0.0880 -0.0390 436 ASN B CB 5348 C CG . ASN D 70 ? 0.5681 0.6368 0.5888 0.1046 -0.0946 -0.0476 436 ASN B CG 5349 O OD1 . ASN D 70 ? 0.6473 0.7205 0.6502 0.1204 -0.0944 -0.0463 436 ASN B OD1 5350 N ND2 . ASN D 70 ? 0.5971 0.6711 0.6194 0.1085 -0.0999 -0.0551 436 ASN B ND2 5351 N N . CYS D 71 ? 0.5362 0.5328 0.5729 0.0905 -0.0562 0.0026 437 CYS B N 5352 C CA . CYS D 71 ? 0.5402 0.5216 0.5720 0.0927 -0.0391 0.0209 437 CYS B CA 5353 C C . CYS D 71 ? 0.5562 0.5394 0.5547 0.0886 -0.0422 0.0077 437 CYS B C 5354 O O . CYS D 71 ? 0.5285 0.5167 0.4988 0.0921 -0.0545 -0.0087 437 CYS B O 5355 C CB . CYS D 71 ? 0.5352 0.4867 0.5500 0.1172 -0.0215 0.0415 437 CYS B CB 5356 S SG . CYS D 71 ? 0.6584 0.5990 0.7142 0.1172 -0.0146 0.0646 437 CYS B SG 5357 N N . TYR D 72 ? 0.5662 0.5444 0.5675 0.0805 -0.0322 0.0168 438 TYR B N 5358 C CA . TYR D 72 ? 0.6106 0.5780 0.5750 0.0733 -0.0346 0.0053 438 TYR B CA 5359 C C . TYR D 72 ? 0.6465 0.5729 0.5767 0.0897 -0.0117 0.0256 438 TYR B C 5360 O O . TYR D 72 ? 0.6666 0.5895 0.6187 0.1038 0.0080 0.0524 438 TYR B O 5361 C CB . TYR D 72 ? 0.5707 0.5668 0.5601 0.0496 -0.0436 -0.0060 438 TYR B CB 5362 C CG . TYR D 72 ? 0.5607 0.5921 0.5879 0.0411 -0.0582 -0.0167 438 TYR B CG 5363 C CD1 . TYR D 72 ? 0.5944 0.6479 0.6161 0.0401 -0.0734 -0.0342 438 TYR B CD1 5364 C CD2 . TYR D 72 ? 0.4936 0.5340 0.5575 0.0358 -0.0577 -0.0075 438 TYR B CD2 5365 C CE1 . TYR D 72 ? 0.5414 0.6188 0.5859 0.0401 -0.0828 -0.0419 438 TYR B CE1 5366 C CE2 . TYR D 72 ? 0.4915 0.5478 0.5734 0.0312 -0.0722 -0.0187 438 TYR B CE2 5367 C CZ . TYR D 72 ? 0.5306 0.6021 0.5989 0.0364 -0.0822 -0.0358 438 TYR B CZ 5368 O OH . TYR D 72 ? 0.5538 0.6334 0.6288 0.0392 -0.0926 -0.0451 438 TYR B OH 5369 N N . SER D 73 ? 0.6890 0.5822 0.5633 0.0883 -0.0140 0.0150 439 SER B N 5370 C CA . SER D 73 ? 0.7652 0.6078 0.5914 0.1078 0.0096 0.0330 439 SER B CA 5371 C C . SER D 73 ? 0.7334 0.5927 0.5906 0.1000 0.0229 0.0462 439 SER B C 5372 O O . SER D 73 ? 0.7636 0.6102 0.6206 0.1218 0.0494 0.0753 439 SER B O 5373 C CB . SER D 73 ? 0.8700 0.6574 0.6146 0.1059 -0.0015 0.0150 439 SER B CB 5374 O OG . SER D 73 ? 0.9960 0.7211 0.6796 0.1290 0.0232 0.0319 439 SER B OG 5375 N N . SER D 74 ? 0.6233 0.5146 0.5074 0.0718 0.0058 0.0275 440 SER B N 5376 C CA . SER D 74 ? 0.6222 0.5357 0.5389 0.0641 0.0145 0.0377 440 SER B CA 5377 C C . SER D 74 ? 0.5478 0.5090 0.5100 0.0378 -0.0070 0.0184 440 SER B C 5378 O O . SER D 74 ? 0.5121 0.4840 0.4687 0.0241 -0.0256 -0.0039 440 SER B O 5379 C CB . SER D 74 ? 0.7517 0.6183 0.6103 0.0683 0.0284 0.0397 440 SER B CB 5380 O OG . SER D 74 ? 0.8540 0.7017 0.6760 0.0454 0.0094 0.0123 440 SER B OG 5381 N N . LEU D 75 ? 0.5255 0.5164 0.5311 0.0335 -0.0046 0.0294 441 LEU B N 5382 C CA . LEU D 75 ? 0.5343 0.5609 0.5719 0.0146 -0.0227 0.0128 441 LEU B CA 5383 C C . LEU D 75 ? 0.5525 0.5840 0.5912 0.0097 -0.0155 0.0178 441 LEU B C 5384 O O . LEU D 75 ? 0.6436 0.6812 0.7005 0.0192 -0.0042 0.0407 441 LEU B O 5385 C CB . LEU D 75 ? 0.5259 0.5785 0.6101 0.0132 -0.0349 0.0172 441 LEU B CB 5386 C CG . LEU D 75 ? 0.4757 0.5522 0.5780 0.0002 -0.0547 -0.0014 441 LEU B CG 5387 C CD1 . LEU D 75 ? 0.4604 0.5388 0.5756 0.0026 -0.0684 -0.0078 441 LEU B CD1 5388 C CD2 . LEU D 75 ? 0.4246 0.5157 0.5515 -0.0058 -0.0585 0.0078 441 LEU B CD2 5389 N N . ILE D 76 ? 0.5732 0.6060 0.5951 -0.0042 -0.0214 -0.0006 442 ILE B N 5390 C CA . ILE D 76 ? 0.5387 0.5711 0.5541 -0.0076 -0.0132 0.0027 442 ILE B CA 5391 C C . ILE D 76 ? 0.5066 0.5757 0.5554 -0.0155 -0.0280 -0.0066 442 ILE B C 5392 O O . ILE D 76 ? 0.5001 0.5859 0.5562 -0.0230 -0.0414 -0.0233 442 ILE B O 5393 C CB . ILE D 76 ? 0.6231 0.6226 0.5905 -0.0184 -0.0069 -0.0082 442 ILE B CB 5394 C CG1 . ILE D 76 ? 0.7029 0.6469 0.6185 -0.0041 0.0128 0.0056 442 ILE B CG1 5395 C CG2 . ILE D 76 ? 0.5844 0.5945 0.5534 -0.0274 -0.0039 -0.0120 442 ILE B CG2 5396 C CD1 . ILE D 76 ? 0.7688 0.6900 0.6661 0.0081 0.0127 0.0092 442 ILE B CD1 5397 N N . LEU D 77 ? 0.5059 0.5865 0.5710 -0.0103 -0.0256 0.0062 443 LEU B N 5398 C CA . LEU D 77 ? 0.4841 0.5886 0.5683 -0.0146 -0.0413 -0.0024 443 LEU B CA 5399 C C . LEU D 77 ? 0.4716 0.5747 0.5402 -0.0117 -0.0312 0.0016 443 LEU B C 5400 O O . LEU D 77 ? 0.4776 0.5824 0.5512 -0.0024 -0.0226 0.0212 443 LEU B O 5401 C CB . LEU D 77 ? 0.4778 0.5985 0.5990 -0.0136 -0.0582 0.0085 443 LEU B CB 5402 C CG . LEU D 77 ? 0.5403 0.6733 0.6700 -0.0166 -0.0791 0.0010 443 LEU B CG 5403 C CD1 . LEU D 77 ? 0.4758 0.6038 0.5856 -0.0172 -0.0886 -0.0239 443 LEU B CD1 5404 C CD2 . LEU D 77 ? 0.6125 0.7555 0.7781 -0.0225 -0.1003 0.0147 443 LEU B CD2 5405 N N . ASP D 78 ? 0.4674 0.5706 0.5184 -0.0177 -0.0303 -0.0138 444 ASP B N 5406 C CA . ASP D 78 ? 0.5041 0.6040 0.5375 -0.0136 -0.0199 -0.0108 444 ASP B CA 5407 C C . ASP D 78 ? 0.5431 0.6626 0.5878 -0.0077 -0.0373 -0.0171 444 ASP B C 5408 O O . ASP D 78 ? 0.5354 0.6635 0.5848 -0.0090 -0.0510 -0.0312 444 ASP B O 5409 C CB . ASP D 78 ? 0.4778 0.5630 0.4841 -0.0246 -0.0060 -0.0194 444 ASP B CB 5410 C CG . ASP D 78 ? 0.5490 0.5999 0.5294 -0.0326 0.0062 -0.0157 444 ASP B CG 5411 O OD1 . ASP D 78 ? 0.5506 0.5819 0.5218 -0.0208 0.0146 -0.0017 444 ASP B OD1 5412 O OD2 . ASP D 78 ? 0.5893 0.6318 0.5565 -0.0498 0.0066 -0.0249 444 ASP B OD2 5413 N N . TYR D 79 ? 0.5382 0.6611 0.5810 0.0020 -0.0373 -0.0059 445 TYR B N 5414 C CA . TYR D 79 ? 0.5677 0.6996 0.6082 0.0091 -0.0566 -0.0129 445 TYR B CA 5415 C C . TYR D 79 ? 0.5499 0.6776 0.5651 0.0213 -0.0433 -0.0065 445 TYR B C 5416 O O . TYR D 79 ? 0.4967 0.6181 0.5044 0.0260 -0.0232 0.0091 445 TYR B O 5417 C CB . TYR D 79 ? 0.5594 0.7035 0.6291 0.0067 -0.0849 -0.0053 445 TYR B CB 5418 C CG . TYR D 79 ? 0.5121 0.6736 0.6037 0.0110 -0.0814 0.0211 445 TYR B CG 5419 C CD1 . TYR D 79 ? 0.4698 0.6371 0.5834 0.0100 -0.0664 0.0401 445 TYR B CD1 5420 C CD2 . TYR D 79 ? 0.4805 0.6546 0.5690 0.0200 -0.0927 0.0297 445 TYR B CD2 5421 C CE1 . TYR D 79 ? 0.4683 0.6576 0.6037 0.0198 -0.0590 0.0701 445 TYR B CE1 5422 C CE2 . TYR D 79 ? 0.4440 0.6443 0.5578 0.0270 -0.0889 0.0586 445 TYR B CE2 5423 C CZ . TYR D 79 ? 0.4825 0.6926 0.6217 0.0277 -0.0704 0.0803 445 TYR B CZ 5424 O OH . TYR D 79 ? 0.5033 0.7453 0.6694 0.0403 -0.0624 0.1148 445 TYR B OH 5425 N N . PHE D 80 ? 0.5794 0.7052 0.5743 0.0307 -0.0525 -0.0177 446 PHE B N 5426 C CA . PHE D 80 ? 0.5944 0.7133 0.5592 0.0456 -0.0382 -0.0129 446 PHE B CA 5427 C C . PHE D 80 ? 0.6444 0.7575 0.5832 0.0606 -0.0555 -0.0255 446 PHE B C 5428 O O . PHE D 80 ? 0.5906 0.6994 0.5275 0.0599 -0.0712 -0.0397 446 PHE B O 5429 C CB . PHE D 80 ? 0.5043 0.6101 0.4511 0.0406 -0.0044 -0.0115 446 PHE B CB 5430 C CG . PHE D 80 ? 0.5082 0.6198 0.4617 0.0290 -0.0018 -0.0240 446 PHE B CG 5431 C CD1 . PHE D 80 ? 0.5304 0.6443 0.5042 0.0108 -0.0020 -0.0262 446 PHE B CD1 5432 C CD2 . PHE D 80 ? 0.5636 0.6808 0.5020 0.0399 0.0019 -0.0308 446 PHE B CD2 5433 C CE1 . PHE D 80 ? 0.5723 0.7000 0.5563 0.0013 -0.0017 -0.0348 446 PHE B CE1 5434 C CE2 . PHE D 80 ? 0.5814 0.7148 0.5322 0.0326 0.0061 -0.0366 446 PHE B CE2 5435 C CZ . PHE D 80 ? 0.5987 0.7405 0.5749 0.0121 0.0029 -0.0386 446 PHE B CZ 5436 N N . SER D 81 ? 0.6761 0.7833 0.5869 0.0784 -0.0513 -0.0197 447 SER B N 5437 C CA . SER D 81 ? 0.6666 0.7585 0.5373 0.0991 -0.0622 -0.0309 447 SER B CA 5438 C C . SER D 81 ? 0.6695 0.7567 0.5228 0.1052 -0.0330 -0.0359 447 SER B C 5439 O O . SER D 81 ? 0.7166 0.8079 0.5751 0.0979 -0.0012 -0.0261 447 SER B O 5440 C CB . SER D 81 ? 0.6891 0.7763 0.5313 0.1193 -0.0639 -0.0214 447 SER B CB 5441 O OG . SER D 81 ? 0.6750 0.7799 0.5437 0.1126 -0.0908 -0.0106 447 SER B OG 5442 N N . TYR D 82 ? 0.6419 0.7189 0.4731 0.1188 -0.0438 -0.0486 448 TYR B N 5443 C CA . TYR D 82 ? 0.6084 0.6923 0.4301 0.1285 -0.0156 -0.0475 448 TYR B CA 5444 C C . TYR D 82 ? 0.6954 0.7560 0.4681 0.1611 -0.0260 -0.0574 448 TYR B C 5445 O O . TYR D 82 ? 0.7276 0.7690 0.4885 0.1638 -0.0558 -0.0709 448 TYR B O 5446 C CB . TYR D 82 ? 0.5858 0.6944 0.4511 0.1045 -0.0085 -0.0479 448 TYR B CB 5447 C CG . TYR D 82 ? 0.5806 0.7131 0.4554 0.1045 0.0236 -0.0382 448 TYR B CG 5448 C CD1 . TYR D 82 ? 0.5363 0.6784 0.4276 0.0848 0.0496 -0.0248 448 TYR B CD1 5449 C CD2 . TYR D 82 ? 0.6332 0.7778 0.4998 0.1242 0.0278 -0.0395 448 TYR B CD2 5450 C CE1 . TYR D 82 ? 0.5450 0.7139 0.4534 0.0780 0.0754 -0.0123 448 TYR B CE1 5451 C CE2 . TYR D 82 ? 0.6235 0.8035 0.5104 0.1233 0.0574 -0.0241 448 TYR B CE2 5452 C CZ . TYR D 82 ? 0.5819 0.7768 0.4941 0.0968 0.0793 -0.0101 448 TYR B CZ 5453 O OH . TYR D 82 ? 0.5267 0.7611 0.4666 0.0894 0.1053 0.0086 448 TYR B OH 5454 N N . PRO D 83 ? 0.7133 0.7684 0.4507 0.1881 0.0002 -0.0494 449 PRO B N 5455 C CA . PRO D 83 ? 0.7510 0.7764 0.4283 0.2281 -0.0035 -0.0561 449 PRO B CA 5456 C C . PRO D 83 ? 0.7559 0.7972 0.4438 0.2355 0.0078 -0.0560 449 PRO B C 5457 O O . PRO D 83 ? 0.7448 0.8315 0.4813 0.2196 0.0361 -0.0418 449 PRO B O 5458 C CB . PRO D 83 ? 0.7788 0.8021 0.4250 0.2539 0.0307 -0.0408 449 PRO B CB 5459 C CG . PRO D 83 ? 0.7379 0.8001 0.4409 0.2222 0.0614 -0.0242 449 PRO B CG 5460 C CD . PRO D 83 ? 0.6489 0.7194 0.3955 0.1845 0.0373 -0.0317 449 PRO B CD 5461 N N . LEU D 84 ? 0.7978 0.7992 0.4372 0.2596 -0.0160 -0.0706 450 LEU B N 5462 C CA . LEU D 84 ? 0.8178 0.8288 0.4576 0.2746 -0.0060 -0.0696 450 LEU B CA 5463 C C . LEU D 84 ? 0.9002 0.9407 0.5316 0.3079 0.0397 -0.0477 450 LEU B C 5464 O O . LEU D 84 ? 0.9299 1.0094 0.5903 0.3137 0.0593 -0.0359 450 LEU B O 5465 C CB . LEU D 84 ? 0.8836 0.8267 0.4540 0.2985 -0.0409 -0.0902 450 LEU B CB 5466 C CG . LEU D 84 ? 0.9353 0.8763 0.4973 0.3163 -0.0354 -0.0913 450 LEU B CG 5467 C CD1 . LEU D 84 ? 0.8318 0.8224 0.4756 0.2738 -0.0389 -0.0897 450 LEU B CD1 5468 C CD2 . LEU D 84 ? 1.0131 0.8651 0.4863 0.3420 -0.0709 -0.1129 450 LEU B CD2 5469 N N . SER D 85 ? 0.8878 0.9142 0.4826 0.3306 0.0576 -0.0387 451 SER B N 5470 C CA . SER D 85 ? 0.8928 0.9481 0.4811 0.3636 0.1048 -0.0124 451 SER B CA 5471 C C . SER D 85 ? 0.8238 0.9573 0.5034 0.3260 0.1357 0.0115 451 SER B C 5472 O O . SER D 85 ? 0.8126 0.9907 0.5124 0.3435 0.1731 0.0383 451 SER B O 5473 C CB . SER D 85 ? 0.9583 0.9760 0.4847 0.3954 0.1169 -0.0077 451 SER B CB 5474 O OG . SER D 85 ? 0.9551 0.9779 0.5102 0.3603 0.1098 -0.0095 451 SER B OG 5475 N N . MET D 86 ? 0.7472 0.8955 0.4794 0.2746 0.1192 0.0038 452 MET B N 5476 C CA . MET D 86 ? 0.7046 0.9122 0.5132 0.2332 0.1399 0.0221 452 MET B CA 5477 C C . MET D 86 ? 0.6592 0.8987 0.5168 0.2065 0.1218 0.0153 452 MET B C 5478 O O . MET D 86 ? 0.6499 0.9171 0.5609 0.1624 0.1197 0.0184 452 MET B O 5479 C CB . MET D 86 ? 0.7287 0.9228 0.5515 0.1982 0.1393 0.0211 452 MET B CB 5480 C CG . MET D 86 ? 0.8249 0.9899 0.6009 0.2241 0.1601 0.0305 452 MET B CG 5481 S SD . MET D 86 ? 0.7959 0.9560 0.5949 0.1852 0.1781 0.0422 452 MET B SD 5482 C CE . MET D 86 ? 1.0392 1.1832 0.8587 0.1491 0.1388 0.0191 452 MET B CE 5483 N N . LYS D 87 ? 0.7529 0.9804 0.5831 0.2363 0.1088 0.0059 453 LYS B N 5484 C CA . LYS D 87 ? 0.7362 0.9896 0.6032 0.2204 0.0930 0.0000 453 LYS B CA 5485 C C . LYS D 87 ? 0.6901 1.0213 0.6304 0.1947 0.1140 0.0241 453 LYS B C 5486 O O . LYS D 87 ? 0.6882 1.0401 0.6742 0.1545 0.0987 0.0190 453 LYS B O 5487 C CB . LYS D 87 ? 0.8147 1.0394 0.6288 0.2674 0.0862 -0.0073 453 LYS B CB 5488 C CG . LYS D 87 ? 0.8526 1.1036 0.6981 0.2598 0.0747 -0.0102 453 LYS B CG 5489 C CD . LYS D 87 ? 0.9896 1.2186 0.7790 0.3157 0.0817 -0.0079 453 LYS B CD 5490 C CE . LYS D 87 ? 1.0651 1.3413 0.8552 0.3546 0.1249 0.0246 453 LYS B CE 5491 N NZ . LYS D 87 ? 1.1224 1.3768 0.8518 0.4174 0.1377 0.0312 453 LYS B NZ 5492 N N . SER D 88 ? 0.6681 1.0424 0.6185 0.2185 0.1480 0.0524 454 SER B N 5493 C CA . SER D 88 ? 0.6720 1.1306 0.6979 0.1947 0.1661 0.0811 454 SER B CA 5494 C C . SER D 88 ? 0.7637 1.2366 0.8381 0.1343 0.1632 0.0850 454 SER B C 5495 O O . SER D 88 ? 0.7129 1.2366 0.8468 0.0965 0.1564 0.0948 454 SER B O 5496 C CB . SER D 88 ? 0.6378 1.1419 0.6666 0.2347 0.2070 0.1170 454 SER B CB 5497 O OG . SER D 88 ? 0.6604 1.1393 0.6660 0.2380 0.2286 0.1259 454 SER B OG 5498 N N . ASP D 89 ? 0.9095 1.3321 0.9514 0.1269 0.1671 0.0774 455 ASP B N 5499 C CA . ASP D 89 ? 0.9413 1.3617 1.0123 0.0762 0.1697 0.0829 455 ASP B CA 5500 C C . ASP D 89 ? 0.8848 1.2795 0.9649 0.0377 0.1373 0.0593 455 ASP B C 5501 O O . ASP D 89 ? 0.8541 1.2490 0.9594 -0.0073 0.1347 0.0636 455 ASP B O 5502 C CB . ASP D 89 ? 1.0156 1.3856 1.0408 0.0880 0.1867 0.0835 455 ASP B CB 5503 C CG . ASP D 89 ? 1.0971 1.4783 1.1513 0.0498 0.2089 0.1060 455 ASP B CG 5504 O OD1 . ASP D 89 ? 1.1215 1.5334 1.1869 0.0642 0.2416 0.1349 455 ASP B OD1 5505 O OD2 . ASP D 89 ? 1.1360 1.4908 1.1980 0.0064 0.1946 0.0964 455 ASP B OD2 5506 N N . LEU D 90 ? 1.2318 0.9707 1.0526 0.1728 0.0482 0.0881 456 LEU B N 5507 C CA . LEU D 90 ? 1.1385 0.8744 0.9080 0.1930 0.0119 0.1222 456 LEU B CA 5508 C C . LEU D 90 ? 1.1993 0.9506 1.0241 0.2460 -0.0097 0.1541 456 LEU B C 5509 O O . LEU D 90 ? 1.2197 0.9276 1.0294 0.2693 0.0010 0.1867 456 LEU B O 5510 C CB . LEU D 90 ? 1.0896 0.7590 0.7860 0.1702 0.0379 0.1340 456 LEU B CB 5511 C CG . LEU D 90 ? 1.0734 0.7294 0.7050 0.1824 0.0130 0.1696 456 LEU B CG 5512 C CD1 . LEU D 90 ? 0.9341 0.6376 0.5343 0.1717 -0.0197 0.1667 456 LEU B CD1 5513 C CD2 . LEU D 90 ? 1.1152 0.7095 0.6974 0.1522 0.0446 0.1778 456 LEU B CD2 5514 N N . SER D 91 ? 1.2196 1.0387 1.1182 0.2642 -0.0400 0.1497 457 SER B N 5515 C CA . SER D 91 ? 1.2714 1.1284 1.2403 0.3125 -0.0693 0.1889 457 SER B CA 5516 C C . SER D 91 ? 1.2940 1.2416 1.2803 0.3175 -0.1376 0.1885 457 SER B C 5517 O O . SER D 91 ? 1.2643 1.2414 1.2431 0.2857 -0.1475 0.1489 457 SER B O 5518 C CB . SER D 91 ? 1.2462 1.0927 1.3327 0.3320 -0.0233 0.1898 457 SER B CB 5519 O OG . SER D 91 ? 1.2628 1.1609 1.4405 0.3812 -0.0536 0.2399 457 SER B OG 5520 N N . VAL D 92 ? 1.3369 1.3301 1.3482 0.3549 -0.1835 0.2345 458 VAL B N 5521 C CA . VAL D 92 ? 1.3253 1.4092 1.3415 0.3533 -0.2567 0.2346 458 VAL B CA 5522 C C . VAL D 92 ? 1.2592 1.4114 1.4059 0.3480 -0.2655 0.2113 458 VAL B C 5523 O O . VAL D 92 ? 1.2255 1.4343 1.3731 0.3207 -0.3044 0.1769 458 VAL B O 5524 C CB . VAL D 92 ? 1.4078 1.5352 1.4176 0.3933 -0.3087 0.3001 458 VAL B CB 5525 C CG1 . VAL D 92 ? 1.4244 1.6414 1.3979 0.3767 -0.3901 0.2916 458 VAL B CG1 5526 C CG2 . VAL D 92 ? 1.4716 1.5224 1.3722 0.4066 -0.2856 0.3318 458 VAL B CG2 5527 N N . SER D 93 ? 1.2351 1.3757 1.4972 0.3729 -0.2216 0.2287 459 SER B N 5528 C CA . SER D 93 ? 1.1843 1.3868 1.5897 0.3750 -0.2210 0.2163 459 SER B CA 5529 C C . SER D 93 ? 1.1180 1.2751 1.5319 0.3415 -0.1581 0.1588 459 SER B C 5530 O O . SER D 93 ? 1.0792 1.2561 1.6136 0.3477 -0.1268 0.1505 459 SER B O 5531 C CB . SER D 93 ? 1.1862 1.4032 1.7306 0.4243 -0.1993 0.2734 459 SER B CB 5532 O OG . SER D 93 ? 1.1639 1.2754 1.6957 0.4341 -0.1143 0.2743 459 SER B OG 5533 N N . SER D 94 ? 1.1153 1.2153 1.4053 0.3067 -0.1380 0.1256 460 SER B N 5534 C CA . SER D 94 ? 1.1132 1.1803 1.3978 0.2720 -0.0844 0.0803 460 SER B CA 5535 C C . SER D 94 ? 1.0865 1.1921 1.3333 0.2371 -0.1133 0.0465 460 SER B C 5536 O O . SER D 94 ? 1.1280 1.2271 1.2781 0.2247 -0.1436 0.0473 460 SER B O 5537 C CB . SER D 94 ? 1.1629 1.1364 1.3528 0.2549 -0.0286 0.0748 460 SER B CB 5538 O OG . SER D 94 ? 1.1412 1.0939 1.3168 0.2179 0.0172 0.0378 460 SER B OG 5539 N N . ALA D 95 ? 1.0196 1.1596 1.3492 0.2223 -0.0950 0.0181 461 ALA B N 5540 C CA . ALA D 95 ? 0.9646 1.1382 1.2827 0.1898 -0.1097 -0.0141 461 ALA B CA 5541 C C . ALA D 95 ? 0.8852 1.0081 1.1312 0.1584 -0.0579 -0.0286 461 ALA B C 5542 O O . ALA D 95 ? 0.8730 1.0181 1.1374 0.1335 -0.0463 -0.0503 461 ALA B O 5543 C CB . ALA D 95 ? 0.9675 1.2093 1.4244 0.1894 -0.1156 -0.0328 461 ALA B CB 5544 N N . GLY D 96 ? 0.8647 0.9237 1.0355 0.1578 -0.0269 -0.0129 462 GLY B N 5545 C CA . GLY D 96 ? 0.8067 0.8281 0.9045 0.1240 0.0126 -0.0171 462 GLY B CA 5546 C C . GLY D 96 ? 0.7443 0.7693 0.7730 0.1058 -0.0093 -0.0113 462 GLY B C 5547 O O . GLY D 96 ? 0.7913 0.8260 0.7956 0.1193 -0.0508 -0.0062 462 GLY B O 5548 N N . PRO D 97 ? 0.6756 0.6933 0.6724 0.0745 0.0221 -0.0077 463 PRO B N 5549 C CA . PRO D 97 ? 0.6444 0.6655 0.6001 0.0574 0.0167 0.0033 463 PRO B CA 5550 C C . PRO D 97 ? 0.7276 0.7083 0.5953 0.0649 -0.0038 0.0260 463 PRO B C 5551 O O . PRO D 97 ? 0.8020 0.7822 0.6429 0.0625 -0.0147 0.0289 463 PRO B O 5552 C CB . PRO D 97 ? 0.6258 0.6506 0.5748 0.0258 0.0581 0.0194 463 PRO B CB 5553 C CG . PRO D 97 ? 0.6586 0.6601 0.5915 0.0208 0.0792 0.0161 463 PRO B CG 5554 C CD . PRO D 97 ? 0.6531 0.6590 0.6498 0.0523 0.0683 -0.0084 463 PRO B CD 5555 N N . ILE D 98 ? 0.7352 0.6766 0.5613 0.0729 -0.0014 0.0403 464 ILE B N 5556 C CA . ILE D 98 ? 0.7671 0.6662 0.5172 0.0816 -0.0146 0.0660 464 ILE B CA 5557 C C . ILE D 98 ? 0.7945 0.7017 0.5300 0.1102 -0.0542 0.0655 464 ILE B C 5558 O O . ILE D 98 ? 0.7910 0.6847 0.4731 0.1068 -0.0604 0.0758 464 ILE B O 5559 C CB . ILE D 98 ? 0.8529 0.7056 0.5786 0.0868 -0.0004 0.0759 464 ILE B CB 5560 C CG1 . ILE D 98 ? 0.8616 0.7039 0.5763 0.0473 0.0363 0.0714 464 ILE B CG1 5561 C CG2 . ILE D 98 ? 0.8407 0.6495 0.4989 0.0978 -0.0104 0.1056 464 ILE B CG2 5562 C CD1 . ILE D 98 ? 0.8688 0.7134 0.5371 0.0134 0.0419 0.0983 464 ILE B CD1 5563 N N . SER D 99 ? 0.8373 0.7689 0.6207 0.1368 -0.0792 0.0567 465 SER B N 5564 C CA . SER D 99 ? 0.9138 0.8668 0.6781 0.1603 -0.1263 0.0617 465 SER B CA 5565 C C . SER D 99 ? 0.9185 0.9131 0.6931 0.1416 -0.1456 0.0302 465 SER B C 5566 O O . SER D 99 ? 0.9798 0.9813 0.6998 0.1451 -0.1790 0.0281 465 SER B O 5567 C CB . SER D 99 ? 0.9225 0.9044 0.7547 0.1936 -0.1502 0.0724 465 SER B CB 5568 O OG . SER D 99 ? 0.9231 0.9475 0.8584 0.1884 -0.1412 0.0476 465 SER B OG 5569 N N . GLN D 100 ? 0.8944 0.9128 0.7347 0.1190 -0.1201 0.0047 466 GLN B N 5570 C CA . GLN D 100 ? 0.9021 0.9547 0.7704 0.0979 -0.1275 -0.0300 466 GLN B CA 5571 C C . GLN D 100 ? 0.9018 0.9165 0.7082 0.0754 -0.0961 -0.0291 466 GLN B C 5572 O O . GLN D 100 ? 0.9977 1.0111 0.7688 0.0638 -0.1079 -0.0524 466 GLN B O 5573 C CB . GLN D 100 ? 0.8616 0.9549 0.8415 0.0862 -0.1054 -0.0529 466 GLN B CB 5574 C CG . GLN D 100 ? 0.8846 1.0191 0.9497 0.1083 -0.1290 -0.0554 466 GLN B CG 5575 C CD . GLN D 100 ? 1.0322 1.2137 1.1077 0.1193 -0.1930 -0.0631 466 GLN B CD 5576 O OE1 . GLN D 100 ? 1.0905 1.2725 1.1403 0.1468 -0.2249 -0.0335 466 GLN B OE1 5577 N NE2 . GLN D 100 ? 1.0972 1.3217 1.2131 0.0951 -0.2120 -0.1009 466 GLN B NE2 5578 N N . PHE D 101 ? 0.7803 0.7651 0.5755 0.0664 -0.0541 -0.0011 467 PHE B N 5579 C CA . PHE D 101 ? 0.8054 0.7644 0.5764 0.0463 -0.0158 0.0100 467 PHE B CA 5580 C C . PHE D 101 ? 0.8440 0.7538 0.5389 0.0503 -0.0022 0.0536 467 PHE B C 5581 O O . PHE D 101 ? 0.8689 0.7502 0.5358 0.0409 0.0260 0.0670 467 PHE B O 5582 C CB . PHE D 101 ? 0.7582 0.7440 0.6102 0.0258 0.0265 0.0154 467 PHE B CB 5583 C CG . PHE D 101 ? 0.7179 0.7500 0.6597 0.0212 0.0232 -0.0241 467 PHE B CG 5584 C CD1 . PHE D 101 ? 0.6861 0.7271 0.6595 0.0078 0.0293 -0.0607 467 PHE B CD1 5585 C CD2 . PHE D 101 ? 0.7117 0.7736 0.7093 0.0275 0.0202 -0.0270 467 PHE B CD2 5586 C CE1 . PHE D 101 ? 0.7299 0.8155 0.7978 0.0004 0.0266 -0.0974 467 PHE B CE1 5587 C CE2 . PHE D 101 ? 0.6913 0.7963 0.7839 0.0247 0.0213 -0.0592 467 PHE B CE2 5588 C CZ . PHE D 101 ? 0.7110 0.8314 0.8434 0.0110 0.0216 -0.0933 467 PHE B CZ 5589 N N . ASN D 102 ? 0.8723 0.5280 0.6220 0.0053 0.0548 -0.0158 468 ASN B N 5590 C CA . ASN D 102 ? 0.8366 0.5274 0.5476 0.0457 0.0692 -0.0425 468 ASN B CA 5591 C C . ASN D 102 ? 0.8361 0.5659 0.5410 0.0332 0.0482 -0.0588 468 ASN B C 5592 O O . ASN D 102 ? 0.8618 0.5746 0.5051 0.0529 0.0439 -0.0827 468 ASN B O 5593 C CB . ASN D 102 ? 0.7635 0.5114 0.5120 0.0751 0.0955 -0.0270 468 ASN B CB 5594 C CG . ASN D 102 ? 0.7723 0.4893 0.5108 0.1053 0.1230 -0.0123 468 ASN B CG 5595 O OD1 . ASN D 102 ? 0.8799 0.5809 0.5699 0.1441 0.1382 -0.0294 468 ASN B OD1 5596 N ND2 . ASN D 102 ? 0.7241 0.4404 0.5126 0.0899 0.1310 0.0261 468 ASN B ND2 5597 N N . TYR D 103 ? 0.8311 0.6167 0.5977 0.0068 0.0387 -0.0411 469 TYR B N 5598 C CA . TYR D 103 ? 0.7886 0.6220 0.5589 -0.0012 0.0237 -0.0494 469 TYR B CA 5599 C C . TYR D 103 ? 0.7673 0.6288 0.5896 -0.0427 0.0022 -0.0303 469 TYR B C 5600 O O . TYR D 103 ? 0.6906 0.5849 0.5734 -0.0526 0.0102 -0.0023 469 TYR B O 5601 C CB . TYR D 103 ? 0.7308 0.6227 0.5234 0.0245 0.0385 -0.0476 469 TYR B CB 5602 C CG . TYR D 103 ? 0.6890 0.6349 0.4956 0.0174 0.0257 -0.0474 469 TYR B CG 5603 C CD1 . TYR D 103 ? 0.6945 0.6480 0.4560 0.0342 0.0237 -0.0589 469 TYR B CD1 5604 C CD2 . TYR D 103 ? 0.5692 0.5608 0.4328 0.0002 0.0188 -0.0299 469 TYR B CD2 5605 C CE1 . TYR D 103 ? 0.6221 0.6350 0.4039 0.0308 0.0160 -0.0484 469 TYR B CE1 5606 C CE2 . TYR D 103 ? 0.5124 0.5525 0.3938 -0.0067 0.0081 -0.0239 469 TYR B CE2 5607 C CZ . TYR D 103 ? 0.5437 0.5983 0.3888 0.0070 0.0072 -0.0308 469 TYR B CZ 5608 O OH . TYR D 103 ? 0.5305 0.6431 0.4005 0.0029 0.0003 -0.0149 469 TYR B OH 5609 N N . LYS D 104 ? 0.8256 0.6769 0.6182 -0.0601 -0.0244 -0.0435 470 LYS B N 5610 C CA . LYS D 104 ? 0.7992 0.6815 0.6355 -0.0988 -0.0498 -0.0268 470 LYS B CA 5611 C C . LYS D 104 ? 0.7571 0.6744 0.5665 -0.0925 -0.0624 -0.0392 470 LYS B C 5612 O O . LYS D 104 ? 0.8224 0.7023 0.5560 -0.0732 -0.0721 -0.0645 470 LYS B O 5613 C CB . LYS D 104 ? 0.8549 0.6743 0.6837 -0.1361 -0.0828 -0.0247 470 LYS B CB 5614 C CG . LYS D 104 ? 0.8818 0.7374 0.7593 -0.1799 -0.1163 -0.0045 470 LYS B CG 5615 C CD . LYS D 104 ? 1.0175 0.8054 0.8953 -0.2244 -0.1597 0.0008 470 LYS B CD 5616 C CE . LYS D 104 ? 1.0564 0.8342 0.9940 -0.2361 -0.1413 0.0368 470 LYS B CE 5617 N NZ . LYS D 104 ? 1.1845 0.8936 1.1361 -0.2873 -0.1888 0.0503 470 LYS B NZ 5618 N N . GLN D 105 ? 0.6820 0.6705 0.5492 -0.1020 -0.0598 -0.0179 471 GLN B N 5619 C CA . GLN D 105 ? 0.6823 0.7155 0.5363 -0.0948 -0.0675 -0.0197 471 GLN B CA 5620 C C . GLN D 105 ? 0.7152 0.7405 0.5501 -0.1202 -0.1030 -0.0227 471 GLN B C 5621 O O . GLN D 105 ? 0.8018 0.7972 0.6544 -0.1536 -0.1264 -0.0174 471 GLN B O 5622 C CB . GLN D 105 ? 0.6089 0.7117 0.5298 -0.0936 -0.0525 0.0056 471 GLN B CB 5623 C CG . GLN D 105 ? 0.5938 0.7075 0.5193 -0.0656 -0.0307 0.0039 471 GLN B CG 5624 C CD . GLN D 105 ? 0.5410 0.6999 0.5256 -0.0674 -0.0267 0.0260 471 GLN B CD 5625 O OE1 . GLN D 105 ? 0.5856 0.7479 0.6070 -0.0770 -0.0257 0.0407 471 GLN B OE1 5626 N NE2 . GLN D 105 ? 0.4659 0.6588 0.4602 -0.0561 -0.0255 0.0331 471 GLN B NE2 5627 N N . SER D 106 ? 0.7188 0.7757 0.5207 -0.1034 -0.1091 -0.0267 472 SER B N 5628 C CA . SER D 106 ? 0.7707 0.8207 0.5385 -0.1178 -0.1460 -0.0336 472 SER B CA 5629 C C . SER D 106 ? 0.7582 0.8548 0.6063 -0.1602 -0.1626 -0.0050 472 SER B C 5630 O O . SER D 106 ? 0.7036 0.8618 0.6253 -0.1630 -0.1384 0.0238 472 SER B O 5631 C CB . SER D 106 ? 0.7797 0.8737 0.5028 -0.0803 -0.1392 -0.0334 472 SER B CB 5632 O OG . SER D 106 ? 0.8377 0.9274 0.5200 -0.0874 -0.1763 -0.0408 472 SER B OG 5633 N N . PHE D 107 ? 0.8440 0.9068 0.6744 -0.1912 -0.2076 -0.0120 473 PHE B N 5634 C CA . PHE D 107 ? 0.8379 0.9564 0.7443 -0.2310 -0.2288 0.0204 473 PHE B CA 5635 C C . PHE D 107 ? 0.8335 0.9981 0.7143 -0.2223 -0.2483 0.0207 473 PHE B C 5636 O O . PHE D 107 ? 0.7894 1.0281 0.7372 -0.2392 -0.2495 0.0537 473 PHE B O 5637 C CB . PHE D 107 ? 1.0073 1.0733 0.9284 -0.2789 -0.2744 0.0229 473 PHE B CB 5638 C CG . PHE D 107 ? 1.1406 1.1785 1.1067 -0.2899 -0.2523 0.0381 473 PHE B CG 5639 C CD1 . PHE D 107 ? 1.1173 1.2233 1.1873 -0.3071 -0.2300 0.0881 473 PHE B CD1 5640 C CD2 . PHE D 107 ? 1.2380 1.1828 1.1372 -0.2757 -0.2516 0.0061 473 PHE B CD2 5641 C CE1 . PHE D 107 ? 1.0891 1.1752 1.1962 -0.3083 -0.2061 0.1073 473 PHE B CE1 5642 C CE2 . PHE D 107 ? 1.2067 1.1292 1.1468 -0.2820 -0.2292 0.0239 473 PHE B CE2 5643 C CZ . PHE D 107 ? 1.1195 1.1148 1.1641 -0.2978 -0.2061 0.0753 473 PHE B CZ 5644 N N . SER D 108 ? 0.8590 0.9815 0.6373 -0.1882 -0.2608 -0.0133 474 SER B N 5645 C CA . SER D 108 ? 0.8650 1.0230 0.5989 -0.1704 -0.2819 -0.0152 474 SER B CA 5646 C C . SER D 108 ? 0.6945 0.9257 0.4321 -0.1243 -0.2353 0.0036 474 SER B C 5647 O O . SER D 108 ? 0.7748 1.0422 0.4704 -0.0971 -0.2427 0.0073 474 SER B O 5648 C CB . SER D 108 ? 1.0316 1.0935 0.6353 -0.1522 -0.3303 -0.0615 474 SER B CB 5649 O OG . SER D 108 ? 1.1135 1.1082 0.6406 -0.1114 -0.3078 -0.0891 474 SER B OG 5650 N N . ASN D 109 ? 0.6135 0.8660 0.4027 -0.1157 -0.1906 0.0187 475 ASN B N 5651 C CA . ASN D 109 ? 0.5733 0.8962 0.3899 -0.0840 -0.1519 0.0457 475 ASN B CA 5652 C C . ASN D 109 ? 0.4540 0.8158 0.3730 -0.1050 -0.1257 0.0755 475 ASN B C 5653 O O . ASN D 109 ? 0.4717 0.7977 0.4205 -0.1259 -0.1236 0.0692 475 ASN B O 5654 C CB . ASN D 109 ? 0.6327 0.9337 0.3865 -0.0389 -0.1291 0.0322 475 ASN B CB 5655 C CG . ASN D 109 ? 0.6937 0.9628 0.3289 0.0035 -0.1480 0.0083 475 ASN B CG 5656 O OD1 . ASN D 109 ? 0.7229 1.0474 0.3361 0.0323 -0.1459 0.0268 475 ASN B OD1 5657 N ND2 . ASN D 109 ? 0.8814 1.0555 0.4317 0.0139 -0.1659 -0.0319 475 ASN B ND2 5658 N N . PRO D 110 ? 0.4815 0.9113 0.4492 -0.0952 -0.1070 0.1097 476 PRO B N 5659 C CA . PRO D 110 ? 0.3404 0.7884 0.3882 -0.1071 -0.0871 0.1340 476 PRO B CA 5660 C C . PRO D 110 ? 0.3584 0.7672 0.4057 -0.0984 -0.0710 0.1201 476 PRO B C 5661 O O . PRO D 110 ? 0.4215 0.8321 0.4338 -0.0748 -0.0622 0.1144 476 PRO B O 5662 C CB . PRO D 110 ? 0.3079 0.8225 0.3904 -0.0935 -0.0751 0.1715 476 PRO B CB 5663 C CG . PRO D 110 ? 0.4017 0.9471 0.4336 -0.0798 -0.0896 0.1716 476 PRO B CG 5664 C CD . PRO D 110 ? 0.5239 1.0109 0.4693 -0.0690 -0.1054 0.1295 476 PRO B CD 5665 N N . THR D 111 ? 0.3060 0.6846 0.3878 -0.1112 -0.0663 0.1176 477 THR B N 5666 C CA . THR D 111 ? 0.3715 0.7110 0.4483 -0.1006 -0.0545 0.1026 477 THR B CA 5667 C C . THR D 111 ? 0.4050 0.7370 0.5311 -0.1004 -0.0480 0.1167 477 THR B C 5668 O O . THR D 111 ? 0.4209 0.7638 0.5783 -0.1071 -0.0490 0.1343 477 THR B O 5669 C CB . THR D 111 ? 0.3912 0.6739 0.4299 -0.1047 -0.0575 0.0746 477 THR B CB 5670 O OG1 . THR D 111 ? 0.4704 0.7509 0.5389 -0.1255 -0.0644 0.0852 477 THR B OG1 5671 C CG2 . THR D 111 ? 0.4474 0.7087 0.4163 -0.0974 -0.0693 0.0521 477 THR B CG2 5672 N N . CYS D 112 ? 0.4840 0.7943 0.6105 -0.0887 -0.0440 0.1091 478 CYS B N 5673 C CA . CYS D 112 ? 0.4681 0.7461 0.6191 -0.0825 -0.0463 0.1117 478 CYS B CA 5674 C C . CYS D 112 ? 0.5754 0.8062 0.6966 -0.0677 -0.0419 0.0858 478 CYS B C 5675 O O . CYS D 112 ? 0.5920 0.8226 0.6843 -0.0630 -0.0371 0.0712 478 CYS B O 5676 C CB . CYS D 112 ? 0.3859 0.6815 0.5765 -0.0861 -0.0582 0.1340 478 CYS B CB 5677 S SG . CYS D 112 ? 0.5195 0.8532 0.7519 -0.0967 -0.0619 0.1703 478 CYS B SG 5678 N N . LEU D 113 ? 0.5826 0.7718 0.7028 -0.0531 -0.0421 0.0813 479 LEU B N 5679 C CA . LEU D 113 ? 0.5042 0.6487 0.5927 -0.0320 -0.0376 0.0590 479 LEU B CA 5680 C C . LEU D 113 ? 0.5431 0.6437 0.6300 -0.0129 -0.0546 0.0546 479 LEU B C 5681 O O . LEU D 113 ? 0.6116 0.6907 0.7007 -0.0004 -0.0574 0.0644 479 LEU B O 5682 C CB . LEU D 113 ? 0.4870 0.6168 0.5578 -0.0229 -0.0187 0.0573 479 LEU B CB 5683 C CG . LEU D 113 ? 0.5935 0.6809 0.6297 0.0048 -0.0080 0.0398 479 LEU B CG 5684 C CD1 . LEU D 113 ? 0.5495 0.6337 0.5624 0.0025 -0.0094 0.0199 479 LEU B CD1 5685 C CD2 . LEU D 113 ? 0.6077 0.6935 0.6440 0.0099 0.0123 0.0535 479 LEU B CD2 5686 N N . ILE D 114 ? 0.5154 0.5993 0.5935 -0.0081 -0.0694 0.0402 480 ILE B N 5687 C CA . ILE D 114 ? 0.5339 0.5660 0.6064 0.0050 -0.0998 0.0320 480 ILE B CA 5688 C C . ILE D 114 ? 0.6614 0.6498 0.6873 0.0357 -0.1018 0.0050 480 ILE B C 5689 O O . ILE D 114 ? 0.6917 0.7041 0.7145 0.0326 -0.0962 -0.0022 480 ILE B O 5690 C CB . ILE D 114 ? 0.4997 0.5580 0.6219 -0.0248 -0.1309 0.0492 480 ILE B CB 5691 C CG1 . ILE D 114 ? 0.4757 0.5837 0.6433 -0.0502 -0.1253 0.0808 480 ILE B CG1 5692 C CG2 . ILE D 114 ? 0.5284 0.5167 0.6450 -0.0183 -0.1761 0.0393 480 ILE B CG2 5693 C CD1 . ILE D 114 ? 0.5284 0.6753 0.7574 -0.0790 -0.1508 0.1117 480 ILE B CD1 5694 N N . LEU D 115 ? 0.6616 0.5862 0.6442 0.0729 -0.1079 -0.0081 481 LEU B N 5695 C CA . LEU D 115 ? 0.6377 0.5151 0.5670 0.1111 -0.1138 -0.0336 481 LEU B CA 5696 C C . LEU D 115 ? 0.7320 0.5467 0.6460 0.1166 -0.1688 -0.0501 481 LEU B C 5697 O O . LEU D 115 ? 0.7531 0.5078 0.6439 0.1337 -0.1908 -0.0527 481 LEU B O 5698 C CB . LEU D 115 ? 0.6804 0.5300 0.5605 0.1608 -0.0813 -0.0337 481 LEU B CB 5699 C CG . LEU D 115 ? 0.6855 0.5914 0.5907 0.1488 -0.0359 -0.0107 481 LEU B CG 5700 C CD1 . LEU D 115 ? 0.7604 0.6504 0.6304 0.1999 -0.0044 0.0022 481 LEU B CD1 5701 C CD2 . LEU D 115 ? 0.6473 0.5869 0.5642 0.1246 -0.0244 -0.0175 481 LEU B CD2 5702 N N . ALA D 116 ? 0.7527 0.5779 0.6783 0.1027 -0.1947 -0.0595 482 ALA B N 5703 C CA . ALA D 116 ? 0.7915 0.5635 0.7192 0.0935 -0.2595 -0.0703 482 ALA B CA 5704 C C . ALA D 116 ? 0.8856 0.6204 0.7616 0.1253 -0.2827 -0.0994 482 ALA B C 5705 O O . ALA D 116 ? 0.9010 0.6757 0.7614 0.1427 -0.2463 -0.1035 482 ALA B O 5706 C CB . ALA D 116 ? 0.7435 0.5810 0.7624 0.0336 -0.2835 -0.0385 482 ALA B CB 5707 N N . THR D 117 ? 0.9772 0.6284 0.8226 0.1337 -0.3479 -0.1200 483 THR B N 5708 C CA . THR D 117 ? 0.9896 0.5994 0.7835 0.1625 -0.3847 -0.1495 483 THR B CA 5709 C C . THR D 117 ? 0.9237 0.5529 0.7889 0.1073 -0.4521 -0.1363 483 THR B C 5710 O O . THR D 117 ? 0.9489 0.5568 0.8668 0.0658 -0.4866 -0.1159 483 THR B O 5711 C CB . THR D 117 ? 1.1306 0.6185 0.8140 0.2286 -0.4110 -0.1849 483 THR B CB 5712 O OG1 . THR D 117 ? 1.1538 0.6639 0.7929 0.2709 -0.3390 -0.1749 483 THR B OG1 5713 C CG2 . THR D 117 ? 1.1546 0.6272 0.7972 0.2629 -0.4305 -0.1989 483 THR B CG2 5714 N N . VAL D 118 ? 0.8614 0.5408 0.7403 0.1068 -0.4494 -0.1347 484 VAL B N 5715 C CA . VAL D 118 ? 0.8971 0.6119 0.8526 0.0574 -0.4897 -0.1087 484 VAL B CA 5716 C C . VAL D 118 ? 1.0373 0.6373 0.9506 0.0688 -0.5519 -0.1312 484 VAL B C 5717 O O . VAL D 118 ? 1.1736 0.7154 1.0054 0.1215 -0.5586 -0.1661 484 VAL B O 5718 C CB . VAL D 118 ? 0.8686 0.6778 0.8451 0.0606 -0.4679 -0.0981 484 VAL B CB 5719 C CG1 . VAL D 118 ? 0.8626 0.7129 0.9139 0.0146 -0.5108 -0.0677 484 VAL B CG1 5720 C CG2 . VAL D 118 ? 0.6859 0.6010 0.7017 0.0549 -0.4128 -0.0715 484 VAL B CG2 5721 N N . PRO D 119 ? 0.7255 0.8031 0.9518 0.0625 -0.3636 -0.0438 485 PRO B N 5722 C CA . PRO D 119 ? 0.7429 0.8140 1.0363 0.0443 -0.3541 -0.0673 485 PRO B CA 5723 C C . PRO D 119 ? 0.8071 0.8911 1.0672 0.0324 -0.3484 -0.0636 485 PRO B C 5724 O O . PRO D 119 ? 0.8566 0.9547 1.0530 0.0429 -0.3520 -0.0370 485 PRO B O 5725 C CB . PRO D 119 ? 0.7106 0.7777 1.0934 0.0524 -0.3660 -0.0336 485 PRO B CB 5726 C CG . PRO D 119 ? 0.7052 0.7887 1.0395 0.0696 -0.3821 0.0209 485 PRO B CG 5727 C CD . PRO D 119 ? 0.7195 0.8073 0.9651 0.0768 -0.3806 0.0071 485 PRO B CD 5728 N N . HIS D 120 ? 0.8401 0.9217 1.1485 0.0091 -0.3387 -0.0924 486 HIS B N 5729 C CA . HIS D 120 ? 0.8471 0.9477 1.1345 -0.0072 -0.3368 -0.0888 486 HIS B CA 5730 C C . HIS D 120 ? 0.8872 1.0002 1.1905 0.0069 -0.3465 -0.0352 486 HIS B C 5731 O O . HIS D 120 ? 0.8728 1.0093 1.1424 0.0045 -0.3482 -0.0166 486 HIS B O 5732 C CB . HIS D 120 ? 0.8951 0.9921 1.2368 -0.0408 -0.3234 -0.1356 486 HIS B CB 5733 C CG . HIS D 120 ? 0.9857 1.0697 1.3311 -0.0575 -0.3081 -0.1923 486 HIS B CG 5734 N ND1 . HIS D 120 ? 1.0416 1.1022 1.4687 -0.0536 -0.2987 -0.2156 486 HIS B ND1 5735 C CD2 . HIS D 120 ? 1.0332 1.1273 1.3143 -0.0794 -0.2998 -0.2283 486 HIS B CD2 5736 C CE1 . HIS D 120 ? 1.0729 1.1306 1.4864 -0.0727 -0.2815 -0.2692 486 HIS B CE1 5737 N NE2 . HIS D 120 ? 1.0776 1.1551 1.3975 -0.0904 -0.2820 -0.2769 486 HIS B NE2 5738 N N . ASN D 121 ? 1.0146 1.1147 1.3747 0.0199 -0.3531 -0.0087 487 ASN B N 5739 C CA . ASN D 121 ? 1.0775 1.1900 1.4417 0.0338 -0.3629 0.0489 487 ASN B CA 5740 C C . ASN D 121 ? 0.9782 1.1148 1.2544 0.0474 -0.3631 0.0726 487 ASN B C 5741 O O . ASN D 121 ? 0.9451 1.1038 1.2133 0.0460 -0.3608 0.0986 487 ASN B O 5742 C CB . ASN D 121 ? 1.1868 1.2869 1.5917 0.0485 -0.3756 0.0772 487 ASN B CB 5743 C CG . ASN D 121 ? 1.3249 1.4193 1.8152 0.0448 -0.3826 0.1161 487 ASN B CG 5744 O OD1 . ASN D 121 ? 1.3455 1.4554 1.8313 0.0399 -0.3819 0.1489 487 ASN B OD1 5745 N ND2 . ASN D 121 ? 1.4870 1.5591 2.0641 0.0470 -0.3888 0.1145 487 ASN B ND2 5746 N N . LEU D 122 ? 0.9052 1.0372 1.1231 0.0600 -0.3635 0.0610 488 LEU B N 5747 C CA . LEU D 122 ? 0.8593 1.0073 1.0011 0.0745 -0.3595 0.0768 488 LEU B CA 5748 C C . LEU D 122 ? 0.8136 0.9682 0.9164 0.0698 -0.3517 0.0534 488 LEU B C 5749 O O . LEU D 122 ? 0.8278 0.9683 0.9160 0.0614 -0.3501 0.0186 488 LEU B O 5750 C CB . LEU D 122 ? 0.8983 1.0368 0.9994 0.0874 -0.3632 0.0750 488 LEU B CB 5751 C CG . LEU D 122 ? 0.8730 1.0240 0.9711 0.0949 -0.3724 0.1159 488 LEU B CG 5752 C CD1 . LEU D 122 ? 0.8532 0.9982 0.9107 0.1014 -0.3782 0.1053 488 LEU B CD1 5753 C CD2 . LEU D 122 ? 0.8874 1.0643 0.9476 0.0994 -0.3619 0.1453 488 LEU B CD2 5754 N N . THR D 123 ? 0.7965 0.9761 0.8857 0.0740 -0.3472 0.0760 489 THR B N 5755 C CA . THR D 123 ? 0.7872 0.9803 0.8508 0.0703 -0.3448 0.0656 489 THR B CA 5756 C C . THR D 123 ? 0.8202 1.0307 0.8497 0.0919 -0.3355 0.0897 489 THR B C 5757 O O . THR D 123 ? 0.8716 1.1026 0.8985 0.0930 -0.3348 0.0962 489 THR B O 5758 C CB . THR D 123 ? 0.7761 0.9908 0.8827 0.0473 -0.3497 0.0641 489 THR B CB 5759 O OG1 . THR D 123 ? 0.8060 1.0394 0.9508 0.0495 -0.3479 0.0963 489 THR B OG1 5760 C CG2 . THR D 123 ? 0.6897 0.8850 0.8304 0.0225 -0.3523 0.0276 489 THR B CG2 5761 N N . THR D 124 ? 0.8196 1.0247 0.8269 0.1072 -0.3279 0.1022 490 THR B N 5762 C CA . THR D 124 ? 0.8567 1.0767 0.8344 0.1259 -0.3117 0.1166 490 THR B CA 5763 C C . THR D 124 ? 0.8226 1.0171 0.7499 0.1380 -0.3039 0.0952 490 THR B C 5764 O O . THR D 124 ? 0.8534 1.0521 0.7605 0.1535 -0.2871 0.0965 490 THR B O 5765 C CB . THR D 124 ? 0.9788 1.2183 0.9589 0.1281 -0.3033 0.1440 490 THR B CB 5766 O OG1 . THR D 124 ? 1.0455 1.2969 1.0769 0.1126 -0.3139 0.1631 490 THR B OG1 5767 C CG2 . THR D 124 ? 1.0363 1.3034 1.0066 0.1420 -0.2804 0.1567 490 THR B CG2 5768 N N . ILE D 125 ? 0.7511 0.9188 0.6659 0.1304 -0.3140 0.0733 491 ILE B N 5769 C CA . ILE D 125 ? 0.8049 0.9471 0.6751 0.1375 -0.3076 0.0506 491 ILE B CA 5770 C C . ILE D 125 ? 0.8312 0.9596 0.6937 0.1355 -0.3083 0.0358 491 ILE B C 5771 O O . ILE D 125 ? 0.8218 0.9466 0.6995 0.1186 -0.3201 0.0238 491 ILE B O 5772 C CB . ILE D 125 ? 0.7893 0.9141 0.6540 0.1291 -0.3185 0.0348 491 ILE B CB 5773 C CG1 . ILE D 125 ? 0.7457 0.8882 0.6159 0.1286 -0.3233 0.0587 491 ILE B CG1 5774 C CG2 . ILE D 125 ? 0.7466 0.8466 0.5667 0.1330 -0.3114 0.0092 491 ILE B CG2 5775 C CD1 . ILE D 125 ? 0.7480 0.8810 0.6263 0.1212 -0.3394 0.0519 491 ILE B CD1 5776 N N . THR D 126 ? 0.8872 1.0089 0.7286 0.1507 -0.2945 0.0373 492 THR B N 5777 C CA . THR D 126 ? 0.9086 1.0175 0.7436 0.1491 -0.2974 0.0334 492 THR B CA 5778 C C . THR D 126 ? 0.9178 0.9921 0.7194 0.1395 -0.2987 0.0052 492 THR B C 5779 O O . THR D 126 ? 0.9538 1.0109 0.7323 0.1441 -0.2905 -0.0106 492 THR B O 5780 C CB . THR D 126 ? 0.9320 1.0424 0.7728 0.1714 -0.2814 0.0488 492 THR B CB 5781 O OG1 . THR D 126 ? 0.9556 1.1033 0.8332 0.1801 -0.2770 0.0732 492 THR B OG1 5782 C CG2 . THR D 126 ? 0.8906 0.9924 0.7340 0.1684 -0.2906 0.0579 492 THR B CG2 5783 N N . LYS D 127 ? 0.8982 0.9672 0.6956 0.1223 -0.3091 -0.0011 493 LYS B N 5784 C CA . LYS D 127 ? 0.8591 0.9007 0.6294 0.1074 -0.3093 -0.0288 493 LYS B CA 5785 C C . LYS D 127 ? 0.9312 0.9445 0.6737 0.1149 -0.3000 -0.0274 493 LYS B C 5786 O O . LYS D 127 ? 0.9784 0.9970 0.7276 0.1199 -0.3025 -0.0025 493 LYS B O 5787 C CB . LYS D 127 ? 0.8125 0.8662 0.5896 0.0781 -0.3210 -0.0404 493 LYS B CB 5788 C CG . LYS D 127 ? 0.7867 0.8243 0.5570 0.0594 -0.3187 -0.0765 493 LYS B CG 5789 C CD . LYS D 127 ? 0.8131 0.8672 0.5919 0.0272 -0.3239 -0.0930 493 LYS B CD 5790 C CE . LYS D 127 ? 0.8814 0.9265 0.6772 0.0101 -0.3172 -0.1332 493 LYS B CE 5791 N NZ . LYS D 127 ? 0.9432 1.0043 0.7427 -0.0265 -0.3151 -0.1586 493 LYS B NZ 5792 N N . PRO D 128 ? 0.9540 0.9380 0.6716 0.1147 -0.2904 -0.0519 494 PRO B N 5793 C CA . PRO D 128 ? 0.9497 0.8995 0.6445 0.1178 -0.2798 -0.0546 494 PRO B CA 5794 C C . PRO D 128 ? 0.9345 0.8786 0.6150 0.0935 -0.2890 -0.0519 494 PRO B C 5795 O O . PRO D 128 ? 0.9546 0.9196 0.6369 0.0709 -0.2997 -0.0615 494 PRO B O 5796 C CB . PRO D 128 ? 0.9833 0.9111 0.6568 0.1163 -0.2698 -0.0866 494 PRO B CB 5797 C CG . PRO D 128 ? 1.0048 0.9598 0.6919 0.1202 -0.2757 -0.0896 494 PRO B CG 5798 C CD . PRO D 128 ? 0.9915 0.9749 0.7073 0.1118 -0.2903 -0.0747 494 PRO B CD 5799 N N . LEU D 129 ? 0.9294 0.8456 0.5972 0.0955 -0.2832 -0.0396 495 LEU B N 5800 C CA . LEU D 129 ? 0.9908 0.9032 0.6369 0.0679 -0.2923 -0.0310 495 LEU B CA 5801 C C . LEU D 129 ? 1.0557 0.9556 0.6752 0.0414 -0.2866 -0.0702 495 LEU B C 5802 O O . LEU D 129 ? 1.1328 1.0467 0.7343 0.0097 -0.2928 -0.0762 495 LEU B O 5803 C CB . LEU D 129 ? 1.0496 0.9319 0.6971 0.0781 -0.2883 -0.0003 495 LEU B CB 5804 C CG . LEU D 129 ? 1.0741 0.9753 0.7599 0.0997 -0.2976 0.0464 495 LEU B CG 5805 C CD1 . LEU D 129 ? 1.1344 0.9998 0.8350 0.1107 -0.2931 0.0782 495 LEU B CD1 5806 C CD2 . LEU D 129 ? 1.0528 1.0039 0.7374 0.0766 -0.3232 0.0690 495 LEU B CD2 5807 N N . LYS D 130 ? 1.0089 0.8875 0.6271 0.0518 -0.2738 -0.0983 496 LYS B N 5808 C CA . LYS D 130 ? 0.9475 0.8173 0.5519 0.0296 -0.2680 -0.1353 496 LYS B CA 5809 C C . LYS D 130 ? 0.9762 0.8384 0.5880 0.0440 -0.2614 -0.1601 496 LYS B C 5810 O O . LYS D 130 ? 1.0358 0.8949 0.6526 0.0680 -0.2575 -0.1504 496 LYS B O 5811 C CB . LYS D 130 ? 0.9713 0.8102 0.5471 0.0103 -0.2600 -0.1338 496 LYS B CB 5812 C CG . LYS D 130 ? 0.9679 0.7642 0.5405 0.0297 -0.2470 -0.1263 496 LYS B CG 5813 C CD . LYS D 130 ? 1.0153 0.7792 0.5672 0.0106 -0.2416 -0.1117 496 LYS B CD 5814 C CE . LYS D 130 ? 1.0828 0.8593 0.6351 0.0068 -0.2564 -0.0624 496 LYS B CE 5815 N NZ . LYS D 130 ? 1.0907 0.8359 0.6239 -0.0131 -0.2542 -0.0374 496 LYS B NZ 5816 N N . TYR D 131 ? 0.7827 0.7459 0.5230 0.1993 -0.1286 -0.1643 497 TYR B N 5817 C CA . TYR D 131 ? 0.7799 0.6997 0.5314 0.1969 -0.1223 -0.1528 497 TYR B CA 5818 C C . TYR D 131 ? 0.7943 0.7049 0.5041 0.1946 -0.1022 -0.1256 497 TYR B C 5819 O O . TYR D 131 ? 0.7631 0.7044 0.4423 0.1914 -0.0930 -0.1275 497 TYR B O 5820 C CB . TYR D 131 ? 0.7878 0.7105 0.5783 0.1975 -0.1303 -0.1889 497 TYR B CB 5821 C CG . TYR D 131 ? 0.8619 0.7779 0.7025 0.1992 -0.1543 -0.2161 497 TYR B CG 5822 C CD1 . TYR D 131 ? 0.8359 0.7047 0.7016 0.1926 -0.1704 -0.1968 497 TYR B CD1 5823 C CD2 . TYR D 131 ? 0.9099 0.8670 0.7711 0.2030 -0.1610 -0.2620 497 TYR B CD2 5824 C CE1 . TYR D 131 ? 0.8370 0.6908 0.7493 0.1895 -0.1951 -0.2171 497 TYR B CE1 5825 C CE2 . TYR D 131 ? 0.9020 0.8454 0.8144 0.2035 -0.1846 -0.2901 497 TYR B CE2 5826 C CZ . TYR D 131 ? 0.8830 0.7703 0.8220 0.1966 -0.2029 -0.2648 497 TYR B CZ 5827 O OH . TYR D 131 ? 0.9213 0.7866 0.9119 0.1927 -0.2291 -0.2882 497 TYR B OH 5828 N N . SER D 132 ? 0.8388 0.7078 0.5452 0.1919 -0.0955 -0.1010 498 SER B N 5829 C CA . SER D 132 ? 0.8516 0.7025 0.5239 0.1881 -0.0775 -0.0778 498 SER B CA 5830 C C . SER D 132 ? 0.8582 0.6773 0.5376 0.1788 -0.0719 -0.0749 498 SER B C 5831 O O . SER D 132 ? 0.8518 0.6513 0.5522 0.1753 -0.0813 -0.0746 498 SER B O 5832 C CB . SER D 132 ? 0.8170 0.6517 0.4736 0.1957 -0.0737 -0.0503 498 SER B CB 5833 O OG . SER D 132 ? 0.8755 0.7433 0.5246 0.2039 -0.0840 -0.0481 498 SER B OG 5834 N N . TYR D 133 ? 0.8791 0.6960 0.5382 0.1705 -0.0581 -0.0710 499 TYR B N 5835 C CA . TYR D 133 ? 0.8284 0.6198 0.4907 0.1594 -0.0535 -0.0677 499 TYR B CA 5836 C C . TYR D 133 ? 0.8261 0.6027 0.4556 0.1481 -0.0341 -0.0526 499 TYR B C 5837 O O . TYR D 133 ? 0.8328 0.6257 0.4394 0.1455 -0.0259 -0.0466 499 TYR B O 5838 C CB . TYR D 133 ? 0.7790 0.5918 0.4773 0.1580 -0.0663 -0.0930 499 TYR B CB 5839 C CG . TYR D 133 ? 0.8167 0.6760 0.5186 0.1565 -0.0577 -0.1161 499 TYR B CG 5840 C CD1 . TYR D 133 ? 0.8132 0.6833 0.5077 0.1425 -0.0438 -0.1176 499 TYR B CD1 5841 C CD2 . TYR D 133 ? 0.8367 0.7367 0.5497 0.1650 -0.0617 -0.1406 499 TYR B CD2 5842 C CE1 . TYR D 133 ? 0.8288 0.7534 0.5274 0.1357 -0.0319 -0.1418 499 TYR B CE1 5843 C CE2 . TYR D 133 ? 0.8281 0.7830 0.5418 0.1588 -0.0496 -0.1677 499 TYR B CE2 5844 C CZ . TYR D 133 ? 0.8147 0.7839 0.5217 0.1436 -0.0335 -0.1678 499 TYR B CZ 5845 O OH . TYR D 133 ? 0.7818 0.8168 0.4899 0.1323 -0.0175 -0.1973 499 TYR B OH 5846 N N . ILE D 134 ? 0.8256 0.5708 0.4502 0.1373 -0.0281 -0.0455 500 ILE B N 5847 C CA . ILE D 134 ? 0.8797 0.6031 0.4783 0.1228 -0.0109 -0.0344 500 ILE B CA 5848 C C . ILE D 134 ? 0.9503 0.7045 0.5551 0.1076 -0.0073 -0.0480 500 ILE B C 5849 O O . ILE D 134 ? 0.9554 0.7229 0.5864 0.1039 -0.0176 -0.0629 500 ILE B O 5850 C CB . ILE D 134 ? 0.9127 0.5964 0.5048 0.1141 -0.0046 -0.0299 500 ILE B CB 5851 C CG1 . ILE D 134 ? 0.8606 0.5288 0.4569 0.1283 -0.0053 -0.0250 500 ILE B CG1 5852 C CG2 . ILE D 134 ? 0.9918 0.6448 0.5608 0.0988 0.0124 -0.0214 500 ILE B CG2 5853 C CD1 . ILE D 134 ? 0.8604 0.5004 0.4497 0.1177 0.0059 -0.0289 500 ILE B CD1 5854 N N . ASN D 135 ? 1.0448 0.8140 0.6273 0.0971 0.0055 -0.0416 501 ASN B N 5855 C CA . ASN D 135 ? 1.0751 0.8882 0.6657 0.0789 0.0139 -0.0585 501 ASN B CA 5856 C C . ASN D 135 ? 1.0939 0.8829 0.6762 0.0553 0.0247 -0.0525 501 ASN B C 5857 O O . ASN D 135 ? 1.0931 0.9148 0.7025 0.0449 0.0231 -0.0725 501 ASN B O 5858 C CB . ASN D 135 ? 1.1727 1.0223 0.7355 0.0681 0.0255 -0.0536 501 ASN B CB 5859 C CG . ASN D 135 ? 1.2895 1.2105 0.8726 0.0519 0.0357 -0.0847 501 ASN B CG 5860 O OD1 . ASN D 135 ? 1.3918 1.3220 0.9672 0.0253 0.0506 -0.0826 501 ASN B OD1 5861 N ND2 . ASN D 135 ? 1.2813 1.2566 0.8958 0.0671 0.0285 -0.1185 501 ASN B ND2 5862 N N . LYS D 136 ? 1.1034 0.8360 0.6543 0.0476 0.0336 -0.0275 502 LYS B N 5863 C CA . LYS D 136 ? 1.1194 0.8195 0.6616 0.0238 0.0436 -0.0247 502 LYS B CA 5864 C C . LYS D 136 ? 1.0881 0.7225 0.6191 0.0318 0.0444 -0.0143 502 LYS B C 5865 O O . LYS D 136 ? 1.0830 0.6906 0.6063 0.0508 0.0423 0.0008 502 LYS B O 5866 C CB . LYS D 136 ? 1.2211 0.9228 0.7379 -0.0062 0.0599 -0.0105 502 LYS B CB 5867 C CG . LYS D 136 ? 1.2887 1.0689 0.8206 -0.0228 0.0664 -0.0302 502 LYS B CG 5868 C CD . LYS D 136 ? 1.4070 1.1890 0.9145 -0.0647 0.0855 -0.0175 502 LYS B CD 5869 C CE . LYS D 136 ? 1.4493 1.1894 0.9621 -0.0843 0.0885 -0.0201 502 LYS B CE 5870 N NZ . LYS D 136 ? 1.5199 1.2585 1.0121 -0.1304 0.1066 -0.0078 502 LYS B NZ 5871 N N . CYS D 137 ? 1.0502 0.6660 0.5840 0.0170 0.0471 -0.0263 503 CYS B N 5872 C CA . CYS D 137 ? 1.0464 0.6089 0.5723 0.0199 0.0528 -0.0280 503 CYS B CA 5873 C C . CYS D 137 ? 1.0392 0.5777 0.5562 -0.0109 0.0630 -0.0393 503 CYS B C 5874 O O . CYS D 137 ? 1.0607 0.6279 0.5832 -0.0266 0.0569 -0.0552 503 CYS B O 5875 C CB . CYS D 137 ? 1.0838 0.6607 0.6210 0.0351 0.0426 -0.0395 503 CYS B CB 5876 S SG . CYS D 137 ? 1.2055 0.7395 0.7351 0.0325 0.0554 -0.0547 503 CYS B SG 5877 N N . SER D 138 ? 1.0449 0.5286 0.5502 -0.0206 0.0750 -0.0301 504 SER B N 5878 C CA . SER D 138 ? 1.1099 0.5670 0.6081 -0.0544 0.0851 -0.0422 504 SER B CA 5879 C C . SER D 138 ? 1.1642 0.5465 0.6616 -0.0527 0.0951 -0.0503 504 SER B C 5880 O O . SER D 138 ? 1.1937 0.5409 0.6996 -0.0244 0.0938 -0.0396 504 SER B O 5881 C CB . SER D 138 ? 1.1762 0.6434 0.6660 -0.0822 0.0904 -0.0252 504 SER B CB 5882 O OG . SER D 138 ? 1.1948 0.7394 0.6954 -0.0824 0.0838 -0.0280 504 SER B OG 5883 N N . ARG D 139 ? 1.1821 0.5435 0.6754 -0.0824 0.1037 -0.0735 505 ARG B N 5884 C CA . ARG D 139 ? 1.2605 0.5464 0.7596 -0.0860 0.1147 -0.0894 505 ARG B CA 5885 C C . ARG D 139 ? 1.2980 0.5320 0.7919 -0.1153 0.1184 -0.0704 505 ARG B C 5886 O O . ARG D 139 ? 1.2717 0.5283 0.7563 -0.1536 0.1217 -0.0764 505 ARG B O 5887 C CB . ARG D 139 ? 1.2970 0.5917 0.7923 -0.1045 0.1229 -0.1342 505 ARG B CB 5888 C CG . ARG D 139 ? 1.2560 0.5767 0.7553 -0.0795 0.1248 -0.1552 505 ARG B CG 5889 C CD . ARG D 139 ? 1.2836 0.5493 0.8014 -0.0693 0.1410 -0.1899 505 ARG B CD 5890 N NE . ARG D 139 ? 1.3515 0.6067 0.8576 -0.1059 0.1531 -0.2323 505 ARG B NE 5891 C CZ . ARG D 139 ? 1.4127 0.5995 0.9378 -0.1119 0.1661 -0.2624 505 ARG B CZ 5892 N NH1 . ARG D 139 ? 1.4702 0.5884 1.0302 -0.0813 0.1652 -0.2492 505 ARG B NH1 5893 N NH2 . ARG D 139 ? 1.4403 0.6258 0.9519 -0.1489 0.1769 -0.3060 505 ARG B NH2 5894 N N . PHE D 140 ? 1.3457 0.5118 0.8477 -0.0995 0.1151 -0.0446 506 PHE B N 5895 C CA . PHE D 140 ? 1.3945 0.4961 0.8897 -0.1316 0.1158 -0.0208 506 PHE B CA 5896 C C . PHE D 140 ? 1.5486 0.5745 1.0633 -0.1434 0.1242 -0.0570 506 PHE B C 5897 O O . PHE D 140 ? 1.6053 0.5761 1.1485 -0.1109 0.1226 -0.0718 506 PHE B O 5898 C CB . PHE D 140 ? 1.4605 0.5179 0.9526 -0.1134 0.1018 0.0310 506 PHE B CB 5899 C CG . PHE D 140 ? 1.5166 0.5270 0.9880 -0.1570 0.0998 0.0703 506 PHE B CG 5900 C CD1 . PHE D 140 ? 1.5042 0.5755 0.9510 -0.2028 0.1102 0.0749 506 PHE B CD1 5901 C CD2 . PHE D 140 ? 1.6155 0.5229 1.0959 -0.1538 0.0861 0.1036 506 PHE B CD2 5902 C CE1 . PHE D 140 ? 1.6022 0.6382 1.0271 -0.2507 0.1114 0.1115 506 PHE B CE1 5903 C CE2 . PHE D 140 ? 1.7011 0.5612 1.1570 -0.2013 0.0823 0.1467 506 PHE B CE2 5904 C CZ . PHE D 140 ? 1.6917 0.6195 1.1165 -0.2527 0.0973 0.1506 506 PHE B CZ 5905 N N . LEU D 141 ? 1.5512 0.5800 1.0560 -0.1901 0.1331 -0.0765 507 LEU B N 5906 C CA . LEU D 141 ? 1.5958 0.5681 1.1167 -0.2076 0.1430 -0.1237 507 LEU B CA 5907 C C . LEU D 141 ? 1.6826 0.5339 1.2285 -0.2056 0.1384 -0.1115 507 LEU B C 5908 O O . LEU D 141 ? 1.7156 0.5246 1.2587 -0.1997 0.1249 -0.0568 507 LEU B O 5909 C CB . LEU D 141 ? 1.6220 0.6341 1.1261 -0.2623 0.1501 -0.1449 507 LEU B CB 5910 C CG . LEU D 141 ? 1.5645 0.6547 1.0597 -0.2674 0.1541 -0.1916 507 LEU B CG 5911 C CD1 . LEU D 141 ? 1.4113 0.5640 0.9030 -0.2235 0.1480 -0.1857 507 LEU B CD1 5912 C CD2 . LEU D 141 ? 1.5816 0.7397 1.0631 -0.3137 0.1516 -0.1935 507 LEU B CD2 5913 N N . SER D 142 ? 1.7342 0.5301 1.3049 -0.2124 0.1478 -0.1641 508 SER B N 5914 C CA . SER D 142 ? 1.8384 0.5517 1.4656 -0.1982 0.1345 -0.1604 508 SER B CA 5915 C C . SER D 142 ? 1.9136 0.5720 1.5324 -0.2447 0.1250 -0.1157 508 SER B C 5916 O O . SER D 142 ? 1.9960 0.5796 1.6547 -0.2339 0.1050 -0.0838 508 SER B O 5917 C CB . SER D 142 ? 1.8388 0.5580 1.5109 -0.1924 0.1420 -0.2331 508 SER B CB 5918 O OG . SER D 142 ? 1.8203 0.5927 1.4593 -0.2396 0.1567 -0.2684 508 SER B OG 5919 N N . ASP D 143 ? 1.8849 0.5873 1.4570 -0.2983 0.1372 -0.1123 509 ASP B N 5920 C CA . ASP D 143 ? 1.9580 0.6299 1.5194 -0.3519 0.1327 -0.0732 509 ASP B CA 5921 C C . ASP D 143 ? 2.0392 0.6931 1.5735 -0.3526 0.1198 0.0050 509 ASP B C 5922 O O . ASP D 143 ? 2.1370 0.7553 1.6708 -0.3901 0.1112 0.0480 509 ASP B O 5923 C CB . ASP D 143 ? 1.9116 0.6577 1.4387 -0.4089 0.1493 -0.0962 509 ASP B CB 5924 C CG . ASP D 143 ? 1.8534 0.7137 1.3502 -0.3954 0.1541 -0.0921 509 ASP B CG 5925 O OD1 . ASP D 143 ? 1.8197 0.7623 1.3120 -0.4135 0.1607 -0.1306 509 ASP B OD1 5926 O OD2 . ASP D 143 ? 1.8498 0.7329 1.3367 -0.3624 0.1463 -0.0498 509 ASP B OD2 5927 N N . ASP D 144 ? 2.0420 0.7287 1.5527 -0.3135 0.1178 0.0231 510 ASP B N 5928 C CA . ASP D 144 ? 2.1130 0.8221 1.5928 -0.3125 0.1055 0.0923 510 ASP B CA 5929 C C . ASP D 144 ? 2.1855 0.9777 1.6275 -0.3705 0.1184 0.1114 510 ASP B C 5930 O O . ASP D 144 ? 2.2108 1.0160 1.6202 -0.3925 0.1130 0.1679 510 ASP B O 5931 C CB . ASP D 144 ? 2.1916 0.8111 1.6977 -0.3038 0.0794 0.1448 510 ASP B CB 5932 C CG . ASP D 144 ? 2.1851 0.7638 1.7457 -0.2339 0.0612 0.1339 510 ASP B CG 5933 O OD1 . ASP D 144 ? 2.1296 0.7352 1.7065 -0.1987 0.0735 0.0770 510 ASP B OD1 5934 O OD2 . ASP D 144 ? 2.2474 0.7758 1.8393 -0.2159 0.0347 0.1825 510 ASP B OD2 5935 N N . ARG D 145 ? 2.2304 1.0858 1.6781 -0.3967 0.1351 0.0620 511 ARG B N 5936 C CA . ARG D 145 ? 2.2365 1.1786 1.6640 -0.4517 0.1481 0.0686 511 ARG B CA 5937 C C . ARG D 145 ? 2.1092 1.1851 1.5412 -0.4312 0.1547 0.0351 511 ARG B C 5938 O O . ARG D 145 ? 2.1005 1.2699 1.5228 -0.4565 0.1626 0.0449 511 ARG B O 5939 C CB . ARG D 145 ? 2.3408 1.2415 1.7785 -0.5108 0.1570 0.0438 511 ARG B CB 5940 C CG . ARG D 145 ? 2.5053 1.3318 1.9310 -0.5625 0.1533 0.0948 511 ARG B CG 5941 C CD . ARG D 145 ? 2.5918 1.3329 2.0250 -0.5220 0.1296 0.1464 511 ARG B CD 5942 N NE . ARG D 145 ? 2.5833 1.3720 1.9733 -0.5218 0.1266 0.2027 511 ARG B NE 5943 C CZ . ARG D 145 ? 2.6209 1.4484 1.9842 -0.5719 0.1295 0.2493 511 ARG B CZ 5944 N NH1 . ARG D 145 ? 2.6788 1.4945 2.0554 -0.6259 0.1350 0.2494 511 ARG B NH1 5945 N NH2 . ARG D 145 ? 2.5978 1.4827 1.9214 -0.5692 0.1275 0.2927 511 ARG B NH2 5946 N N . THR D 146 ? 1.9761 1.0618 1.4259 -0.3857 0.1505 -0.0044 512 THR B N 5947 C CA . THR D 146 ? 1.7532 0.9506 1.2109 -0.3707 0.1510 -0.0367 512 THR B CA 5948 C C . THR D 146 ? 1.6168 0.8456 1.0761 -0.3105 0.1419 -0.0329 512 THR B C 5949 O O . THR D 146 ? 1.6010 0.7672 1.0655 -0.2742 0.1372 -0.0348 512 THR B O 5950 C CB . THR D 146 ? 1.6967 0.8973 1.1675 -0.3851 0.1528 -0.0899 512 THR B CB 5951 O OG1 . THR D 146 ? 1.7575 0.8873 1.2299 -0.4339 0.1599 -0.0972 512 THR B OG1 5952 C CG2 . THR D 146 ? 1.6095 0.9280 1.0893 -0.3966 0.1489 -0.1115 512 THR B CG2 5953 N N . GLU D 147 ? 1.5024 0.8304 0.9640 -0.3005 0.1391 -0.0313 513 GLU B N 5954 C CA . GLU D 147 ? 1.4179 0.7815 0.8839 -0.2486 0.1292 -0.0310 513 GLU B CA 5955 C C . GLU D 147 ? 1.3521 0.7879 0.8349 -0.2389 0.1211 -0.0658 513 GLU B C 5956 O O . GLU D 147 ? 1.3093 0.8161 0.8058 -0.2623 0.1194 -0.0779 513 GLU B O 5957 C CB . GLU D 147 ? 1.3910 0.8033 0.8478 -0.2397 0.1283 0.0005 513 GLU B CB 5958 C CG . GLU D 147 ? 1.3245 0.7695 0.7878 -0.1887 0.1169 0.0003 513 GLU B CG 5959 C CD . GLU D 147 ? 1.3070 0.8380 0.7721 -0.1858 0.1167 0.0077 513 GLU B CD 5960 O OE1 . GLU D 147 ? 1.3531 0.9324 0.8182 -0.2232 0.1275 0.0072 513 GLU B OE1 5961 O OE2 . GLU D 147 ? 1.2444 0.7992 0.7140 -0.1481 0.1072 0.0095 513 GLU B OE2 5962 N N . VAL D 148 ? 1.3230 0.7432 0.8069 -0.2059 0.1143 -0.0805 514 VAL B N 5963 C CA . VAL D 148 ? 1.2688 0.7487 0.7611 -0.1996 0.1018 -0.1049 514 VAL B CA 5964 C C . VAL D 148 ? 1.2234 0.7314 0.7210 -0.1565 0.0900 -0.0954 514 VAL B C 5965 O O . VAL D 148 ? 1.2614 0.7306 0.7524 -0.1319 0.0924 -0.0964 514 VAL B O 5966 C CB . VAL D 148 ? 1.2934 0.7397 0.7750 -0.2137 0.1049 -0.1366 514 VAL B CB 5967 C CG1 . VAL D 148 ? 1.2170 0.7291 0.6983 -0.2152 0.0870 -0.1530 514 VAL B CG1 5968 C CG2 . VAL D 148 ? 1.3872 0.7976 0.8660 -0.2582 0.1160 -0.1503 514 VAL B CG2 5969 N N . PRO D 149 ? 1.1625 0.7405 0.6785 -0.1477 0.0773 -0.0902 515 PRO B N 5970 C CA . PRO D 149 ? 1.0819 0.6860 0.6077 -0.1100 0.0636 -0.0828 515 PRO B CA 5971 C C . PRO D 149 ? 1.0920 0.6932 0.6115 -0.1017 0.0516 -0.0944 515 PRO B C 5972 O O . PRO D 149 ? 1.1015 0.7171 0.6162 -0.1257 0.0443 -0.1096 515 PRO B O 5973 C CB . PRO D 149 ? 1.0391 0.7193 0.5963 -0.1096 0.0514 -0.0863 515 PRO B CB 5974 C CG . PRO D 149 ? 1.0857 0.7915 0.6524 -0.1468 0.0527 -0.1011 515 PRO B CG 5975 C CD . PRO D 149 ? 1.1425 0.7827 0.6796 -0.1734 0.0742 -0.0971 515 PRO B CD 5976 N N . GLN D 150 ? 1.1039 0.6915 0.6205 -0.0722 0.0494 -0.0864 516 GLN B N 5977 C CA . GLN D 150 ? 1.1057 0.6947 0.6114 -0.0695 0.0416 -0.0947 516 GLN B CA 5978 C C . GLN D 150 ? 1.0141 0.6474 0.5368 -0.0544 0.0154 -0.0840 516 GLN B C 5979 O O . GLN D 150 ? 0.9877 0.6218 0.5207 -0.0278 0.0122 -0.0734 516 GLN B O 5980 C CB . GLN D 150 ? 1.1441 0.6902 0.6411 -0.0509 0.0584 -0.0975 516 GLN B CB 5981 C CG . GLN D 150 ? 1.1817 0.6723 0.6715 -0.0619 0.0802 -0.1114 516 GLN B CG 5982 C CD . GLN D 150 ? 1.1938 0.6823 0.6658 -0.0960 0.0861 -0.1403 516 GLN B CD 5983 O OE1 . GLN D 150 ? 1.2844 0.7632 0.7535 -0.1228 0.0891 -0.1471 516 GLN B OE1 5984 N NE2 . GLN D 150 ? 1.1351 0.6380 0.5929 -0.0998 0.0887 -0.1588 516 GLN B NE2 5985 N N . LEU D 151 ? 0.9867 0.6548 0.5160 -0.0719 -0.0068 -0.0865 517 LEU B N 5986 C CA . LEU D 151 ? 0.9588 0.6596 0.5112 -0.0587 -0.0388 -0.0744 517 LEU B CA 5987 C C . LEU D 151 ? 0.9799 0.6683 0.5064 -0.0614 -0.0460 -0.0654 517 LEU B C 5988 O O . LEU D 151 ? 0.9738 0.6553 0.4646 -0.0879 -0.0394 -0.0728 517 LEU B O 5989 C CB . LEU D 151 ? 0.9625 0.7037 0.5375 -0.0752 -0.0666 -0.0768 517 LEU B CB 5990 C CG . LEU D 151 ? 0.9911 0.7620 0.5992 -0.0776 -0.0589 -0.0898 517 LEU B CG 5991 C CD1 . LEU D 151 ? 1.0451 0.8672 0.6920 -0.0869 -0.0927 -0.0941 517 LEU B CD1 5992 C CD2 . LEU D 151 ? 0.9565 0.7368 0.5916 -0.0487 -0.0486 -0.0900 517 LEU B CD2 5993 N N . VAL D 152 ? 1.0196 0.7098 0.5632 -0.0381 -0.0579 -0.0522 518 VAL B N 5994 C CA . VAL D 152 ? 1.0172 0.7004 0.5381 -0.0445 -0.0627 -0.0416 518 VAL B CA 5995 C C . VAL D 152 ? 1.0255 0.7261 0.5320 -0.0721 -0.0963 -0.0259 518 VAL B C 5996 O O . VAL D 152 ? 1.0530 0.7704 0.5913 -0.0682 -0.1298 -0.0158 518 VAL B O 5997 C CB . VAL D 152 ? 0.9959 0.6769 0.5427 -0.0160 -0.0695 -0.0312 518 VAL B CB 5998 C CG1 . VAL D 152 ? 0.9285 0.6266 0.5203 -0.0005 -0.1040 -0.0230 518 VAL B CG1 5999 C CG2 . VAL D 152 ? 1.0380 0.7160 0.5612 -0.0286 -0.0696 -0.0210 518 VAL B CG2 6000 N N . ASN D 153 ? 1.0129 0.7134 0.4729 -0.1014 -0.0883 -0.0249 519 ASN B N 6001 C CA . ASN D 153 ? 1.0602 0.7787 0.4924 -0.1357 -0.1218 -0.0035 519 ASN B CA 6002 C C . ASN D 153 ? 1.0744 0.7898 0.5106 -0.1358 -0.1493 0.0285 519 ASN B C 6003 O O . ASN D 153 ? 1.0339 0.7375 0.4878 -0.1137 -0.1348 0.0271 519 ASN B O 6004 C CB . ASN D 153 ? 1.1483 0.8776 0.5200 -0.1765 -0.0984 -0.0212 519 ASN B CB 6005 C CG . ASN D 153 ? 1.1755 0.9028 0.5440 -0.1835 -0.0779 -0.0523 519 ASN B CG 6006 O OD1 . ASN D 153 ? 1.1531 0.8859 0.5530 -0.1750 -0.0958 -0.0501 519 ASN B OD1 6007 N ND2 . ASN D 153 ? 1.1849 0.9062 0.5208 -0.2003 -0.0396 -0.0852 519 ASN B ND2 6008 N N . ALA D 154 ? 1.1799 0.9046 0.6003 -0.1632 -0.1924 0.0597 520 ALA B N 6009 C CA . ALA D 154 ? 1.2190 0.9329 0.6405 -0.1716 -0.2255 0.0975 520 ALA B CA 6010 C C . ALA D 154 ? 1.2513 0.9719 0.6232 -0.1985 -0.1933 0.0965 520 ALA B C 6011 O O . ALA D 154 ? 1.3073 1.0501 0.6271 -0.2288 -0.1617 0.0760 520 ALA B O 6012 C CB . ALA D 154 ? 1.2651 0.9844 0.6740 -0.2009 -0.2829 0.1371 520 ALA B CB 6013 N N . ASN D 155 ? 1.1383 0.8445 0.5318 -0.1880 -0.2001 0.1132 521 ASN B N 6014 C CA . ASN D 155 ? 1.1473 0.8684 0.5051 -0.2141 -0.1720 0.1131 521 ASN B CA 6015 C C . ASN D 155 ? 1.1197 0.8588 0.4718 -0.2005 -0.1123 0.0650 521 ASN B C 6016 O O . ASN D 155 ? 1.2471 1.0148 0.5641 -0.2289 -0.0818 0.0522 521 ASN B O 6017 C CB . ASN D 155 ? 1.1671 0.9106 0.4544 -0.2777 -0.1878 0.1430 521 ASN B CB 6018 C CG . ASN D 155 ? 1.2364 0.9565 0.5338 -0.2924 -0.2536 0.1979 521 ASN B CG 6019 O OD1 . ASN D 155 ? 1.2257 0.9105 0.5728 -0.2667 -0.2853 0.2192 521 ASN B OD1 6020 N ND2 . ASN D 155 ? 1.3634 1.1075 0.6420 -0.3265 -0.2693 0.2129 521 ASN B ND2 6021 N N . GLN D 156 ? 1.0201 0.7441 0.4099 -0.1584 -0.0968 0.0381 522 GLN B N 6022 C CA . GLN D 156 ? 1.0092 0.7381 0.4016 -0.1414 -0.0480 -0.0031 522 GLN B CA 6023 C C . GLN D 156 ? 0.9687 0.6770 0.4142 -0.0906 -0.0404 -0.0128 522 GLN B C 6024 O O . GLN D 156 ? 0.9826 0.6773 0.4605 -0.0690 -0.0681 0.0029 522 GLN B O 6025 C CB . GLN D 156 ? 1.0432 0.7738 0.4091 -0.1560 -0.0321 -0.0284 522 GLN B CB 6026 C CG . GLN D 156 ? 1.1655 0.9270 0.4695 -0.2105 -0.0300 -0.0300 522 GLN B CG 6027 C CD . GLN D 156 ? 1.2812 1.0449 0.5617 -0.2257 -0.0128 -0.0626 522 GLN B CD 6028 O OE1 . GLN D 156 ? 1.3136 1.0510 0.6257 -0.1961 0.0001 -0.0831 522 GLN B OE1 6029 N NE2 . GLN D 156 ? 1.3211 1.1174 0.5426 -0.2768 -0.0134 -0.0671 522 GLN B NE2 6030 N N . TYR D 157 ? 0.9478 0.6574 0.4037 -0.0723 -0.0041 -0.0403 523 TYR B N 6031 C CA . TYR D 157 ? 0.9207 0.6125 0.4175 -0.0285 0.0026 -0.0467 523 TYR B CA 6032 C C . TYR D 157 ? 0.9754 0.6438 0.4735 -0.0170 0.0128 -0.0603 523 TYR B C 6033 O O . TYR D 157 ? 1.0163 0.6826 0.4879 -0.0412 0.0198 -0.0720 523 TYR B O 6034 C CB . TYR D 157 ? 0.9209 0.6247 0.4361 -0.0120 0.0292 -0.0643 523 TYR B CB 6035 C CG . TYR D 157 ? 0.9229 0.6539 0.4453 -0.0223 0.0209 -0.0515 523 TYR B CG 6036 C CD1 . TYR D 157 ? 0.8561 0.5846 0.4112 0.0011 0.0016 -0.0365 523 TYR B CD1 6037 C CD2 . TYR D 157 ? 0.9402 0.7035 0.4351 -0.0603 0.0338 -0.0566 523 TYR B CD2 6038 C CE1 . TYR D 157 ? 0.8597 0.6103 0.4241 -0.0122 -0.0067 -0.0255 523 TYR B CE1 6039 C CE2 . TYR D 157 ? 0.9375 0.7272 0.4382 -0.0767 0.0272 -0.0425 523 TYR B CE2 6040 C CZ . TYR D 157 ? 0.9160 0.6958 0.4536 -0.0520 0.0060 -0.0263 523 TYR B CZ 6041 O OH . TYR D 157 ? 0.9772 0.7804 0.5231 -0.0719 -0.0015 -0.0128 523 TYR B OH 6042 N N . SER D 158 ? 1.0495 0.7027 0.5755 0.0152 0.0132 -0.0582 524 SER B N 6043 C CA . SER D 158 ? 1.0602 0.6891 0.5866 0.0224 0.0248 -0.0667 524 SER B CA 6044 C C . SER D 158 ? 1.0927 0.7000 0.6168 0.0260 0.0540 -0.0891 524 SER B C 6045 O O . SER D 158 ? 1.1014 0.7164 0.6399 0.0395 0.0652 -0.0974 524 SER B O 6046 C CB . SER D 158 ? 1.0778 0.7032 0.6276 0.0495 0.0165 -0.0547 524 SER B CB 6047 O OG . SER D 158 ? 1.1363 0.7384 0.6817 0.0497 0.0284 -0.0576 524 SER B OG 6048 N N . PRO D 159 ? 1.1455 0.7264 0.6584 0.0139 0.0656 -0.1022 525 PRO B N 6049 C CA . PRO D 159 ? 1.1597 0.7078 0.6817 0.0218 0.0905 -0.1267 525 PRO B CA 6050 C C . PRO D 159 ? 1.1595 0.6822 0.7125 0.0589 0.0906 -0.1137 525 PRO B C 6051 O O . PRO D 159 ? 1.1363 0.6348 0.7121 0.0758 0.1050 -0.1312 525 PRO B O 6052 C CB . PRO D 159 ? 1.1434 0.6638 0.6491 -0.0018 0.0956 -0.1370 525 PRO B CB 6053 C CG . PRO D 159 ? 1.1410 0.6969 0.6235 -0.0291 0.0765 -0.1267 525 PRO B CG 6054 C CD . PRO D 159 ? 1.1350 0.7177 0.6315 -0.0104 0.0548 -0.0991 525 PRO B CD 6055 N N . CYS D 160 ? 1.1771 0.7088 0.7331 0.0713 0.0727 -0.0851 526 CYS B N 6056 C CA . CYS D 160 ? 1.2009 0.7141 0.7756 0.1004 0.0678 -0.0666 526 CYS B CA 6057 C C . CYS D 160 ? 1.1918 0.7372 0.7882 0.1244 0.0594 -0.0614 526 CYS B C 6058 O O . CYS D 160 ? 1.2112 0.7535 0.8199 0.1471 0.0493 -0.0430 526 CYS B O 6059 C CB . CYS D 160 ? 1.2155 0.7292 0.7765 0.0947 0.0565 -0.0430 526 CYS B CB 6060 S SG . CYS D 160 ? 1.5262 1.0063 1.0673 0.0632 0.0663 -0.0462 526 CYS B SG 6061 N N . VAL D 161 ? 1.1471 0.7260 0.7456 0.1152 0.0625 -0.0758 527 VAL B N 6062 C CA . VAL D 161 ? 1.0504 0.6627 0.6727 0.1325 0.0565 -0.0737 527 VAL B CA 6063 C C . VAL D 161 ? 1.0022 0.6064 0.6599 0.1581 0.0689 -0.0886 527 VAL B C 6064 O O . VAL D 161 ? 0.9877 0.6199 0.6747 0.1781 0.0627 -0.0866 527 VAL B O 6065 C CB . VAL D 161 ? 0.9993 0.6497 0.6123 0.1081 0.0562 -0.0812 527 VAL B CB 6066 C CG1 . VAL D 161 ? 0.9794 0.6341 0.5700 0.0883 0.0359 -0.0644 527 VAL B CG1 6067 C CG2 . VAL D 161 ? 0.9351 0.5904 0.5382 0.0872 0.0803 -0.1097 527 VAL B CG2 6068 N N . SER D 162 ? 1.0201 0.5864 0.6818 0.1580 0.0845 -0.1063 528 SER B N 6069 C CA . SER D 162 ? 1.0672 0.6180 0.7751 0.1867 0.0939 -0.1256 528 SER B CA 6070 C C . SER D 162 ? 1.1302 0.6383 0.8548 0.2158 0.0743 -0.0950 528 SER B C 6071 O O . SER D 162 ? 1.2035 0.6974 0.9756 0.2474 0.0709 -0.1009 528 SER B O 6072 C CB . SER D 162 ? 1.1142 0.6392 0.8253 0.1735 0.1185 -0.1648 528 SER B CB 6073 O OG . SER D 162 ? 1.1311 0.6033 0.8127 0.1573 0.1158 -0.1535 528 SER B OG 6074 N N . ILE D 163 ? 1.0909 0.8386 0.6653 0.1022 0.0381 0.0899 529 ILE B N 6075 C CA . ILE D 163 ? 1.1647 0.8138 0.6593 0.1267 0.0399 0.0910 529 ILE B CA 6076 C C . ILE D 163 ? 1.1083 0.7736 0.6200 0.1255 0.0120 0.0974 529 ILE B C 6077 O O . ILE D 163 ? 1.1577 0.7514 0.6002 0.1532 0.0050 0.1012 529 ILE B O 6078 C CB . ILE D 163 ? 1.1962 0.7435 0.6144 0.0994 0.0788 0.0805 529 ILE B CB 6079 C CG1 . ILE D 163 ? 1.0999 0.6615 0.5486 0.0449 0.0837 0.0780 529 ILE B CG1 6080 C CG2 . ILE D 163 ? 1.2425 0.7753 0.6448 0.0923 0.1063 0.0665 529 ILE B CG2 6081 C CD1 . ILE D 163 ? 1.1280 0.5950 0.5229 0.0147 0.1222 0.0664 529 ILE B CD1 6082 N N . VAL D 164 ? 1.0138 0.7700 0.6140 0.0937 -0.0023 0.0989 530 VAL B N 6083 C CA . VAL D 164 ? 0.9846 0.7623 0.6122 0.0883 -0.0256 0.1000 530 VAL B CA 6084 C C . VAL D 164 ? 0.9529 0.8228 0.6631 0.1179 -0.0654 0.1027 530 VAL B C 6085 O O . VAL D 164 ? 0.9120 0.8757 0.7173 0.1093 -0.0684 0.1072 530 VAL B O 6086 C CB . VAL D 164 ? 0.8664 0.6803 0.5529 0.0318 -0.0115 0.1000 530 VAL B CB 6087 C CG1 . VAL D 164 ? 0.7967 0.6382 0.5225 0.0263 -0.0315 0.0978 530 VAL B CG1 6088 C CG2 . VAL D 164 ? 0.9177 0.6383 0.5366 0.0015 0.0260 0.0958 530 VAL B CG2 6089 N N . PRO D 165 ? 0.9695 0.8116 0.6439 0.1535 -0.0964 0.1002 531 PRO B N 6090 C CA . PRO D 165 ? 0.9131 0.8375 0.6700 0.1837 -0.1409 0.0987 531 PRO B CA 6091 C C . PRO D 165 ? 0.8135 0.8387 0.6910 0.1498 -0.1499 0.0941 531 PRO B C 6092 O O . PRO D 165 ? 0.7814 0.8003 0.6635 0.1056 -0.1271 0.0927 531 PRO B O 6093 C CB . PRO D 165 ? 0.9583 0.8130 0.6261 0.2166 -0.1731 0.0941 531 PRO B CB 6094 C CG . PRO D 165 ? 1.0427 0.7732 0.5765 0.2203 -0.1388 0.1006 531 PRO B CG 6095 C CD . PRO D 165 ? 1.0133 0.7385 0.5615 0.1676 -0.0913 0.0991 531 PRO B CD 6096 N N . SER D 166 ? 0.7777 0.8944 0.7622 0.1711 -0.1803 0.0929 532 SER B N 6097 C CA . SER D 166 ? 0.6837 0.8994 0.7976 0.1430 -0.1863 0.0896 532 SER B CA 6098 C C . SER D 166 ? 0.7056 0.8994 0.8021 0.1245 -0.2036 0.0723 532 SER B C 6099 O O . SER D 166 ? 0.6434 0.8948 0.8289 0.0896 -0.1953 0.0687 532 SER B O 6100 C CB . SER D 166 ? 0.6391 0.9499 0.8767 0.1741 -0.2123 0.0904 532 SER B CB 6101 O OG . SER D 166 ? 0.7267 1.0178 0.9413 0.2166 -0.2595 0.0786 532 SER B OG 6102 N N . THR D 167 ? 0.8020 0.9082 0.7803 0.1492 -0.2249 0.0626 533 THR B N 6103 C CA . THR D 167 ? 0.8182 0.8813 0.7461 0.1338 -0.2367 0.0440 533 THR B CA 6104 C C . THR D 167 ? 0.9075 0.8353 0.6620 0.1447 -0.2219 0.0468 533 THR B C 6105 O O . THR D 167 ? 0.9649 0.8417 0.6368 0.1893 -0.2447 0.0528 533 THR B O 6106 C CB . THR D 167 ? 0.8196 0.9328 0.7968 0.1602 -0.2958 0.0231 533 THR B CB 6107 O OG1 . THR D 167 ? 0.7486 0.9851 0.9004 0.1458 -0.3011 0.0197 533 THR B OG1 6108 C CG2 . THR D 167 ? 0.8756 0.9284 0.7725 0.1452 -0.3068 -0.0004 533 THR B CG2 6109 N N . VAL D 168 ? 0.8994 0.7683 0.6073 0.1048 -0.1800 0.0452 534 VAL B N 6110 C CA . VAL D 168 ? 0.9692 0.7038 0.5198 0.1113 -0.1544 0.0492 534 VAL B CA 6111 C C . VAL D 168 ? 1.1557 0.8324 0.6049 0.1397 -0.1910 0.0347 534 VAL B C 6112 O O . VAL D 168 ? 1.1839 0.8898 0.6661 0.1217 -0.2069 0.0135 534 VAL B O 6113 C CB . VAL D 168 ? 0.9501 0.6394 0.4962 0.0590 -0.0961 0.0507 534 VAL B CB 6114 C CG1 . VAL D 168 ? 1.0830 0.6275 0.4723 0.0671 -0.0629 0.0551 534 VAL B CG1 6115 C CG2 . VAL D 168 ? 0.8521 0.5979 0.4881 0.0314 -0.0686 0.0651 534 VAL B CG2 6116 N N . TRP D 169 ? 1.2397 0.8330 0.5638 0.1847 -0.2047 0.0462 535 TRP B N 6117 C CA . TRP D 169 ? 1.3909 0.9274 0.6022 0.2203 -0.2491 0.0375 535 TRP B CA 6118 C C . TRP D 169 ? 1.4883 0.9205 0.5821 0.1955 -0.2135 0.0272 535 TRP B C 6119 O O . TRP D 169 ? 1.4640 0.9017 0.5394 0.1888 -0.2407 0.0029 535 TRP B O 6120 C CB . TRP D 169 ? 1.5252 0.9975 0.6375 0.2774 -0.2683 0.0609 535 TRP B CB 6121 C CG . TRP D 169 ? 1.6952 1.1513 0.7382 0.3203 -0.3307 0.0552 535 TRP B CG 6122 C CD1 . TRP D 169 ? 1.8576 1.2218 0.7733 0.3254 -0.3243 0.0503 535 TRP B CD1 6123 C CD2 . TRP D 169 ? 1.6713 1.2228 0.8121 0.3515 -0.3930 0.0503 535 TRP B CD2 6124 N NE1 . TRP D 169 ? 1.8770 1.2738 0.7945 0.3586 -0.3856 0.0436 535 TRP B NE1 6125 C CE2 . TRP D 169 ? 1.7997 1.3113 0.8589 0.3731 -0.4277 0.0431 535 TRP B CE2 6126 C CE3 . TRP D 169 ? 1.5253 1.1914 0.8211 0.3608 -0.4173 0.0520 535 TRP B CE3 6127 C CZ2 . TRP D 169 ? 1.8188 1.4016 0.9464 0.4016 -0.4898 0.0378 535 TRP B CZ2 6128 C CZ3 . TRP D 169 ? 1.5400 1.2743 0.9113 0.3871 -0.4700 0.0462 535 TRP B CZ3 6129 C CH2 . TRP D 169 ? 1.6927 1.3856 0.9801 0.4066 -0.5082 0.0394 535 TRP B CH2 6130 N N . GLU D 170 ? 1.6572 0.9917 0.6752 0.1810 -0.1493 0.0436 536 GLU B N 6131 C CA . GLU D 170 ? 1.7744 0.9968 0.6821 0.1581 -0.1014 0.0378 536 GLU B CA 6132 C C . GLU D 170 ? 1.6763 0.8956 0.6614 0.1022 -0.0305 0.0404 536 GLU B C 6133 O O . GLU D 170 ? 1.6209 0.8596 0.6621 0.0943 -0.0075 0.0557 536 GLU B O 6134 C CB . GLU D 170 ? 1.9982 1.0858 0.7345 0.1989 -0.0861 0.0572 536 GLU B CB 6135 C CG . GLU D 170 ? 2.1590 1.1370 0.8020 0.1796 -0.0333 0.0498 536 GLU B CG 6136 C CD . GLU D 170 ? 2.2878 1.2617 0.8672 0.1899 -0.0763 0.0272 536 GLU B CD 6137 O OE1 . GLU D 170 ? 2.3874 1.2793 0.8965 0.1694 -0.0335 0.0175 536 GLU B OE1 6138 O OE2 . GLU D 170 ? 2.2872 1.3410 0.8952 0.2177 -0.1522 0.0178 536 GLU B OE2 6139 N N . ASP D 171 ? 1.6884 0.8831 0.6792 0.0630 0.0030 0.0241 537 ASP B N 6140 C CA . ASP D 171 ? 1.5984 0.7934 0.6768 0.0090 0.0673 0.0277 537 ASP B CA 6141 C C . ASP D 171 ? 1.6787 0.7548 0.6702 0.0098 0.1265 0.0477 537 ASP B C 6142 O O . ASP D 171 ? 1.8420 0.7898 0.6895 0.0251 0.1582 0.0507 537 ASP B O 6143 C CB . ASP D 171 ? 1.6455 0.8256 0.7443 -0.0295 0.0964 0.0066 537 ASP B CB 6144 C CG . ASP D 171 ? 1.6052 0.8052 0.8271 -0.0859 0.1564 0.0129 537 ASP B CG 6145 O OD1 . ASP D 171 ? 1.4868 0.8101 0.8693 -0.1125 0.1403 0.0120 537 ASP B OD1 6146 O OD2 . ASP D 171 ? 1.6782 0.7703 0.8414 -0.1025 0.2201 0.0208 537 ASP B OD2 6147 N N . GLY D 172 ? 1.5555 0.6724 0.6335 -0.0067 0.1424 0.0603 538 GLY B N 6148 C CA . GLY D 172 ? 1.5904 0.6055 0.6105 -0.0097 0.1972 0.0750 538 GLY B CA 6149 C C . GLY D 172 ? 1.6216 0.6227 0.5878 0.0371 0.1738 0.0853 538 GLY B C 6150 O O . GLY D 172 ? 1.6998 0.6394 0.6378 0.0479 0.2079 0.0810 538 GLY B O 6151 N N . ASP D 173 ? 1.5799 0.6690 0.5764 0.0655 0.1129 0.0871 539 ASP B N 6152 C CA . ASP D 173 ? 1.6413 0.7170 0.5917 0.1119 0.0917 0.1002 539 ASP B CA 6153 C C . ASP D 173 ? 1.6279 0.7098 0.6362 0.0906 0.1258 0.1042 539 ASP B C 6154 O O . ASP D 173 ? 1.5387 0.6786 0.6509 0.0419 0.1433 0.0966 539 ASP B O 6155 C CB . ASP D 173 ? 1.5821 0.7676 0.5878 0.1439 0.0203 0.0966 539 ASP B CB 6156 C CG . ASP D 173 ? 1.6602 0.8076 0.5630 0.1885 -0.0237 0.0968 539 ASP B CG 6157 O OD1 . ASP D 173 ? 1.7370 0.7834 0.5402 0.2026 0.0023 0.0989 539 ASP B OD1 6158 O OD2 . ASP D 173 ? 1.6313 0.8727 0.5947 0.2048 -0.0839 0.0870 539 ASP B OD2 6159 N N . TYR D 174 ? 1.6814 0.7184 0.6424 0.1264 0.1313 0.1098 540 TYR B N 6160 C CA . TYR D 174 ? 1.5949 0.6178 0.5902 0.1089 0.1673 0.1072 540 TYR B CA 6161 C C . TYR D 174 ? 1.5209 0.5940 0.5355 0.1378 0.1383 0.1155 540 TYR B C 6162 O O . TYR D 174 ? 1.5635 0.6419 0.5396 0.1883 0.1021 0.1256 540 TYR B O 6163 C CB . TYR D 174 ? 1.6963 0.6180 0.6301 0.1215 0.2141 0.0996 540 TYR B CB 6164 C CG . TYR D 174 ? 1.6998 0.6024 0.6661 0.1008 0.2541 0.0902 540 TYR B CG 6165 C CD1 . TYR D 174 ? 1.5954 0.5455 0.6515 0.0456 0.2711 0.0770 540 TYR B CD1 6166 C CD2 . TYR D 174 ? 1.7740 0.6155 0.6861 0.1357 0.2736 0.0935 540 TYR B CD2 6167 C CE1 . TYR D 174 ? 1.6171 0.5556 0.7029 0.0250 0.3011 0.0645 540 TYR B CE1 6168 C CE2 . TYR D 174 ? 1.7802 0.6022 0.7185 0.1144 0.3117 0.0819 540 TYR B CE2 6169 C CZ . TYR D 174 ? 1.7430 0.6135 0.7657 0.0583 0.3232 0.0659 540 TYR B CZ 6170 O OH . TYR D 174 ? 1.8102 0.6680 0.8617 0.0349 0.3545 0.0512 540 TYR B OH 6171 N N . TYR D 175 ? 1.4159 0.5416 0.5104 0.1045 0.1515 0.1045 541 TYR B N 6172 C CA . TYR D 175 ? 1.3793 0.5651 0.5123 0.1259 0.1320 0.1024 541 TYR B CA 6173 C C . TYR D 175 ? 1.3893 0.5336 0.5235 0.1026 0.1741 0.0906 541 TYR B C 6174 O O . TYR D 175 ? 1.3502 0.4767 0.5092 0.0544 0.2026 0.0802 541 TYR B O 6175 C CB . TYR D 175 ? 1.2842 0.6120 0.5282 0.1101 0.0913 0.0975 541 TYR B CB 6176 C CG . TYR D 175 ? 1.3179 0.6931 0.5825 0.1184 0.0534 0.1014 541 TYR B CG 6177 C CD1 . TYR D 175 ? 1.4178 0.7909 0.6445 0.1705 0.0152 0.1092 541 TYR B CD1 6178 C CD2 . TYR D 175 ? 1.1898 0.6120 0.5170 0.0735 0.0546 0.0959 541 TYR B CD2 6179 C CE1 . TYR D 175 ? 1.3954 0.8109 0.6396 0.1757 -0.0231 0.1065 541 TYR B CE1 6180 C CE2 . TYR D 175 ? 1.1460 0.6078 0.4938 0.0788 0.0236 0.0941 541 TYR B CE2 6181 C CZ . TYR D 175 ? 1.2977 0.7557 0.6007 0.1289 -0.0165 0.0969 541 TYR B CZ 6182 O OH . TYR D 175 ? 1.3340 0.8309 0.6564 0.1320 -0.0512 0.0891 541 TYR B OH 6183 N N . ARG D 176 ? 1.4556 0.5837 0.5686 0.1361 0.1781 0.0904 542 ARG B N 6184 C CA . ARG D 176 ? 1.5220 0.6083 0.6321 0.1159 0.2176 0.0733 542 ARG B CA 6185 C C . ARG D 176 ? 1.5758 0.6983 0.7011 0.1463 0.2100 0.0689 542 ARG B C 6186 O O . ARG D 176 ? 1.6258 0.7629 0.7422 0.1967 0.1855 0.0853 542 ARG B O 6187 C CB . ARG D 176 ? 1.6157 0.5604 0.6434 0.1250 0.2677 0.0766 542 ARG B CB 6188 C CG . ARG D 176 ? 1.6985 0.5700 0.6447 0.1905 0.2672 0.1011 542 ARG B CG 6189 C CD . ARG D 176 ? 1.8021 0.5693 0.6927 0.1943 0.3185 0.0981 542 ARG B CD 6190 N NE . ARG D 176 ? 1.8429 0.5734 0.6726 0.2527 0.3113 0.1175 542 ARG B NE 6191 C CZ . ARG D 176 ? 1.9542 0.6537 0.7635 0.2936 0.3215 0.1277 542 ARG B CZ 6192 N NH1 . ARG D 176 ? 1.9980 0.6915 0.8386 0.2833 0.3433 0.1158 542 ARG B NH1 6193 N NH2 . ARG D 176 ? 1.9982 0.6721 0.7594 0.3438 0.3103 0.1482 542 ARG B NH2 6194 N N . LYS D 177 ? 1.5955 0.7310 0.7453 0.1149 0.2310 0.0457 543 LYS B N 6195 C CA . LYS D 177 ? 1.6384 0.7999 0.7989 0.1384 0.2346 0.0370 543 LYS B CA 6196 C C . LYS D 177 ? 1.7105 0.7999 0.8403 0.1168 0.2812 0.0091 543 LYS B C 6197 O O . LYS D 177 ? 1.6707 0.7588 0.8132 0.0638 0.2919 -0.0123 543 LYS B O 6198 C CB . LYS D 177 ? 1.5741 0.8649 0.8095 0.1216 0.2015 0.0341 543 LYS B CB 6199 C CG . LYS D 177 ? 1.6082 0.9267 0.8560 0.1443 0.2117 0.0250 543 LYS B CG 6200 C CD . LYS D 177 ? 1.5120 0.9534 0.8306 0.1278 0.1848 0.0265 543 LYS B CD 6201 C CE . LYS D 177 ? 1.5461 1.0085 0.8738 0.1518 0.2031 0.0181 543 LYS B CE 6202 N NZ . LYS D 177 ? 1.4727 1.0496 0.8670 0.1394 0.1832 0.0241 543 LYS B NZ 6203 N N . GLN D 178 ? 1.8460 0.8759 0.9425 0.1576 0.3080 0.0083 544 GLN B N 6204 C CA . GLN D 178 ? 1.9089 0.8713 0.9806 0.1397 0.3550 -0.0233 544 GLN B CA 6205 C C . GLN D 178 ? 1.8855 0.9283 0.9896 0.1085 0.3471 -0.0509 544 GLN B C 6206 O O . GLN D 178 ? 1.8676 0.9704 0.9954 0.1369 0.3347 -0.0435 544 GLN B O 6207 C CB . GLN D 178 ? 2.0527 0.9289 1.0873 0.1954 0.3898 -0.0135 544 GLN B CB 6208 C CG . GLN D 178 ? 2.1802 0.9817 1.1938 0.1788 0.4445 -0.0500 544 GLN B CG 6209 C CD . GLN D 178 ? 2.2096 0.9307 1.2033 0.1376 0.4761 -0.0674 544 GLN B CD 6210 O OE1 . GLN D 178 ? 2.1817 0.8737 1.1647 0.1404 0.4721 -0.0407 544 GLN B OE1 6211 N NE2 . GLN D 178 ? 2.2456 0.9652 1.2574 0.0927 0.4978 -0.1045 544 GLN B NE2 6212 N N . LEU D 179 ? 1.8876 0.9306 0.9934 0.0505 0.3540 -0.0817 545 LEU B N 6213 C CA . LEU D 179 ? 1.7965 0.9086 0.9151 0.0180 0.3446 -0.1084 545 LEU B CA 6214 C C . LEU D 179 ? 1.7951 0.8361 0.8702 0.0167 0.3902 -0.1469 545 LEU B C 6215 O O . LEU D 179 ? 1.7586 0.7030 0.8074 0.0048 0.4258 -0.1678 545 LEU B O 6216 C CB . LEU D 179 ? 1.5253 0.6875 0.6724 -0.0451 0.3177 -0.1204 545 LEU B CB 6217 C CG . LEU D 179 ? 1.4206 0.6612 0.6215 -0.0518 0.2761 -0.0863 545 LEU B CG 6218 C CD1 . LEU D 179 ? 1.3695 0.6688 0.6098 -0.1137 0.2507 -0.0975 545 LEU B CD1 6219 C CD2 . LEU D 179 ? 1.3570 0.6844 0.5873 -0.0135 0.2503 -0.0595 545 LEU B CD2 6220 N N . SER D 180 ? 1.7726 0.8579 0.8428 0.0289 0.3942 -0.1570 546 SER B N 6221 C CA . SER D 180 ? 1.8989 0.9209 0.9250 0.0253 0.4403 -0.1982 546 SER B CA 6222 C C . SER D 180 ? 1.9693 0.9744 0.9697 -0.0409 0.4401 -0.2448 546 SER B C 6223 O O . SER D 180 ? 1.9129 0.9875 0.9357 -0.0820 0.3973 -0.2415 546 SER B O 6224 C CB . SER D 180 ? 1.8779 0.9565 0.9048 0.0495 0.4463 -0.1981 546 SER B CB 6225 O OG . SER D 180 ? 1.7939 0.9747 0.8323 0.0161 0.4076 -0.1968 546 SER B OG 6226 N N . PRO D 181 ? 2.0665 1.0034 1.0527 -0.0524 0.4757 -0.2781 547 PRO B N 6227 C CA . PRO D 181 ? 2.1136 1.0477 1.0941 -0.1144 0.4672 -0.3220 547 PRO B CA 6228 C C . PRO D 181 ? 2.0943 1.1115 1.0456 -0.1499 0.4322 -0.3429 547 PRO B C 6229 O O . PRO D 181 ? 2.1076 1.1465 1.0578 -0.2043 0.4029 -0.3686 547 PRO B O 6230 C CB . PRO D 181 ? 2.2282 1.0952 1.2054 -0.1056 0.5125 -0.3467 547 PRO B CB 6231 C CG . PRO D 181 ? 2.2285 1.0419 1.2237 -0.0471 0.5438 -0.3068 547 PRO B CG 6232 C CD . PRO D 181 ? 2.1350 1.0020 1.1271 -0.0078 0.5206 -0.2694 547 PRO B CD 6233 N N . LEU D 182 ? 2.0857 1.1509 1.0182 -0.1182 0.4350 -0.3283 548 LEU B N 6234 C CA . LEU D 182 ? 2.0786 1.2281 0.9815 -0.1442 0.4047 -0.3362 548 LEU B CA 6235 C C . LEU D 182 ? 1.9829 1.2148 0.9182 -0.1682 0.3515 -0.3058 548 LEU B C 6236 O O . LEU D 182 ? 1.9780 1.2729 0.8990 -0.2100 0.3142 -0.3149 548 LEU B O 6237 C CB . LEU D 182 ? 2.0673 1.2478 0.9603 -0.0983 0.4281 -0.3193 548 LEU B CB 6238 C CG . LEU D 182 ? 2.0634 1.3273 0.9237 -0.1167 0.4063 -0.3207 548 LEU B CG 6239 C CD1 . LEU D 182 ? 2.1786 1.4258 0.9871 -0.1622 0.4003 -0.3692 548 LEU B CD1 6240 C CD2 . LEU D 182 ? 2.0656 1.3518 0.9328 -0.0658 0.4396 -0.2992 548 LEU B CD2 6241 N N . GLU D 183 ? 1.9323 1.1751 0.9297 -0.1393 0.3415 -0.2622 549 GLU B N 6242 C CA . GLU D 183 ? 1.8835 1.2115 0.9431 -0.1571 0.2912 -0.2251 549 GLU B CA 6243 C C . GLU D 183 ? 1.9033 1.2021 0.9866 -0.2059 0.2748 -0.2403 549 GLU B C 6244 O O . GLU D 183 ? 1.8151 1.1685 0.9583 -0.2227 0.2407 -0.2112 549 GLU B O 6245 C CB . GLU D 183 ? 1.8405 1.1896 0.9522 -0.1070 0.2876 -0.1768 549 GLU B CB 6246 C CG . GLU D 183 ? 1.8377 1.2381 0.9580 -0.0606 0.2943 -0.1550 549 GLU B CG 6247 C CD . GLU D 183 ? 1.7854 1.1994 0.9588 -0.0114 0.2860 -0.1138 549 GLU B CD 6248 O OE1 . GLU D 183 ? 1.8098 1.1525 0.9784 0.0024 0.2958 -0.1093 549 GLU B OE1 6249 O OE2 . GLU D 183 ? 1.7113 1.2055 0.9304 0.0134 0.2694 -0.0862 549 GLU B OE2 6250 N N . GLY D 184 ? 1.9983 1.2090 1.0436 -0.2289 0.3031 -0.2871 550 GLY B N 6251 C CA . GLY D 184 ? 1.9982 1.1729 1.0770 -0.2755 0.2942 -0.3060 550 GLY B CA 6252 C C . GLY D 184 ? 2.0019 1.0773 1.0977 -0.2514 0.3357 -0.2978 550 GLY B C 6253 O O . GLY D 184 ? 2.0071 1.0395 1.1396 -0.2841 0.3399 -0.3092 550 GLY B O 6254 N N . GLY D 185 ? 2.1068 1.1447 1.1785 -0.1925 0.3673 -0.2755 551 GLY B N 6255 C CA . GLY D 185 ? 1.7846 0.7245 0.8574 -0.1608 0.4075 -0.2609 551 GLY B CA 6256 C C . GLY D 185 ? 1.7532 0.7096 0.8727 -0.1626 0.3876 -0.2217 551 GLY B C 6257 O O . GLY D 185 ? 1.6160 0.6690 0.7740 -0.1764 0.3428 -0.1984 551 GLY B O 6258 N N . GLY D 186 ? 1.7886 0.6500 0.9065 -0.1479 0.4248 -0.2123 552 GLY B N 6259 C CA . GLY D 186 ? 1.7658 0.6217 0.9140 -0.1479 0.4176 -0.1780 552 GLY B CA 6260 C C . GLY D 186 ? 1.7298 0.6319 0.8675 -0.0990 0.3937 -0.1326 552 GLY B C 6261 O O . GLY D 186 ? 1.7219 0.6400 0.8315 -0.0551 0.3918 -0.1234 552 GLY B O 6262 N N . TRP D 187 ? 1.6987 0.6250 0.8675 -0.1076 0.3757 -0.1055 553 TRP B N 6263 C CA . TRP D 187 ? 1.6335 0.6031 0.7965 -0.0655 0.3498 -0.0661 553 TRP B CA 6264 C C . TRP D 187 ? 1.5353 0.6267 0.7625 -0.0936 0.3013 -0.0540 553 TRP B C 6265 O O . TRP D 187 ? 1.5049 0.6337 0.7822 -0.1463 0.2903 -0.0679 553 TRP B O 6266 C CB . TRP D 187 ? 1.6539 0.5305 0.7814 -0.0410 0.3770 -0.0414 553 TRP B CB 6267 C CG . TRP D 187 ? 1.7573 0.5333 0.8271 -0.0011 0.4206 -0.0380 553 TRP B CG 6268 C CD1 . TRP D 187 ? 1.7949 0.5418 0.8824 -0.0203 0.4573 -0.0522 553 TRP B CD1 6269 C CD2 . TRP D 187 ? 1.7789 0.5167 0.7918 0.0648 0.4222 -0.0111 553 TRP B CD2 6270 N NE1 . TRP D 187 ? 1.8636 0.5527 0.9062 0.0264 0.4859 -0.0346 553 TRP B NE1 6271 C CE2 . TRP D 187 ? 1.8566 0.5409 0.8528 0.0793 0.4634 -0.0082 553 TRP B CE2 6272 C CE3 . TRP D 187 ? 1.7161 0.5045 0.7172 0.1093 0.3821 0.0157 553 TRP B CE3 6273 C CZ2 . TRP D 187 ? 1.9304 0.5711 0.8781 0.1394 0.4735 0.0184 553 TRP B CZ2 6274 C CZ3 . TRP D 187 ? 1.8020 0.5348 0.7515 0.1722 0.3898 0.0399 553 TRP B CZ3 6275 C CH2 . TRP D 187 ? 1.9091 0.5664 0.8296 0.1871 0.4361 0.0416 553 TRP B CH2 6276 N N . LEU D 188 ? 1.4703 0.6243 0.7036 -0.0576 0.2717 -0.0275 554 LEU B N 6277 C CA . LEU D 188 ? 1.3573 0.6189 0.6569 -0.0777 0.2315 -0.0111 554 LEU B CA 6278 C C . LEU D 188 ? 1.4229 0.6666 0.7142 -0.0509 0.2250 0.0154 554 LEU B C 6279 O O . LEU D 188 ? 1.4680 0.7160 0.7323 -0.0018 0.2115 0.0306 554 LEU B O 6280 C CB . LEU D 188 ? 1.3036 0.6690 0.6313 -0.0641 0.2013 -0.0079 554 LEU B CB 6281 C CG . LEU D 188 ? 1.1892 0.6711 0.5945 -0.0816 0.1630 0.0116 554 LEU B CG 6282 C CD1 . LEU D 188 ? 1.1530 0.6676 0.6088 -0.1420 0.1561 0.0050 554 LEU B CD1 6283 C CD2 . LEU D 188 ? 1.1017 0.6717 0.5308 -0.0601 0.1436 0.0172 554 LEU B CD2 6284 N N . VAL D 189 ? 1.4493 0.6705 0.7644 -0.0836 0.2347 0.0196 555 VAL B N 6285 C CA . VAL D 189 ? 1.4317 0.6178 0.7225 -0.0624 0.2361 0.0400 555 VAL B CA 6286 C C . VAL D 189 ? 1.3045 0.5858 0.6742 -0.0883 0.2065 0.0509 555 VAL B C 6287 O O . VAL D 189 ? 1.2170 0.5730 0.6651 -0.1312 0.1941 0.0462 555 VAL B O 6288 C CB . VAL D 189 ? 1.4806 0.5405 0.7254 -0.0729 0.2857 0.0383 555 VAL B CB 6289 C CG1 . VAL D 189 ? 1.5796 0.5397 0.7503 -0.0429 0.3201 0.0304 555 VAL B CG1 6290 C CG2 . VAL D 189 ? 1.4140 0.5231 0.7527 -0.1287 0.2919 0.0196 555 VAL B CG2 6291 N N . ALA D 190 ? 1.2906 0.5677 0.6386 -0.0614 0.1943 0.0656 556 ALA B N 6292 C CA . ALA D 190 ? 1.1891 0.5464 0.6118 -0.0836 0.1720 0.0737 556 ALA B CA 6293 C C . ALA D 190 ? 1.2454 0.5467 0.6131 -0.0607 0.1756 0.0819 556 ALA B C 6294 O O . ALA D 190 ? 1.3274 0.5471 0.5963 -0.0176 0.1818 0.0861 556 ALA B O 6295 C CB . ALA D 190 ? 1.0594 0.5433 0.5502 -0.0739 0.1286 0.0781 556 ALA B CB 6296 N N . SER D 191 ? 1.1665 0.5103 0.5965 -0.0895 0.1723 0.0845 557 SER B N 6297 C CA . SER D 191 ? 1.1949 0.4918 0.5728 -0.0731 0.1746 0.0871 557 SER B CA 6298 C C . SER D 191 ? 1.0966 0.5041 0.5590 -0.0790 0.1363 0.0867 557 SER B C 6299 O O . SER D 191 ? 1.0035 0.5013 0.5809 -0.1162 0.1312 0.0889 557 SER B O 6300 C CB . SER D 191 ? 1.2182 0.4665 0.6085 -0.0973 0.2166 0.0744 557 SER B CB 6301 O OG . SER D 191 ? 1.2741 0.4796 0.6110 -0.0853 0.2214 0.0732 557 SER B OG 6302 N N . GLY D 192 ? 1.1598 0.5598 0.5679 -0.0418 0.1085 0.0844 558 GLY B N 6303 C CA . GLY D 192 ? 1.0753 0.5760 0.5654 -0.0447 0.0716 0.0793 558 GLY B CA 6304 C C . GLY D 192 ? 1.0839 0.5435 0.5540 -0.0608 0.0867 0.0699 558 GLY B C 6305 O O . GLY D 192 ? 1.2003 0.5443 0.5495 -0.0463 0.1100 0.0678 558 GLY B O 6306 N N . SER D 193 ? 0.9636 0.5138 0.5507 -0.0905 0.0779 0.0649 559 SER B N 6307 C CA . SER D 193 ? 1.0193 0.5388 0.6010 -0.1087 0.0942 0.0514 559 SER B CA 6308 C C . SER D 193 ? 0.9659 0.5831 0.6205 -0.0996 0.0480 0.0374 559 SER B C 6309 O O . SER D 193 ? 0.8947 0.6257 0.6616 -0.0992 0.0193 0.0438 559 SER B O 6310 C CB . SER D 193 ? 1.0119 0.5309 0.6837 -0.1642 0.1452 0.0571 559 SER B CB 6311 O OG . SER D 193 ? 1.1105 0.5360 0.7257 -0.1750 0.1890 0.0664 559 SER B OG 6312 N N . THR D 194 ? 1.0583 0.6269 0.6472 -0.0925 0.0432 0.0169 560 THR B N 6313 C CA . THR D 194 ? 1.0066 0.6586 0.6607 -0.0846 -0.0021 -0.0037 560 THR B CA 6314 C C . THR D 194 ? 0.9952 0.6500 0.7108 -0.1264 0.0292 -0.0221 560 THR B C 6315 O O . THR D 194 ? 1.1095 0.6657 0.7585 -0.1482 0.0809 -0.0249 560 THR B O 6316 C CB . THR D 194 ? 1.1459 0.7511 0.6699 -0.0343 -0.0526 -0.0193 560 THR B CB 6317 O OG1 . THR D 194 ? 1.2982 0.7730 0.6722 -0.0342 -0.0245 -0.0309 560 THR B OG1 6318 C CG2 . THR D 194 ? 1.2309 0.8229 0.6950 0.0094 -0.0773 0.0011 560 THR B CG2 6319 N N . VAL D 195 ? 0.8934 0.6597 0.7445 -0.1372 0.0030 -0.0344 561 VAL B N 6320 C CA . VAL D 195 ? 0.8577 0.6343 0.7765 -0.1728 0.0274 -0.0575 561 VAL B CA 6321 C C . VAL D 195 ? 0.8661 0.6970 0.8031 -0.1518 -0.0294 -0.0910 561 VAL B C 6322 O O . VAL D 195 ? 0.8018 0.7323 0.8243 -0.1301 -0.0761 -0.0866 561 VAL B O 6323 C CB . VAL D 195 ? 0.6895 0.5586 0.7978 -0.2174 0.0624 -0.0375 561 VAL B CB 6324 C CG1 . VAL D 195 ? 0.6690 0.5545 0.8628 -0.2514 0.0881 -0.0627 561 VAL B CG1 6325 C CG2 . VAL D 195 ? 0.6350 0.4521 0.7338 -0.2414 0.1128 -0.0079 561 VAL B CG2 6326 N N . ALA D 196 ? 1.1370 0.7555 0.4415 0.1986 -0.1574 0.1099 562 ALA B N 6327 C CA . ALA D 196 ? 1.1369 0.7527 0.4007 0.1966 -0.1915 0.0877 562 ALA B CA 6328 C C . ALA D 196 ? 1.2110 0.8171 0.4842 0.1820 -0.2078 0.0530 562 ALA B C 6329 O O . ALA D 196 ? 1.1516 0.7408 0.4271 0.1772 -0.1860 0.0427 562 ALA B O 6330 C CB . ALA D 196 ? 1.2208 0.8182 0.4088 0.2085 -0.1830 0.0870 562 ALA B CB 6331 N N . MET D 197 ? 1.2503 0.8701 0.5357 0.1741 -0.2461 0.0376 563 MET B N 6332 C CA . MET D 197 ? 1.1980 0.8145 0.5046 0.1587 -0.2647 0.0065 563 MET B CA 6333 C C . MET D 197 ? 1.2191 0.8076 0.4708 0.1570 -0.2621 -0.0191 563 MET B C 6334 O O . MET D 197 ? 1.2763 0.8558 0.4732 0.1648 -0.2697 -0.0218 563 MET B O 6335 C CB . MET D 197 ? 1.1948 0.8374 0.5416 0.1506 -0.3061 0.0003 563 MET B CB 6336 C CG . MET D 197 ? 1.1532 0.7983 0.5361 0.1339 -0.3264 -0.0289 563 MET B CG 6337 S SD . MET D 197 ? 1.1942 0.8407 0.6281 0.1250 -0.3028 -0.0330 563 MET B SD 6338 C CE . MET D 197 ? 1.1337 0.8086 0.6258 0.1308 -0.3028 -0.0061 563 MET B CE 6339 N N . THR D 198 ? 1.1664 0.7419 0.4338 0.1470 -0.2509 -0.0373 564 THR B N 6340 C CA . THR D 198 ? 1.2038 0.7517 0.4305 0.1442 -0.2462 -0.0628 564 THR B CA 6341 C C . THR D 198 ? 1.2639 0.8186 0.5040 0.1311 -0.2863 -0.0912 564 THR B C 6342 O O . THR D 198 ? 1.2852 0.8668 0.5749 0.1232 -0.3147 -0.0898 564 THR B O 6343 C CB . THR D 198 ? 1.1203 0.6535 0.3652 0.1378 -0.2167 -0.0679 564 THR B CB 6344 O OG1 . THR D 198 ? 1.0492 0.6060 0.3611 0.1240 -0.2290 -0.0705 564 THR B OG1 6345 C CG2 . THR D 198 ? 1.1068 0.6295 0.3352 0.1509 -0.1754 -0.0399 564 THR B CG2 6346 N N . GLU D 199 ? 1.3239 0.8545 0.5248 0.1291 -0.2880 -0.1163 565 GLU B N 6347 C CA . GLU D 199 ? 1.3868 0.9222 0.6031 0.1159 -0.3262 -0.1446 565 GLU B CA 6348 C C . GLU D 199 ? 1.2943 0.8473 0.5924 0.0979 -0.3374 -0.1548 565 GLU B C 6349 O O . GLU D 199 ? 1.2524 0.8270 0.5964 0.0873 -0.3722 -0.1626 565 GLU B O 6350 C CB . GLU D 199 ? 1.5258 1.0293 0.6861 0.1171 -0.3218 -0.1719 565 GLU B CB 6351 C CG . GLU D 199 ? 1.6368 1.1434 0.8182 0.1018 -0.3613 -0.2034 565 GLU B CG 6352 C CD . GLU D 199 ? 1.8023 1.2759 0.9281 0.1029 -0.3568 -0.2337 565 GLU B CD 6353 O OE1 . GLU D 199 ? 1.8210 1.2907 0.9784 0.0876 -0.3778 -0.2629 565 GLU B OE1 6354 O OE2 . GLU D 199 ? 1.9133 1.3652 0.9669 0.1192 -0.3315 -0.2281 565 GLU B OE2 6355 N N . GLN D 200 ? 1.2693 0.8146 0.5879 0.0948 -0.3070 -0.1527 566 GLN B N 6356 C CA . GLN D 200 ? 1.1792 0.7451 0.5757 0.0794 -0.3121 -0.1571 566 GLN B CA 6357 C C . GLN D 200 ? 1.1414 0.7242 0.5626 0.0837 -0.2925 -0.1310 566 GLN B C 6358 O O . GLN D 200 ? 1.1358 0.7030 0.5189 0.0947 -0.2607 -0.1147 566 GLN B O 6359 C CB . GLN D 200 ? 1.1407 0.6872 0.5492 0.0694 -0.2952 -0.1778 566 GLN B CB 6360 C CG . GLN D 200 ? 1.1957 0.7301 0.6027 0.0607 -0.3188 -0.2080 566 GLN B CG 6361 C CD . GLN D 200 ? 1.2444 0.7569 0.6657 0.0522 -0.2971 -0.2271 566 GLN B CD 6362 O OE1 . GLN D 200 ? 1.2850 0.7807 0.6877 0.0577 -0.2596 -0.2176 566 GLN B OE1 6363 N NE2 . GLN D 200 ? 1.2960 0.8082 0.7560 0.0384 -0.3200 -0.2526 566 GLN B NE2 6364 N N . LEU D 201 ? 1.0908 0.7060 0.5786 0.0753 -0.3109 -0.1265 567 LEU B N 6365 C CA . LEU D 201 ? 0.9636 0.5974 0.4788 0.0788 -0.2958 -0.1052 567 LEU B CA 6366 C C . LEU D 201 ? 0.9824 0.6106 0.5091 0.0739 -0.2585 -0.1025 567 LEU B C 6367 O O . LEU D 201 ? 0.9778 0.6095 0.5419 0.0608 -0.2531 -0.1165 567 LEU B O 6368 C CB . LEU D 201 ? 0.9035 0.5751 0.4946 0.0709 -0.3214 -0.1037 567 LEU B CB 6369 C CG . LEU D 201 ? 0.8531 0.5527 0.4909 0.0733 -0.2989 -0.0827 567 LEU B CG 6370 C CD1 . LEU D 201 ? 0.8203 0.5084 0.4127 0.0897 -0.2897 -0.0614 567 LEU B CD1 6371 C CD2 . LEU D 201 ? 0.8502 0.5883 0.5677 0.0670 -0.3190 -0.0820 567 LEU B CD2 6372 N N . GLN D 202 ? 0.9470 0.5727 0.4560 0.0834 -0.2282 -0.0796 568 GLN B N 6373 C CA . GLN D 202 ? 0.8930 0.5213 0.4238 0.0784 -0.1885 -0.0696 568 GLN B CA 6374 C C . GLN D 202 ? 0.8803 0.5449 0.4703 0.0750 -0.1774 -0.0527 568 GLN B C 6375 O O . GLN D 202 ? 0.9069 0.5796 0.4968 0.0837 -0.1860 -0.0406 568 GLN B O 6376 C CB . GLN D 202 ? 0.8858 0.4792 0.3509 0.0915 -0.1609 -0.0569 568 GLN B CB 6377 C CG . GLN D 202 ? 1.0034 0.5569 0.4015 0.0970 -0.1668 -0.0767 568 GLN B CG 6378 C CD . GLN D 202 ? 1.0819 0.6038 0.4102 0.1154 -0.1415 -0.0604 568 GLN B CD 6379 O OE1 . GLN D 202 ? 1.1390 0.6686 0.4698 0.1244 -0.1252 -0.0326 568 GLN B OE1 6380 N NE2 . GLN D 202 ? 1.0970 0.5907 0.3819 0.1199 -0.1343 -0.0753 568 GLN B NE2 6381 N N . MET D 203 ? 0.7957 0.4820 0.4361 0.0629 -0.1583 -0.0521 569 MET B N 6382 C CA . MET D 203 ? 0.7576 0.4796 0.4512 0.0591 -0.1495 -0.0417 569 MET B CA 6383 C C . MET D 203 ? 0.7676 0.4958 0.4727 0.0545 -0.1161 -0.0278 569 MET B C 6384 O O . MET D 203 ? 0.8109 0.5217 0.4991 0.0514 -0.0983 -0.0257 569 MET B O 6385 C CB . MET D 203 ? 0.7520 0.5073 0.5066 0.0490 -0.1644 -0.0531 569 MET B CB 6386 C CG . MET D 203 ? 0.8096 0.5650 0.5675 0.0520 -0.2009 -0.0642 569 MET B CG 6387 S SD . MET D 203 ? 0.7813 0.5763 0.6225 0.0402 -0.2153 -0.0734 569 MET B SD 6388 C CE . MET D 203 ? 0.6661 0.4987 0.5522 0.0431 -0.1937 -0.0603 569 MET B CE 6389 N N . GLY D 204 ? 0.7052 0.4579 0.4406 0.0540 -0.1087 -0.0188 570 GLY B N 6390 C CA . GLY D 204 ? 0.6422 0.4074 0.3941 0.0478 -0.0830 -0.0064 570 GLY B CA 6391 C C . GLY D 204 ? 0.6164 0.4230 0.4195 0.0389 -0.0808 -0.0109 570 GLY B C 6392 O O . GLY D 204 ? 0.5862 0.4109 0.4115 0.0421 -0.0932 -0.0180 570 GLY B O 6393 N N . PHE D 205 ? 0.6482 0.4708 0.4710 0.0291 -0.0632 -0.0049 571 PHE B N 6394 C CA . PHE D 205 ? 0.6394 0.5043 0.5058 0.0221 -0.0570 -0.0051 571 PHE B CA 6395 C C . PHE D 205 ? 0.6377 0.5179 0.5058 0.0179 -0.0387 0.0084 571 PHE B C 6396 O O . PHE D 205 ? 0.6377 0.5118 0.5007 0.0124 -0.0234 0.0226 571 PHE B O 6397 C CB . PHE D 205 ? 0.6939 0.5736 0.5919 0.0136 -0.0537 -0.0063 571 PHE B CB 6398 C CG . PHE D 205 ? 0.7914 0.6594 0.6962 0.0153 -0.0762 -0.0214 571 PHE B CG 6399 C CD1 . PHE D 205 ? 0.8262 0.6915 0.7270 0.0232 -0.0977 -0.0314 571 PHE B CD1 6400 C CD2 . PHE D 205 ? 0.8310 0.6904 0.7508 0.0086 -0.0776 -0.0256 571 PHE B CD2 6401 C CE1 . PHE D 205 ? 0.8597 0.7163 0.7690 0.0237 -0.1225 -0.0438 571 PHE B CE1 6402 C CE2 . PHE D 205 ? 0.8607 0.7085 0.7884 0.0087 -0.1030 -0.0416 571 PHE B CE2 6403 C CZ . PHE D 205 ? 0.8521 0.6997 0.7735 0.0159 -0.1268 -0.0501 571 PHE B CZ 6404 N N . GLY D 206 ? 0.6607 0.5604 0.5379 0.0206 -0.0413 0.0035 572 GLY B N 6405 C CA . GLY D 206 ? 0.5755 0.4924 0.4540 0.0158 -0.0295 0.0120 572 GLY B CA 6406 C C . GLY D 206 ? 0.5231 0.4846 0.4277 0.0108 -0.0209 0.0111 572 GLY B C 6407 O O . GLY D 206 ? 0.5188 0.4993 0.4399 0.0157 -0.0255 -0.0020 572 GLY B O 6408 N N . ILE D 207 ? 0.5224 0.5020 0.4323 0.0020 -0.0067 0.0279 573 ILE B N 6409 C CA . ILE D 207 ? 0.4886 0.5140 0.4193 -0.0020 0.0040 0.0329 573 ILE B CA 6410 C C . ILE D 207 ? 0.5055 0.5490 0.4216 -0.0062 0.0080 0.0391 573 ILE B C 6411 O O . ILE D 207 ? 0.5463 0.5747 0.4521 -0.0119 0.0091 0.0531 573 ILE B O 6412 C CB . ILE D 207 ? 0.5158 0.5561 0.4734 -0.0091 0.0167 0.0512 573 ILE B CB 6413 C CG1 . ILE D 207 ? 0.5324 0.5488 0.5035 -0.0068 0.0086 0.0425 573 ILE B CG1 6414 C CG2 . ILE D 207 ? 0.5570 0.6487 0.5401 -0.0108 0.0291 0.0601 573 ILE B CG2 6415 C CD1 . ILE D 207 ? 0.5659 0.5930 0.5716 -0.0141 0.0199 0.0570 573 ILE B CD1 6416 N N . THR D 208 ? 0.4660 0.5416 0.3816 -0.0030 0.0097 0.0286 574 THR B N 6417 C CA . THR D 208 ? 0.4692 0.5653 0.3664 -0.0073 0.0102 0.0305 574 THR B CA 6418 C C . THR D 208 ? 0.5364 0.6827 0.4383 -0.0057 0.0230 0.0337 574 THR B C 6419 O O . THR D 208 ? 0.6595 0.8194 0.5694 0.0037 0.0271 0.0187 574 THR B O 6420 C CB . THR D 208 ? 0.4730 0.5475 0.3506 -0.0021 -0.0041 0.0060 574 THR B CB 6421 O OG1 . THR D 208 ? 0.5310 0.5616 0.4072 -0.0020 -0.0135 0.0085 574 THR B OG1 6422 C CG2 . THR D 208 ? 0.4819 0.5753 0.3398 -0.0081 -0.0081 0.0046 574 THR B CG2 6423 N N . VAL D 209 ? 0.4332 0.6088 0.3323 -0.0140 0.0304 0.0564 575 VAL B N 6424 C CA . VAL D 209 ? 0.4628 0.6901 0.3636 -0.0114 0.0448 0.0655 575 VAL B CA 6425 C C . VAL D 209 ? 0.5645 0.8147 0.4266 -0.0125 0.0392 0.0583 575 VAL B C 6426 O O . VAL D 209 ? 0.6213 0.8547 0.4665 -0.0209 0.0246 0.0588 575 VAL B O 6427 C CB . VAL D 209 ? 0.4274 0.6810 0.3607 -0.0186 0.0599 0.1023 575 VAL B CB 6428 C CG1 . VAL D 209 ? 0.3638 0.6019 0.3378 -0.0163 0.0657 0.1044 575 VAL B CG1 6429 C CG2 . VAL D 209 ? 0.4398 0.6812 0.3711 -0.0309 0.0550 0.1242 575 VAL B CG2 6430 N N . GLN D 210 ? 0.5508 0.8396 0.3997 -0.0036 0.0508 0.0515 576 GLN B N 6431 C CA . GLN D 210 ? 0.4671 0.7824 0.2716 -0.0031 0.0465 0.0424 576 GLN B CA 6432 C C . GLN D 210 ? 0.4647 0.8384 0.2686 -0.0018 0.0656 0.0728 576 GLN B C 6433 O O . GLN D 210 ? 0.5332 0.9343 0.3508 0.0098 0.0862 0.0761 576 GLN B O 6434 C CB . GLN D 210 ? 0.4825 0.7875 0.2599 0.0102 0.0441 0.0004 576 GLN B CB 6435 C CG . GLN D 210 ? 0.5356 0.8716 0.2610 0.0143 0.0435 -0.0148 576 GLN B CG 6436 C CD . GLN D 210 ? 0.6245 0.9478 0.3210 0.0006 0.0172 -0.0194 576 GLN B CD 6437 O OE1 . GLN D 210 ? 0.7073 0.9862 0.4144 -0.0058 -0.0019 -0.0333 576 GLN B OE1 6438 N NE2 . GLN D 210 ? 0.6309 0.9952 0.2940 -0.0038 0.0156 -0.0051 576 GLN B NE2 6439 N N . TYR D 211 ? 0.5444 0.7686 0.3228 -0.0413 -0.1601 0.0296 577 TYR B N 6440 C CA . TYR D 211 ? 0.5382 0.8236 0.3587 -0.0268 -0.1240 0.0467 577 TYR B CA 6441 C C . TYR D 211 ? 0.5401 0.8598 0.3620 -0.0415 -0.1142 0.0362 577 TYR B C 6442 O O . TYR D 211 ? 0.5381 0.8576 0.3187 -0.0606 -0.1246 0.0318 577 TYR B O 6443 C CB . TYR D 211 ? 0.5624 0.9027 0.3664 -0.0214 -0.1063 0.0790 577 TYR B CB 6444 C CG . TYR D 211 ? 0.5249 0.8519 0.3506 0.0028 -0.1080 0.0854 577 TYR B CG 6445 C CD1 . TYR D 211 ? 0.4571 0.7759 0.3245 0.0268 -0.0960 0.0979 577 TYR B CD1 6446 C CD2 . TYR D 211 ? 0.5702 0.8831 0.3727 -0.0045 -0.1196 0.0751 577 TYR B CD2 6447 C CE1 . TYR D 211 ? 0.4887 0.7879 0.3767 0.0515 -0.1007 0.1009 577 TYR B CE1 6448 C CE2 . TYR D 211 ? 0.5708 0.8852 0.3950 0.0179 -0.1221 0.0755 577 TYR B CE2 6449 C CZ . TYR D 211 ? 0.5369 0.8387 0.4092 0.0504 -0.1127 0.0873 577 TYR B CZ 6450 O OH . TYR D 211 ? 0.5034 0.7932 0.4009 0.0755 -0.1164 0.0836 577 TYR B OH 6451 N N . GLY D 212 ? 0.5718 0.9163 0.4398 -0.0377 -0.0916 0.0293 578 GLY B N 6452 C CA . GLY D 212 ? 0.5885 0.9804 0.4620 -0.0571 -0.0761 0.0140 578 GLY B CA 6453 C C . GLY D 212 ? 0.6400 1.0901 0.4894 -0.0708 -0.0474 0.0552 578 GLY B C 6454 O O . GLY D 212 ? 0.6601 1.1081 0.5000 -0.0582 -0.0432 0.0909 578 GLY B O 6455 N N . THR D 213 ? 0.7223 1.2205 0.5609 -0.0951 -0.0330 0.0474 579 THR B N 6456 C CA . THR D 213 ? 0.8536 1.4010 0.6610 -0.1131 -0.0113 0.0867 579 THR B CA 6457 C C . THR D 213 ? 0.9739 1.5312 0.7983 -0.1330 0.0117 0.0909 579 THR B C 6458 O O . THR D 213 ? 1.0416 1.5951 0.8367 -0.1383 0.0156 0.1343 579 THR B O 6459 C CB . THR D 213 ? 0.8861 1.4557 0.6953 -0.1319 -0.0054 0.0733 579 THR B CB 6460 O OG1 . THR D 213 ? 0.9111 1.5241 0.7257 -0.1541 0.0025 0.0263 579 THR B OG1 6461 C CG2 . THR D 213 ? 0.8778 1.4070 0.6809 -0.1195 -0.0234 0.0694 579 THR B CG2 6462 N N . ASP D 214 ? 1.0496 1.6164 0.9191 -0.1462 0.0220 0.0413 580 ASP B N 6463 C CA . ASP D 214 ? 1.1145 1.7040 0.9943 -0.1819 0.0487 0.0353 580 ASP B CA 6464 C C . ASP D 214 ? 1.0940 1.6572 1.0294 -0.1708 0.0472 -0.0025 580 ASP B C 6465 O O . ASP D 214 ? 1.1168 1.6740 1.0483 -0.1965 0.0636 0.0076 580 ASP B O 6466 C CB . ASP D 214 ? 1.1759 1.8430 1.0599 -0.2264 0.0743 -0.0023 580 ASP B CB 6467 C CG . ASP D 214 ? 1.2322 1.9167 1.0677 -0.2365 0.0719 0.0312 580 ASP B CG 6468 O OD1 . ASP D 214 ? 1.2779 1.9128 1.0826 -0.2215 0.0556 0.0860 580 ASP B OD1 6469 O OD2 . ASP D 214 ? 1.2183 1.9439 1.0691 -0.2479 0.0747 -0.0076 580 ASP B OD2 6470 N N . THR D 215 ? 1.0380 1.5788 1.0174 -0.1364 0.0232 -0.0452 581 THR B N 6471 C CA . THR D 215 ? 1.0335 1.5559 1.0733 -0.1230 0.0170 -0.0908 581 THR B CA 6472 C C . THR D 215 ? 0.9205 1.3626 0.9631 -0.0793 -0.0161 -0.0754 581 THR B C 6473 O O . THR D 215 ? 0.9159 1.3239 0.9512 -0.0559 -0.0482 -0.0868 581 THR B O 6474 C CB . THR D 215 ? 1.0839 1.6542 1.1873 -0.1222 0.0101 -0.1763 581 THR B CB 6475 O OG1 . THR D 215 ? 1.1531 1.6933 1.2417 -0.0960 -0.0256 -0.1863 581 THR B OG1 6476 C CG2 . THR D 215 ? 1.0742 1.7426 1.1854 -0.1740 0.0502 -0.2060 581 THR B CG2 6477 N N . ASN D 216 ? 0.8071 1.2146 0.8517 -0.0747 -0.0101 -0.0498 582 ASN B N 6478 C CA . ASN D 216 ? 0.6955 1.0343 0.7481 -0.0386 -0.0369 -0.0416 582 ASN B CA 6479 C C . ASN D 216 ? 0.6976 1.0216 0.8000 -0.0380 -0.0317 -0.0708 582 ASN B C 6480 O O . ASN D 216 ? 0.7450 1.0459 0.8337 -0.0447 -0.0188 -0.0379 582 ASN B O 6481 C CB . ASN D 216 ? 0.6193 0.9286 0.6226 -0.0255 -0.0399 0.0206 582 ASN B CB 6482 C CG . ASN D 216 ? 0.5355 0.8693 0.4933 -0.0260 -0.0462 0.0434 582 ASN B CG 6483 O OD1 . ASN D 216 ? 0.4966 0.8108 0.4399 -0.0140 -0.0690 0.0351 582 ASN B OD1 6484 N ND2 . ASN D 216 ? 0.4857 0.8593 0.4124 -0.0459 -0.0282 0.0729 582 ASN B ND2 6485 N N . SER D 217 ? 0.6503 0.9847 0.8099 -0.0285 -0.0470 -0.1360 583 SER B N 6486 C CA . SER D 217 ? 0.6438 0.9886 0.8617 -0.0326 -0.0393 -0.1785 583 SER B CA 6487 C C . SER D 217 ? 0.6594 0.9272 0.8907 0.0017 -0.0684 -0.1740 583 SER B C 6488 O O . SER D 217 ? 0.6986 0.9677 0.9734 -0.0004 -0.0626 -0.2017 583 SER B O 6489 C CB . SER D 217 ? 0.6645 1.0757 0.9522 -0.0353 -0.0446 -0.2661 583 SER B CB 6490 O OG . SER D 217 ? 0.7816 1.2761 1.0605 -0.0740 -0.0123 -0.2777 583 SER B OG 6491 N N . VAL D 218 ? 0.5964 0.8028 0.7870 0.0265 -0.0984 -0.1424 584 VAL B N 6492 C CA . VAL D 218 ? 0.6280 0.7624 0.8213 0.0514 -0.1258 -0.1373 584 VAL B CA 6493 C C . VAL D 218 ? 0.6042 0.7153 0.7628 0.0516 -0.1067 -0.0793 584 VAL B C 6494 O O . VAL D 218 ? 0.6175 0.7071 0.7302 0.0603 -0.1160 -0.0434 584 VAL B O 6495 C CB . VAL D 218 ? 0.6179 0.6937 0.7763 0.0670 -0.1732 -0.1414 584 VAL B CB 6496 C CG1 . VAL D 218 ? 0.4703 0.4719 0.6338 0.0848 -0.2053 -0.1480 584 VAL B CG1 6497 C CG2 . VAL D 218 ? 0.5021 0.5907 0.6832 0.0702 -0.2012 -0.1958 584 VAL B CG2 6498 N N . CYS D 219 ? 0.5913 0.7096 0.7717 0.0401 -0.0825 -0.0762 585 CYS B N 6499 C CA . CYS D 219 ? 0.6119 0.6985 0.7601 0.0427 -0.0714 -0.0258 585 CYS B CA 6500 C C . CYS D 219 ? 0.6198 0.6530 0.7928 0.0605 -0.0832 -0.0337 585 CYS B C 6501 O O . CYS D 219 ? 0.6108 0.6422 0.8301 0.0615 -0.0914 -0.0785 585 CYS B O 6502 C CB . CYS D 219 ? 0.6038 0.7173 0.7332 0.0069 -0.0415 -0.0063 585 CYS B CB 6503 S SG . CYS D 219 ? 0.7584 0.9354 0.8523 -0.0200 -0.0261 0.0061 585 CYS B SG 6504 N N . PRO D 220 ? 0.6291 0.6220 0.7754 0.0773 -0.0873 0.0040 586 PRO B N 6505 C CA . PRO D 220 ? 0.5720 0.5143 0.7398 0.0927 -0.0970 -0.0034 586 PRO B CA 6506 C C . PRO D 220 ? 0.6070 0.5429 0.7997 0.0701 -0.0792 -0.0164 586 PRO B C 6507 O O . PRO D 220 ? 0.6012 0.5592 0.7743 0.0389 -0.0582 -0.0032 586 PRO B O 6508 C CB . PRO D 220 ? 0.5070 0.4231 0.6423 0.1151 -0.1035 0.0347 586 PRO B CB 6509 C CG . PRO D 220 ? 0.5869 0.5333 0.6869 0.1075 -0.0948 0.0652 586 PRO B CG 6510 C CD . PRO D 220 ? 0.6196 0.6167 0.7215 0.0878 -0.0878 0.0469 586 PRO B CD 6511 N N . LYS D 221 ? 0.6569 0.5634 0.8857 0.0789 -0.0884 -0.0430 587 LYS B N 6512 C CA . LYS D 221 ? 0.7040 0.6105 0.9584 0.0533 -0.0712 -0.0623 587 LYS B CA 6513 C C . LYS D 221 ? 0.7453 0.5911 0.9630 0.0511 -0.0673 -0.0204 587 LYS B C 6514 O O . LYS D 221 ? 0.7288 0.5260 0.9425 0.0830 -0.0849 -0.0063 587 LYS B O 6515 C CB . LYS D 221 ? 0.7569 0.6607 1.0703 0.0662 -0.0879 -0.1146 587 LYS B CB 6516 C CG . LYS D 221 ? 0.8589 0.7784 1.2071 0.0377 -0.0690 -0.1451 587 LYS B CG 6517 C CD . LYS D 221 ? 0.8623 0.7737 1.2710 0.0598 -0.0939 -0.1966 587 LYS B CD 6518 C CE . LYS D 221 ? 0.9004 0.8427 1.3494 0.0288 -0.0730 -0.2343 587 LYS B CE 6519 N NZ . LYS D 221 ? 0.9139 0.8437 1.4232 0.0556 -0.1030 -0.2838 587 LYS B NZ 6520 N N . LEU D 222 ? 0.7676 0.6124 0.9525 0.0093 -0.0477 -0.0032 588 LEU B N 6521 C CA . LEU D 222 ? 0.8828 0.6499 1.0185 0.0032 -0.0541 0.0384 588 LEU B CA 6522 C C . LEU D 222 ? 1.0449 0.7911 1.1926 -0.0317 -0.0415 0.0178 588 LEU B C 6523 O O . LEU D 222 ? 1.0419 0.8532 1.2297 -0.0657 -0.0200 -0.0290 588 LEU B O 6524 C CB . LEU D 222 ? 0.9201 0.6702 0.9833 -0.0268 -0.0531 0.0826 588 LEU B CB 6525 C CG . LEU D 222 ? 0.8870 0.6392 0.9242 0.0103 -0.0723 0.1143 588 LEU B CG 6526 C CD1 . LEU D 222 ? 0.8662 0.5871 0.9247 0.0728 -0.0979 0.1175 588 LEU B CD1 6527 C CD2 . LEU D 222 ? 0.8288 0.6683 0.8899 0.0052 -0.0572 0.0918 588 LEU B CD2 6528 N N . GLU D 223 ? 1.2005 0.8606 1.3161 -0.0226 -0.0567 0.0469 589 GLU B N 6529 C CA . GLU D 223 ? 1.3396 0.9681 1.4532 -0.0605 -0.0463 0.0336 589 GLU B CA 6530 C C . GLU D 223 ? 1.4942 1.0700 1.5187 -0.1250 -0.0421 0.0706 589 GLU B C 6531 O O . GLU D 223 ? 1.5635 1.1135 1.5275 -0.1305 -0.0547 0.1106 589 GLU B O 6532 C CB . GLU D 223 ? 1.3909 0.9489 1.5202 -0.0157 -0.0683 0.0389 589 GLU B CB 6533 C CG . GLU D 223 ? 1.3394 0.9399 1.5448 0.0254 -0.0722 -0.0027 589 GLU B CG 6534 C CD . GLU D 223 ? 1.3473 0.8836 1.5611 0.0651 -0.0926 0.0032 589 GLU B CD 6535 O OE1 . GLU D 223 ? 1.3436 0.8830 1.5968 0.0633 -0.0900 -0.0284 589 GLU B OE1 6536 O OE2 . GLU D 223 ? 1.3671 0.8718 1.5430 0.0965 -0.1073 0.0331 589 GLU B OE2 6537 N N . PHE D 224 ? 1.5780 1.1340 1.5866 -0.1792 -0.0276 0.0571 590 PHE B N 6538 C CA . PHE D 224 ? 1.7541 1.2463 1.6583 -0.2581 -0.0265 0.0927 590 PHE B CA 6539 C C . PHE D 224 ? 1.8566 1.2419 1.7197 -0.2730 -0.0430 0.1096 590 PHE B C 6540 O O . PHE D 224 ? 1.9672 1.3281 1.7667 -0.3586 -0.0286 0.1112 590 PHE B O 6541 C CB . PHE D 224 ? 1.7792 1.3788 1.6845 -0.3460 0.0182 0.0511 590 PHE B CB 6542 C CG . PHE D 224 ? 1.6854 1.4013 1.6473 -0.3285 0.0358 0.0202 590 PHE B CG 6543 C CD1 . PHE D 224 ? 1.5705 1.4022 1.6442 -0.3038 0.0555 -0.0524 590 PHE B CD1 6544 C CD2 . PHE D 224 ? 1.7188 1.4205 1.6199 -0.3342 0.0261 0.0621 590 PHE B CD2 6545 C CE1 . PHE D 224 ? 1.5083 1.4344 1.6294 -0.2860 0.0646 -0.0828 590 PHE B CE1 6546 C CE2 . PHE D 224 ? 1.6308 1.4364 1.5810 -0.3197 0.0420 0.0334 590 PHE B CE2 6547 C CZ . PHE D 224 ? 1.5347 1.4498 1.5936 -0.2957 0.0610 -0.0392 590 PHE B CZ 6548 N N . ALA D 225 ? 1.8420 1.1668 1.7377 -0.1951 -0.0727 0.1192 591 ALA B N 6549 C CA . ALA D 225 ? 1.9511 1.1711 1.8156 -0.1974 -0.0925 0.1323 591 ALA B CA 6550 C C . ALA D 225 ? 2.0080 1.1474 1.8802 -0.1086 -0.1372 0.1562 591 ALA B C 6551 O O . ALA D 225 ? 2.0153 1.1483 1.9356 -0.0685 -0.1391 0.1354 591 ALA B O 6552 C CB . ALA D 225 ? 1.8748 1.1603 1.8160 -0.2104 -0.0618 0.0777 591 ALA B CB 6553 N N . GLN E 1 ? 1.6987 1.2211 0.9275 -0.3675 0.3131 -0.2011 1 GLN D N 6554 C CA . GLN E 1 ? 1.6124 1.1845 0.8663 -0.3315 0.2817 -0.1613 1 GLN D CA 6555 C C . GLN E 1 ? 1.5796 1.1953 0.8574 -0.3142 0.2374 -0.1125 1 GLN D C 6556 O O . GLN E 1 ? 1.5848 1.1945 0.8774 -0.3213 0.2351 -0.1101 1 GLN D O 6557 C CB . GLN E 1 ? 1.5540 1.1334 0.8800 -0.2748 0.3013 -0.1735 1 GLN D CB 6558 C CG . GLN E 1 ? 1.5448 1.1263 0.9395 -0.2249 0.2993 -0.1650 1 GLN D CG 6559 C CD . GLN E 1 ? 1.5000 1.1065 0.9630 -0.1666 0.3048 -0.1703 1 GLN D CD 6560 O OE1 . GLN E 1 ? 1.5251 1.1399 0.9962 -0.1683 0.3244 -0.1971 1 GLN D OE1 6561 N NE2 . GLN E 1 ? 1.4324 1.0543 0.9427 -0.1181 0.2878 -0.1457 1 GLN D NE2 6562 N N . VAL E 2 ? 1.5366 1.1929 0.8193 -0.2921 0.2067 -0.0750 2 VAL D N 6563 C CA . VAL E 2 ? 1.4748 1.1804 0.7889 -0.2699 0.1685 -0.0297 2 VAL D CA 6564 C C . VAL E 2 ? 1.4213 1.1353 0.8090 -0.2132 0.1751 -0.0224 2 VAL D C 6565 O O . VAL E 2 ? 1.3868 1.0840 0.8027 -0.1813 0.1965 -0.0425 2 VAL D O 6566 C CB . VAL E 2 ? 1.4405 1.1789 0.7335 -0.2600 0.1366 0.0082 2 VAL D CB 6567 C CG1 . VAL E 2 ? 1.3798 1.1085 0.7006 -0.2168 0.1497 0.0070 2 VAL D CG1 6568 C CG2 . VAL E 2 ? 1.4241 1.2217 0.7479 -0.2447 0.0979 0.0518 2 VAL D CG2 6569 N N . GLN E 3 ? 1.4610 1.2050 0.8782 -0.2030 0.1570 0.0053 3 GLN D N 6570 C CA . GLN E 3 ? 1.4286 1.1791 0.9013 -0.1516 0.1618 0.0180 3 GLN D CA 6571 C C . GLN E 3 ? 1.3491 1.1545 0.8488 -0.1188 0.1340 0.0580 3 GLN D C 6572 O O . GLN E 3 ? 1.3407 1.1848 0.8280 -0.1380 0.1088 0.0813 3 GLN D O 6573 C CB . GLN E 3 ? 1.5429 1.2699 1.0262 -0.1654 0.1753 0.0155 3 GLN D CB 6574 C CG . GLN E 3 ? 1.6897 1.3555 1.1394 -0.2064 0.2043 -0.0248 3 GLN D CG 6575 C CD . GLN E 3 ? 1.7270 1.3508 1.1877 -0.1765 0.2334 -0.0573 3 GLN D CD 6576 O OE1 . GLN E 3 ? 1.7144 1.3495 1.2158 -0.1219 0.2328 -0.0490 3 GLN D OE1 6577 N NE2 . GLN E 3 ? 1.7595 1.3407 1.1856 -0.2132 0.2593 -0.0971 3 GLN D NE2 6578 N N . LEU E 4 ? 1.2928 1.1034 0.8289 -0.0676 0.1383 0.0648 4 LEU D N 6579 C CA . LEU E 4 ? 1.1738 1.0291 0.7352 -0.0332 0.1195 0.0975 4 LEU D CA 6580 C C . LEU E 4 ? 1.0740 0.9441 0.6666 -0.0110 0.1240 0.1159 4 LEU D C 6581 O O . LEU E 4 ? 1.0219 0.8694 0.6259 0.0211 0.1377 0.1085 4 LEU D O 6582 C CB . LEU E 4 ? 1.1076 0.9576 0.6756 0.0033 0.1218 0.0889 4 LEU D CB 6583 C CG . LEU E 4 ? 1.1105 0.9608 0.6520 -0.0070 0.1110 0.0946 4 LEU D CG 6584 C CD1 . LEU E 4 ? 1.1631 0.9899 0.6578 -0.0579 0.1134 0.0805 4 LEU D CD1 6585 C CD2 . LEU E 4 ? 1.0661 0.9004 0.6145 0.0200 0.1216 0.0764 4 LEU D CD2 6586 N N . VAL E 5 ? 1.0415 0.9531 0.6471 -0.0291 0.1121 0.1407 5 VAL D N 6587 C CA . VAL E 5 ? 1.0191 0.9471 0.6520 -0.0164 0.1216 0.1598 5 VAL D CA 6588 C C . VAL E 5 ? 0.9668 0.9494 0.6310 0.0215 0.1117 0.1871 5 VAL D C 6589 O O . VAL E 5 ? 0.9569 0.9895 0.6359 0.0164 0.0918 0.2033 5 VAL D O 6590 C CB . VAL E 5 ? 1.0642 1.0066 0.6998 -0.0691 0.1230 0.1635 5 VAL D CB 6591 C CG1 . VAL E 5 ? 1.0154 0.9724 0.6782 -0.0605 0.1391 0.1842 5 VAL D CG1 6592 C CG2 . VAL E 5 ? 1.1485 1.0251 0.7483 -0.1075 0.1391 0.1319 5 VAL D CG2 6593 N N . GLN E 6 ? 0.9314 0.9029 0.6028 0.0617 0.1259 0.1921 6 GLN D N 6594 C CA . GLN E 6 ? 0.9319 0.9452 0.6266 0.1002 0.1240 0.2113 6 GLN D CA 6595 C C . GLN E 6 ? 1.0200 1.0714 0.7414 0.0961 0.1374 0.2345 6 GLN D C 6596 O O . GLN E 6 ? 1.0832 1.1173 0.7999 0.0642 0.1502 0.2355 6 GLN D O 6597 C CB . GLN E 6 ? 0.9007 0.8836 0.5792 0.1443 0.1311 0.1984 6 GLN D CB 6598 C CG . GLN E 6 ? 0.8439 0.7934 0.5034 0.1443 0.1237 0.1705 6 GLN D CG 6599 C CD . GLN E 6 ? 0.7755 0.7102 0.4267 0.1834 0.1272 0.1540 6 GLN D CD 6600 O OE1 . GLN E 6 ? 0.7652 0.6776 0.4085 0.1833 0.1256 0.1269 6 GLN D OE1 6601 N NE2 . GLN E 6 ? 0.7671 0.7198 0.4205 0.2143 0.1328 0.1675 6 GLN D NE2 6602 N N . SER E 7 ? 1.0144 1.1133 0.7635 0.1268 0.1393 0.2511 7 SER D N 6603 C CA . SER E 7 ? 0.9835 1.1275 0.7636 0.1241 0.1582 0.2714 7 SER D CA 6604 C C . SER E 7 ? 1.0188 1.1150 0.7651 0.1401 0.1851 0.2729 7 SER D C 6605 O O . SER E 7 ? 0.9760 1.0172 0.6826 0.1636 0.1834 0.2590 7 SER D O 6606 C CB . SER E 7 ? 0.9662 1.1755 0.7890 0.1574 0.1568 0.2859 7 SER D CB 6607 O OG . SER E 7 ? 1.0072 1.1849 0.8055 0.2041 0.1628 0.2766 7 SER D OG 6608 N N . GLY E 8 ? 1.0688 1.1894 0.8307 0.1267 0.2096 0.2907 8 GLY D N 6609 C CA . GLY E 8 ? 1.1090 1.1780 0.8280 0.1386 0.2372 0.2995 8 GLY D CA 6610 C C . GLY E 8 ? 1.1576 1.2223 0.8501 0.1913 0.2437 0.2997 8 GLY D C 6611 O O . GLY E 8 ? 1.2056 1.3048 0.9183 0.2174 0.2313 0.2908 8 GLY D O 6612 N N . ALA E 9 ? 1.1914 1.2078 0.8322 0.2063 0.2637 0.3099 9 ALA D N 6613 C CA . ALA E 9 ? 1.2319 1.2415 0.8331 0.2523 0.2691 0.3080 9 ALA D CA 6614 C C . ALA E 9 ? 1.2411 1.3139 0.8725 0.2625 0.2924 0.3153 9 ALA D C 6615 O O . ALA E 9 ? 1.2779 1.3897 0.9451 0.2352 0.3167 0.3318 9 ALA D O 6616 C CB . ALA E 9 ? 1.3037 1.2487 0.8430 0.2619 0.2787 0.3181 9 ALA D CB 6617 N N . GLU E 10 ? 1.2001 1.2843 0.8204 0.3005 0.2877 0.2996 10 GLU D N 6618 C CA . GLU E 10 ? 1.1485 1.2866 0.7976 0.3181 0.3133 0.3012 10 GLU D CA 6619 C C . GLU E 10 ? 1.2335 1.3438 0.8268 0.3422 0.3284 0.2920 10 GLU D C 6620 O O . GLU E 10 ? 1.2487 1.3141 0.7927 0.3596 0.3057 0.2736 10 GLU D O 6621 C CB . GLU E 10 ? 1.0886 1.2567 0.7837 0.3373 0.2939 0.2835 10 GLU D CB 6622 C CG . GLU E 10 ? 1.0736 1.2807 0.8355 0.3106 0.2722 0.2912 10 GLU D CG 6623 C CD . GLU E 10 ? 1.0951 1.3802 0.9249 0.2940 0.2931 0.3112 10 GLU D CD 6624 O OE1 . GLU E 10 ? 1.1046 1.4208 0.9442 0.3139 0.3275 0.3150 10 GLU D OE1 6625 O OE2 . GLU E 10 ? 1.1055 1.4257 0.9799 0.2590 0.2760 0.3203 10 GLU D OE2 6626 N N . VAL E 11 ? 1.2744 1.4170 0.8817 0.3389 0.3638 0.3016 11 VAL D N 6627 C CA . VAL E 11 ? 1.1046 1.2237 0.6594 0.3559 0.3788 0.2904 11 VAL D CA 6628 C C . VAL E 11 ? 1.2166 1.3863 0.8106 0.3772 0.4057 0.2782 11 VAL D C 6629 O O . VAL E 11 ? 1.1199 1.3398 0.7590 0.3655 0.4406 0.2903 11 VAL D O 6630 C CB . VAL E 11 ? 1.1754 1.2695 0.6937 0.3297 0.4029 0.3108 11 VAL D CB 6631 C CG1 . VAL E 11 ? 1.2516 1.3157 0.6994 0.3467 0.4133 0.3000 11 VAL D CG1 6632 C CG2 . VAL E 11 ? 1.1833 1.2222 0.6727 0.3099 0.3808 0.3249 11 VAL D CG2 6633 N N . LYS E 12 ? 1.1906 1.3463 0.7717 0.4068 0.3911 0.2516 12 LYS D N 6634 C CA . LYS E 12 ? 1.2240 1.4133 0.8444 0.4306 0.4147 0.2363 12 LYS D CA 6635 C C . LYS E 12 ? 1.2762 1.4289 0.8322 0.4436 0.4262 0.2092 12 LYS D C 6636 O O . LYS E 12 ? 1.2762 1.3809 0.7605 0.4425 0.4030 0.1963 12 LYS D O 6637 C CB . LYS E 12 ? 1.1915 1.3877 0.8544 0.4511 0.3942 0.2259 12 LYS D CB 6638 C CG . LYS E 12 ? 1.1374 1.3902 0.8752 0.4420 0.3891 0.2529 12 LYS D CG 6639 C CD . LYS E 12 ? 1.1381 1.4720 0.9570 0.4424 0.4216 0.2698 12 LYS D CD 6640 C CE . LYS E 12 ? 1.0803 1.4788 0.9836 0.4241 0.4005 0.2930 12 LYS D CE 6641 N NZ . LYS E 12 ? 1.0771 1.4532 0.9542 0.3766 0.3785 0.3061 12 LYS D NZ 6642 N N . LYS E 13 ? 1.3135 1.4950 0.8988 0.4552 0.4622 0.1994 13 LYS D N 6643 C CA . LYS E 13 ? 1.3855 1.5364 0.9112 0.4639 0.4801 0.1700 13 LYS D CA 6644 C C . LYS E 13 ? 1.4077 1.5242 0.9239 0.4845 0.4625 0.1357 13 LYS D C 6645 O O . LYS E 13 ? 1.4078 1.5325 0.9806 0.4971 0.4489 0.1375 13 LYS D O 6646 C CB . LYS E 13 ? 1.4395 1.6343 1.0038 0.4655 0.5310 0.1692 13 LYS D CB 6647 C CG . LYS E 13 ? 1.4790 1.7153 1.0680 0.4383 0.5544 0.2013 13 LYS D CG 6648 C CD . LYS E 13 ? 1.6148 1.8415 1.1447 0.4233 0.5943 0.1949 13 LYS D CD 6649 C CE . LYS E 13 ? 1.6941 1.8500 1.1055 0.4174 0.5710 0.1876 13 LYS D CE 6650 N NZ . LYS E 13 ? 1.8124 1.9571 1.1552 0.4011 0.6093 0.1846 13 LYS D NZ 6651 N N . PRO E 14 ? 1.4327 1.5090 0.8741 0.4842 0.4631 0.1039 14 PRO D N 6652 C CA . PRO E 14 ? 1.4643 1.5043 0.8945 0.4953 0.4515 0.0654 14 PRO D CA 6653 C C . PRO E 14 ? 1.4843 1.5340 0.9805 0.5164 0.4827 0.0536 14 PRO D C 6654 O O . PRO E 14 ? 1.5440 1.6115 1.0484 0.5223 0.5228 0.0457 14 PRO D O 6655 C CB . PRO E 14 ? 1.4496 1.4599 0.7864 0.4851 0.4538 0.0345 14 PRO D CB 6656 C CG . PRO E 14 ? 1.4972 1.5289 0.8057 0.4755 0.4808 0.0568 14 PRO D CG 6657 C CD . PRO E 14 ? 1.4280 1.4889 0.7863 0.4698 0.4720 0.1020 14 PRO D CD 6658 N N . GLY E 15 ? 1.4846 1.5207 1.0269 0.5285 0.4649 0.0530 15 GLY D N 6659 C CA . GLY E 15 ? 1.5109 1.5500 1.1193 0.5540 0.4883 0.0481 15 GLY D CA 6660 C C . GLY E 15 ? 1.4756 1.5688 1.1731 0.5672 0.4817 0.0896 15 GLY D C 6661 O O . GLY E 15 ? 1.4866 1.5846 1.2460 0.5924 0.4890 0.0937 15 GLY D O 6662 N N . SER E 16 ? 1.4363 1.5706 1.1397 0.5498 0.4669 0.1205 16 SER D N 6663 C CA . SER E 16 ? 1.3607 1.5592 1.1480 0.5550 0.4595 0.1583 16 SER D CA 6664 C C . SER E 16 ? 1.3356 1.5116 1.1323 0.5572 0.4217 0.1677 16 SER D C 6665 O O . SER E 16 ? 1.3736 1.4822 1.1202 0.5563 0.4061 0.1428 16 SER D O 6666 C CB . SER E 16 ? 1.3218 1.5707 1.1109 0.5286 0.4652 0.1845 16 SER D CB 6667 O OG . SER E 16 ? 1.4048 1.6707 1.1802 0.5228 0.5038 0.1766 16 SER D OG 6668 N N . SER E 17 ? 1.2628 1.4997 1.1251 0.5565 0.4086 0.2018 17 SER D N 6669 C CA . SER E 17 ? 1.1827 1.4049 1.0554 0.5572 0.3743 0.2138 17 SER D CA 6670 C C . SER E 17 ? 1.1543 1.4159 1.0319 0.5260 0.3550 0.2372 17 SER D C 6671 O O . SER E 17 ? 1.1987 1.5258 1.1142 0.5094 0.3675 0.2570 17 SER D O 6672 C CB . SER E 17 ? 1.2021 1.4536 1.1529 0.5858 0.3668 0.2328 17 SER D CB 6673 O OG . SER E 17 ? 1.1677 1.4040 1.1238 0.5838 0.3310 0.2489 17 SER D OG 6674 N N . VAL E 18 ? 1.0438 1.2539 0.8812 0.5024 0.3183 0.2308 18 VAL D N 6675 C CA . VAL E 18 ? 0.9672 1.1902 0.8013 0.4592 0.2900 0.2464 18 VAL D CA 6676 C C . VAL E 18 ? 0.9688 1.1792 0.8213 0.4454 0.2513 0.2549 18 VAL D C 6677 O O . VAL E 18 ? 1.0258 1.1826 0.8554 0.4597 0.2427 0.2401 18 VAL D O 6678 C CB . VAL E 18 ? 0.9830 1.1543 0.7385 0.4409 0.2866 0.2281 18 VAL D CB 6679 C CG1 . VAL E 18 ? 0.9969 1.1029 0.7027 0.4519 0.2747 0.1956 18 VAL D CG1 6680 C CG2 . VAL E 18 ? 0.8700 1.0438 0.6236 0.4005 0.2628 0.2431 18 VAL D CG2 6681 N N . LYS E 19 ? 0.9056 1.1621 0.7940 0.4139 0.2306 0.2776 19 LYS D N 6682 C CA . LYS E 19 ? 0.8602 1.1076 0.7556 0.3955 0.1939 0.2868 19 LYS D CA 6683 C C . LYS E 19 ? 0.9006 1.1398 0.7724 0.3455 0.1752 0.2863 19 LYS D C 6684 O O . LYS E 19 ? 0.8697 1.1606 0.7723 0.3185 0.1763 0.3008 19 LYS D O 6685 C CB . LYS E 19 ? 0.8311 1.1515 0.7998 0.4103 0.1816 0.3157 19 LYS D CB 6686 C CG . LYS E 19 ? 0.8121 1.1135 0.7742 0.4027 0.1439 0.3285 19 LYS D CG 6687 C CD . LYS E 19 ? 0.8269 1.2031 0.8609 0.4311 0.1285 0.3603 19 LYS D CD 6688 C CE . LYS E 19 ? 0.8522 1.1969 0.8626 0.4290 0.0906 0.3778 19 LYS D CE 6689 N NZ . LYS E 19 ? 0.9426 1.3611 1.0213 0.4659 0.0696 0.4138 19 LYS D NZ 6690 N N . VAL E 20 ? 0.9455 1.1187 0.7653 0.3319 0.1618 0.2665 20 VAL D N 6691 C CA . VAL E 20 ? 0.9545 1.1077 0.7490 0.2900 0.1487 0.2604 20 VAL D CA 6692 C C . VAL E 20 ? 0.9688 1.1235 0.7670 0.2616 0.1204 0.2675 20 VAL D C 6693 O O . VAL E 20 ? 0.9926 1.1212 0.7792 0.2741 0.1094 0.2661 20 VAL D O 6694 C CB . VAL E 20 ? 0.9892 1.0791 0.7304 0.2930 0.1526 0.2317 20 VAL D CB 6695 C CG1 . VAL E 20 ? 0.9633 1.0295 0.6851 0.2565 0.1422 0.2244 20 VAL D CG1 6696 C CG2 . VAL E 20 ? 0.9951 1.0836 0.7184 0.3192 0.1760 0.2263 20 VAL D CG2 6697 N N . SER E 21 ? 0.9672 1.1461 0.7740 0.2207 0.1108 0.2745 21 SER D N 6698 C CA . SER E 21 ? 0.9967 1.1799 0.7966 0.1873 0.0835 0.2791 21 SER D CA 6699 C C . SER E 21 ? 1.0035 1.1219 0.7525 0.1567 0.0822 0.2534 21 SER D C 6700 O O . SER E 21 ? 1.0066 1.0878 0.7366 0.1604 0.0993 0.2353 21 SER D O 6701 C CB . SER E 21 ? 1.0408 1.2976 0.8825 0.1544 0.0722 0.2974 21 SER D CB 6702 O OG . SER E 21 ? 1.0800 1.3223 0.9112 0.1187 0.0877 0.2860 21 SER D OG 6703 N N . CYS E 22 ? 1.0590 1.1665 0.7852 0.1287 0.0621 0.2526 22 CYS D N 6704 C CA . CYS E 22 ? 1.1038 1.1543 0.7847 0.0976 0.0648 0.2256 22 CYS D CA 6705 C C . CYS E 22 ? 1.1523 1.2140 0.8114 0.0518 0.0436 0.2302 22 CYS D C 6706 O O . CYS E 22 ? 1.2056 1.2518 0.8352 0.0486 0.0292 0.2360 22 CYS D O 6707 C CB . CYS E 22 ? 1.1307 1.1288 0.7842 0.1194 0.0723 0.2074 22 CYS D CB 6708 S SG . CYS E 22 ? 1.0037 0.9425 0.6160 0.0865 0.0835 0.1682 22 CYS D SG 6709 N N . LYS E 23 ? 1.1457 1.2299 0.8127 0.0135 0.0430 0.2273 23 LYS D N 6710 C CA . LYS E 23 ? 1.1866 1.2900 0.8302 -0.0367 0.0212 0.2279 23 LYS D CA 6711 C C . LYS E 23 ? 1.2125 1.2478 0.8001 -0.0740 0.0343 0.1938 23 LYS D C 6712 O O . LYS E 23 ? 1.2430 1.2312 0.8282 -0.0701 0.0612 0.1700 23 LYS D O 6713 C CB . LYS E 23 ? 1.2483 1.4141 0.9307 -0.0675 0.0161 0.2366 23 LYS D CB 6714 C CG . LYS E 23 ? 1.3301 1.5287 0.9897 -0.1255 -0.0107 0.2339 23 LYS D CG 6715 C CD . LYS E 23 ? 1.3512 1.6209 1.0595 -0.1599 -0.0142 0.2389 23 LYS D CD 6716 C CE . LYS E 23 ? 1.3579 1.5730 1.0665 -0.1775 0.0261 0.2170 23 LYS D CE 6717 N NZ . LYS E 23 ? 1.4098 1.5389 1.0555 -0.2158 0.0417 0.1819 23 LYS D NZ 6718 N N . ALA E 24 ? 1.2423 1.2732 0.7836 -0.1077 0.0157 0.1924 24 ALA D N 6719 C CA . ALA E 24 ? 1.2758 1.2458 0.7606 -0.1483 0.0320 0.1573 24 ALA D CA 6720 C C . ALA E 24 ? 1.3217 1.3006 0.7931 -0.2056 0.0314 0.1407 24 ALA D C 6721 O O . ALA E 24 ? 1.3622 1.3971 0.8290 -0.2360 0.0010 0.1566 24 ALA D O 6722 C CB . ALA E 24 ? 1.2785 1.2267 0.7045 -0.1590 0.0188 0.1621 24 ALA D CB 6723 N N . SER E 25 ? 1.3217 1.2452 0.7879 -0.2196 0.0647 0.1076 25 SER D N 6724 C CA . SER E 25 ? 1.3691 1.2803 0.8181 -0.2762 0.0735 0.0853 25 SER D CA 6725 C C . SER E 25 ? 1.4378 1.2946 0.8170 -0.3222 0.0863 0.0482 25 SER D C 6726 O O . SER E 25 ? 1.4473 1.2467 0.8108 -0.3056 0.1143 0.0238 25 SER D O 6727 C CB . SER E 25 ? 1.3575 1.2290 0.8402 -0.2621 0.1065 0.0748 25 SER D CB 6728 O OG . SER E 25 ? 1.4278 1.2701 0.8898 -0.3194 0.1216 0.0503 25 SER D OG 6729 N N . GLY E 26 ? 1.5146 1.3956 0.8529 -0.3818 0.0665 0.0415 26 GLY D N 6730 C CA . GLY E 26 ? 1.6138 1.4449 0.8738 -0.4330 0.0794 0.0043 26 GLY D CA 6731 C C . GLY E 26 ? 1.6430 1.4587 0.8569 -0.4170 0.0748 0.0103 26 GLY D C 6732 O O . GLY E 26 ? 1.6494 1.4050 0.8497 -0.4043 0.1111 -0.0172 26 GLY D O 6733 N N . GLY E 27 ? 1.6658 1.5362 0.8575 -0.4172 0.0310 0.0472 27 GLY D N 6734 C CA . GLY E 27 ? 1.6706 1.5194 0.8132 -0.4011 0.0260 0.0619 27 GLY D CA 6735 C C . GLY E 27 ? 1.6123 1.5012 0.8068 -0.3384 0.0017 0.1099 27 GLY D C 6736 O O . GLY E 27 ? 1.5782 1.4956 0.8509 -0.2989 0.0042 0.1210 27 GLY D O 6737 N N . THR E 28 ? 1.6374 1.5209 0.7823 -0.3293 -0.0186 0.1384 28 THR D N 6738 C CA . THR E 28 ? 1.6123 1.5222 0.7990 -0.2693 -0.0392 0.1836 28 THR D CA 6739 C C . THR E 28 ? 1.5666 1.4142 0.7622 -0.2332 -0.0023 0.1721 28 THR D C 6740 O O . THR E 28 ? 1.5638 1.3615 0.7464 -0.2513 0.0371 0.1298 28 THR D O 6741 C CB . THR E 28 ? 1.7014 1.6354 0.8310 -0.2716 -0.0845 0.2287 28 THR D CB 6742 O OG1 . THR E 28 ? 1.7890 1.6632 0.8488 -0.3023 -0.0695 0.2063 28 THR D OG1 6743 C CG2 . THR E 28 ? 1.7238 1.7491 0.8712 -0.2960 -0.1308 0.2453 28 THR D CG2 6744 N N . PHE E 29 ? 1.5125 1.3662 0.7345 -0.1826 -0.0143 0.2074 29 PHE D N 6745 C CA . PHE E 29 ? 1.4253 1.2222 0.6525 -0.1536 0.0178 0.1960 29 PHE D CA 6746 C C . PHE E 29 ? 1.5077 1.2362 0.6451 -0.1870 0.0346 0.1883 29 PHE D C 6747 O O . PHE E 29 ? 1.5473 1.2252 0.6819 -0.1818 0.0697 0.1657 29 PHE D O 6748 C CB . PHE E 29 ? 1.2898 1.1024 0.5619 -0.0940 0.0035 0.2334 29 PHE D CB 6749 C CG . PHE E 29 ? 1.1546 1.0179 0.5148 -0.0576 0.0053 0.2304 29 PHE D CG 6750 C CD1 . PHE E 29 ? 1.1245 0.9902 0.5164 -0.0693 0.0287 0.1928 29 PHE D CD1 6751 C CD2 . PHE E 29 ? 1.1389 1.0434 0.5468 -0.0097 -0.0139 0.2664 29 PHE D CD2 6752 C CE1 . PHE E 29 ? 1.0778 0.9819 0.5371 -0.0373 0.0319 0.1941 29 PHE D CE1 6753 C CE2 . PHE E 29 ? 1.1085 1.0572 0.5891 0.0201 -0.0071 0.2628 29 PHE D CE2 6754 C CZ . PHE E 29 ? 1.0636 1.0099 0.5646 0.0046 0.0153 0.2281 29 PHE D CZ 6755 N N . SER E 30 ? 1.5437 1.2828 0.6312 -0.2173 0.0100 0.2010 30 SER D N 6756 C CA . SER E 30 ? 1.6276 1.3147 0.6536 -0.2430 0.0236 0.1925 30 SER D CA 6757 C C . SER E 30 ? 1.6598 1.2993 0.6760 -0.2084 0.0329 0.2190 30 SER D C 6758 O O . SER E 30 ? 1.6658 1.3221 0.6947 -0.1661 0.0040 0.2660 30 SER D O 6759 C CB . SER E 30 ? 1.6317 1.2812 0.6465 -0.2851 0.0692 0.1333 30 SER D CB 6760 O OG . SER E 30 ? 1.7309 1.3339 0.6848 -0.3159 0.0834 0.1246 30 SER D OG 6761 N N . SER E 31 ? 1.6617 1.2410 0.6584 -0.2276 0.0756 0.1868 31 SER D N 6762 C CA . SER E 31 ? 1.6224 1.1432 0.6026 -0.2070 0.0922 0.2043 31 SER D CA 6763 C C . SER E 31 ? 1.5032 1.0024 0.5285 -0.1929 0.1292 0.1726 31 SER D C 6764 O O . SER E 31 ? 1.5141 0.9549 0.5237 -0.1930 0.1577 0.1667 31 SER D O 6765 C CB . SER E 31 ? 1.6856 1.1490 0.5978 -0.2463 0.1134 0.1945 31 SER D CB 6766 O OG . SER E 31 ? 1.6465 1.0956 0.5652 -0.2873 0.1555 0.1356 31 SER D OG 6767 N N . TYR E 32 ? 1.3991 0.9439 0.4764 -0.1826 0.1302 0.1513 32 TYR D N 6768 C CA . TYR E 32 ? 1.3431 0.8866 0.4785 -0.1632 0.1603 0.1167 32 TYR D CA 6769 C C . TYR E 32 ? 1.3668 0.9328 0.5605 -0.1053 0.1398 0.1433 32 TYR D C 6770 O O . TYR E 32 ? 1.3956 1.0064 0.6107 -0.0794 0.1049 0.1774 32 TYR D O 6771 C CB . TYR E 32 ? 1.2660 0.8555 0.4548 -0.1734 0.1717 0.0728 32 TYR D CB 6772 C CG . TYR E 32 ? 1.3445 0.9103 0.4865 -0.2273 0.2020 0.0357 32 TYR D CG 6773 C CD1 . TYR E 32 ? 1.3675 0.9461 0.4775 -0.2565 0.1829 0.0411 32 TYR D CD1 6774 C CD2 . TYR E 32 ? 1.3936 0.9396 0.5530 -0.2444 0.2455 -0.0105 32 TYR D CD2 6775 C CE1 . TYR E 32 ? 1.4148 0.9760 0.5053 -0.2992 0.2083 0.0024 32 TYR D CE1 6776 C CE2 . TYR E 32 ? 1.4440 0.9815 0.5954 -0.2849 0.2698 -0.0473 32 TYR D CE2 6777 C CZ . TYR E 32 ? 1.4522 0.9917 0.5651 -0.3113 0.2524 -0.0402 32 TYR D CZ 6778 O OH . TYR E 32 ? 1.5139 1.0377 0.6145 -0.3516 0.2801 -0.0781 32 TYR D OH 6779 N N . ALA E 33 ? 1.3344 0.8722 0.5547 -0.0884 0.1641 0.1240 33 ALA D N 6780 C CA . ALA E 33 ? 1.2552 0.8072 0.5264 -0.0360 0.1529 0.1396 33 ALA D CA 6781 C C . ALA E 33 ? 1.2182 0.8377 0.5662 -0.0130 0.1481 0.1144 33 ALA D C 6782 O O . ALA E 33 ? 1.2402 0.8800 0.6085 -0.0340 0.1626 0.0759 33 ALA D O 6783 C CB . ALA E 33 ? 1.2512 0.7398 0.5115 -0.0334 0.1823 0.1243 33 ALA D CB 6784 N N . ILE E 34 ? 1.1825 0.8338 0.5710 0.0322 0.1300 0.1377 34 ILE D N 6785 C CA . ILE E 34 ? 1.1055 0.8135 0.5550 0.0561 0.1261 0.1214 34 ILE D CA 6786 C C . ILE E 34 ? 1.1412 0.8434 0.6209 0.0923 0.1370 0.1080 34 ILE D C 6787 O O . ILE E 34 ? 1.2656 0.9398 0.7359 0.1169 0.1365 0.1305 34 ILE D O 6788 C CB . ILE E 34 ? 1.0706 0.8328 0.5424 0.0715 0.0987 0.1567 34 ILE D CB 6789 C CG1 . ILE E 34 ? 1.0777 0.8472 0.5137 0.0295 0.0854 0.1660 34 ILE D CG1 6790 C CG2 . ILE E 34 ? 0.9797 0.7879 0.5035 0.0923 0.1004 0.1426 34 ILE D CG2 6791 C CD1 . ILE E 34 ? 1.0638 0.8294 0.4968 -0.0050 0.1032 0.1255 34 ILE D CD1 6792 N N . SER E 35 ? 1.0833 0.8103 0.5964 0.0968 0.1467 0.0707 35 SER D N 6793 C CA . SER E 35 ? 1.1119 0.8405 0.6474 0.1266 0.1544 0.0521 35 SER D CA 6794 C C . SER E 35 ? 1.1065 0.8887 0.6779 0.1580 0.1433 0.0549 35 SER D C 6795 O O . SER E 35 ? 1.0734 0.8866 0.6564 0.1528 0.1335 0.0653 35 SER D O 6796 C CB . SER E 35 ? 1.1568 0.8707 0.6955 0.1039 0.1740 0.0025 35 SER D CB 6797 O OG . SER E 35 ? 1.2918 0.9447 0.7918 0.0741 0.1920 0.0000 35 SER D OG 6798 N N . TRP E 36 ? 1.1217 0.9076 0.7033 0.1878 0.1479 0.0447 36 TRP D N 6799 C CA . TRP E 36 ? 1.0759 0.9054 0.6785 0.2176 0.1410 0.0481 36 TRP D CA 6800 C C . TRP E 36 ? 1.0924 0.9336 0.6996 0.2264 0.1443 0.0071 36 TRP D C 6801 O O . TRP E 36 ? 1.1303 0.9463 0.7272 0.2248 0.1549 -0.0181 36 TRP D O 6802 C CB . TRP E 36 ? 1.0512 0.8865 0.6582 0.2498 0.1422 0.0795 36 TRP D CB 6803 C CG . TRP E 36 ? 1.0250 0.8780 0.6415 0.2459 0.1311 0.1212 36 TRP D CG 6804 C CD1 . TRP E 36 ? 1.0801 0.9098 0.6850 0.2384 0.1258 0.1451 36 TRP D CD1 6805 C CD2 . TRP E 36 ? 1.0157 0.9161 0.6536 0.2466 0.1223 0.1436 36 TRP D CD2 6806 N NE1 . TRP E 36 ? 1.0934 0.9650 0.7155 0.2349 0.1094 0.1791 36 TRP D NE1 6807 C CE2 . TRP E 36 ? 1.0337 0.9486 0.6786 0.2363 0.1095 0.1765 36 TRP D CE2 6808 C CE3 . TRP E 36 ? 1.0381 0.9670 0.6863 0.2534 0.1244 0.1403 36 TRP D CE3 6809 C CZ2 . TRP E 36 ? 1.0277 0.9919 0.6966 0.2271 0.0996 0.2000 36 TRP D CZ2 6810 C CZ3 . TRP E 36 ? 1.0649 1.0286 0.7312 0.2447 0.1197 0.1666 36 TRP D CZ3 6811 C CH2 . TRP E 36 ? 1.0505 1.0353 0.7306 0.2288 0.1079 0.1932 36 TRP D CH2 6812 N N . VAL E 37 ? 1.0647 0.9426 0.6852 0.2350 0.1344 0.0007 37 VAL D N 6813 C CA . VAL E 37 ? 1.0594 0.9625 0.6849 0.2476 0.1289 -0.0344 37 VAL D CA 6814 C C . VAL E 37 ? 1.0758 1.0077 0.6955 0.2802 0.1189 -0.0161 37 VAL D C 6815 O O . VAL E 37 ? 1.0974 1.0367 0.7232 0.2825 0.1143 0.0072 37 VAL D O 6816 C CB . VAL E 37 ? 1.0466 0.9666 0.6957 0.2265 0.1257 -0.0665 37 VAL D CB 6817 C CG1 . VAL E 37 ? 1.0577 1.0220 0.7201 0.2462 0.1114 -0.0981 37 VAL D CG1 6818 C CG2 . VAL E 37 ? 1.0750 0.9643 0.7233 0.1891 0.1419 -0.0891 37 VAL D CG2 6819 N N . ARG E 38 ? 1.0615 1.0025 0.6621 0.3025 0.1185 -0.0275 38 ARG D N 6820 C CA . ARG E 38 ? 1.0049 0.9678 0.5859 0.3322 0.1117 -0.0097 38 ARG D CA 6821 C C . ARG E 38 ? 1.0114 1.0066 0.5877 0.3449 0.0912 -0.0375 38 ARG D C 6822 O O . ARG E 38 ? 1.0013 1.0112 0.5938 0.3308 0.0841 -0.0780 38 ARG D O 6823 C CB . ARG E 38 ? 0.9621 0.9171 0.5163 0.3512 0.1264 -0.0015 38 ARG D CB 6824 C CG . ARG E 38 ? 0.9448 0.8980 0.4761 0.3544 0.1274 -0.0441 38 ARG D CG 6825 C CD . ARG E 38 ? 0.9412 0.8829 0.4414 0.3760 0.1474 -0.0377 38 ARG D CD 6826 N NE . ARG E 38 ? 1.0095 0.9443 0.4791 0.3753 0.1500 -0.0840 38 ARG D NE 6827 C CZ . ARG E 38 ? 1.0787 0.9978 0.5244 0.3847 0.1675 -0.0904 38 ARG D CZ 6828 N NH1 . ARG E 38 ? 1.0317 0.9466 0.4813 0.4030 0.1867 -0.0538 38 ARG D NH1 6829 N NH2 . ARG E 38 ? 1.1603 1.0714 0.5834 0.3718 0.1671 -0.1362 38 ARG D NH2 6830 N N . GLN E 39 ? 1.0126 1.0205 0.5671 0.3711 0.0814 -0.0145 39 GLN D N 6831 C CA . GLN E 39 ? 0.9964 1.0388 0.5422 0.3924 0.0557 -0.0322 39 GLN D CA 6832 C C . GLN E 39 ? 1.0431 1.0882 0.5318 0.4236 0.0509 -0.0092 39 GLN D C 6833 O O . GLN E 39 ? 1.0867 1.1102 0.5567 0.4357 0.0591 0.0326 39 GLN D O 6834 C CB . GLN E 39 ? 0.9755 1.0232 0.5556 0.3956 0.0451 -0.0248 39 GLN D CB 6835 C CG . GLN E 39 ? 0.9684 1.0587 0.5507 0.4260 0.0145 -0.0393 39 GLN D CG 6836 C CD . GLN E 39 ? 0.9293 1.0170 0.5502 0.4358 0.0097 -0.0306 39 GLN D CD 6837 O OE1 . GLN E 39 ? 0.8853 0.9313 0.5174 0.4185 0.0308 -0.0101 39 GLN D OE1 6838 N NE2 . GLN E 39 ? 0.9224 1.0575 0.5655 0.4643 -0.0185 -0.0484 39 GLN D NE2 6839 N N . ALA E 40 ? 1.0223 1.0907 0.4779 0.4320 0.0403 -0.0384 40 ALA D N 6840 C CA . ALA E 40 ? 1.0891 1.1623 0.4768 0.4601 0.0339 -0.0218 40 ALA D CA 6841 C C . ALA E 40 ? 1.1727 1.2600 0.5473 0.4896 0.0059 0.0028 40 ALA D C 6842 O O . ALA E 40 ? 1.1973 1.3126 0.6188 0.4922 -0.0171 -0.0141 40 ALA D O 6843 C CB . ALA E 40 ? 1.1188 1.2175 0.4713 0.4579 0.0243 -0.0674 40 ALA D CB 6844 N N . PRO E 41 ? 1.3488 1.5725 0.5990 0.2513 0.0845 0.3005 41 PRO D N 6845 C CA . PRO E 41 ? 1.2691 1.5565 0.5921 0.2382 0.0803 0.3549 41 PRO D CA 6846 C C . PRO E 41 ? 1.2998 1.5872 0.5812 0.2142 0.0379 0.3490 41 PRO D C 6847 O O . PRO E 41 ? 1.4078 1.6861 0.5938 0.2200 0.0239 0.3253 41 PRO D O 6848 C CB . PRO E 41 ? 1.2785 1.6147 0.5993 0.2694 0.1130 0.3824 41 PRO D CB 6849 C CG . PRO E 41 ? 1.3317 1.6417 0.6350 0.2959 0.1436 0.3614 41 PRO D CG 6850 C CD . PRO E 41 ? 1.3918 1.6248 0.6153 0.2876 0.1224 0.2999 41 PRO D CD 6851 N N . GLY E 42 ? 1.2456 1.5422 0.6019 0.1855 0.0178 0.3720 42 GLY D N 6852 C CA . GLY E 42 ? 1.2732 1.5792 0.6138 0.1604 -0.0228 0.3767 42 GLY D CA 6853 C C . GLY E 42 ? 1.3060 1.5501 0.5636 0.1433 -0.0627 0.3194 42 GLY D C 6854 O O . GLY E 42 ? 1.3503 1.5991 0.5710 0.1230 -0.1018 0.3157 42 GLY D O 6855 N N . GLN E 43 ? 1.2625 1.4412 0.5091 0.1460 -0.0536 0.2694 43 GLN D N 6856 C CA . GLN E 43 ? 1.2969 1.4034 0.4819 0.1277 -0.0875 0.2072 43 GLN D CA 6857 C C . GLN E 43 ? 1.2200 1.2800 0.4926 0.1038 -0.0912 0.1877 43 GLN D C 6858 O O . GLN E 43 ? 1.1316 1.2128 0.5059 0.0995 -0.0693 0.2194 43 GLN D O 6859 C CB . GLN E 43 ? 1.3774 1.4392 0.4453 0.1565 -0.0737 0.1587 43 GLN D CB 6860 C CG . GLN E 43 ? 1.4761 1.5706 0.4608 0.1744 -0.0670 0.1675 43 GLN D CG 6861 C CD . GLN E 43 ? 1.6350 1.6716 0.5238 0.1911 -0.0534 0.1106 43 GLN D CD 6862 O OE1 . GLN E 43 ? 1.7043 1.6726 0.5674 0.1845 -0.0630 0.0594 43 GLN D OE1 6863 N NE2 . GLN E 43 ? 1.6917 1.7543 0.5342 0.2136 -0.0283 0.1209 43 GLN D NE2 6864 N N . GLY E 44 ? 1.2737 1.2687 0.5042 0.0877 -0.1189 0.1352 44 GLY D N 6865 C CA . GLY E 44 ? 1.2185 1.1693 0.5226 0.0652 -0.1253 0.1163 44 GLY D CA 6866 C C . GLY E 44 ? 1.2176 1.1352 0.5381 0.0823 -0.0928 0.0938 44 GLY D C 6867 O O . GLY E 44 ? 1.2124 1.1493 0.5070 0.1124 -0.0605 0.1021 44 GLY D O 6868 N N . LEU E 45 ? 1.1970 1.0688 0.5634 0.0636 -0.1012 0.0694 45 LEU D N 6869 C CA . LEU E 45 ? 1.1728 1.0166 0.5626 0.0753 -0.0750 0.0510 45 LEU D CA 6870 C C . LEU E 45 ? 1.2210 1.0049 0.5305 0.0883 -0.0791 -0.0005 45 LEU D C 6871 O O . LEU E 45 ? 1.2562 1.0049 0.5068 0.0773 -0.1094 -0.0300 45 LEU D O 6872 C CB . LEU E 45 ? 1.0993 0.9287 0.5821 0.0495 -0.0783 0.0554 45 LEU D CB 6873 C CG . LEU E 45 ? 1.0396 0.9150 0.6094 0.0365 -0.0680 0.1026 45 LEU D CG 6874 C CD1 . LEU E 45 ? 1.0156 0.8635 0.6603 0.0127 -0.0691 0.0978 45 LEU D CD1 6875 C CD2 . LEU E 45 ? 0.9985 0.9195 0.5879 0.0575 -0.0338 0.1334 45 LEU D CD2 6876 N N . GLU E 46 ? 1.2055 0.9780 0.5175 0.1106 -0.0484 -0.0091 46 GLU D N 6877 C CA . GLU E 46 ? 1.2164 0.9311 0.4606 0.1281 -0.0435 -0.0536 46 GLU D CA 6878 C C . GLU E 46 ? 1.1373 0.8417 0.4321 0.1385 -0.0174 -0.0549 46 GLU D C 6879 O O . GLU E 46 ? 1.0990 0.8437 0.4214 0.1586 0.0141 -0.0265 46 GLU D O 6880 C CB . GLU E 46 ? 1.3319 1.0497 0.4779 0.1616 -0.0258 -0.0608 46 GLU D CB 6881 C CG . GLU E 46 ? 1.4526 1.0997 0.5161 0.1804 -0.0197 -0.1111 46 GLU D CG 6882 C CD . GLU E 46 ? 1.6258 1.2716 0.5844 0.2133 -0.0003 -0.1205 46 GLU D CD 6883 O OE1 . GLU E 46 ? 1.7034 1.4057 0.6657 0.2390 0.0304 -0.0819 46 GLU D OE1 6884 O OE2 . GLU E 46 ? 1.6665 1.2698 0.5779 0.2046 -0.0143 -0.1606 46 GLU D OE2 6885 N N . TRP E 47 ? 1.1328 0.7873 0.4432 0.1236 -0.0321 -0.0842 47 TRP D N 6886 C CA . TRP E 47 ? 1.0499 0.6943 0.4050 0.1315 -0.0118 -0.0858 47 TRP D CA 6887 C C . TRP E 47 ? 1.2300 0.8534 0.5283 0.1700 0.0187 -0.1006 47 TRP D C 6888 O O . TRP E 47 ? 1.2810 0.8517 0.5030 0.1810 0.0135 -0.1369 47 TRP D O 6889 C CB . TRP E 47 ? 1.0319 0.6303 0.4171 0.1063 -0.0358 -0.1100 47 TRP D CB 6890 C CG . TRP E 47 ? 1.0106 0.6031 0.4436 0.1113 -0.0188 -0.1087 47 TRP D CG 6891 C CD1 . TRP E 47 ? 0.9284 0.5563 0.4358 0.0974 -0.0126 -0.0830 47 TRP D CD1 6892 C CD2 . TRP E 47 ? 1.1014 0.6501 0.5104 0.1304 -0.0066 -0.1333 47 TRP D CD2 6893 N NE1 . TRP E 47 ? 0.8851 0.5006 0.4142 0.1058 -0.0001 -0.0879 47 TRP D NE1 6894 C CE2 . TRP E 47 ? 0.9524 0.5210 0.4268 0.1275 0.0054 -0.1161 47 TRP D CE2 6895 C CE3 . TRP E 47 ? 1.1991 0.6913 0.5367 0.1493 -0.0039 -0.1682 47 TRP D CE3 6896 C CZ2 . TRP E 47 ? 1.0247 0.5663 0.5021 0.1447 0.0204 -0.1267 47 TRP D CZ2 6897 C CZ3 . TRP E 47 ? 1.2029 0.6604 0.5449 0.1672 0.0141 -0.1816 47 TRP D CZ3 6898 C CH2 . TRP E 47 ? 1.0938 0.5798 0.5085 0.1657 0.0264 -0.1580 47 TRP D CH2 6899 N N . MET E 48 ? 1.1975 0.8609 0.5349 0.1901 0.0510 -0.0715 48 MET D N 6900 C CA . MET E 48 ? 1.2655 0.9173 0.5617 0.2310 0.0870 -0.0756 48 MET D CA 6901 C C . MET E 48 ? 1.3366 0.9612 0.6692 0.2357 0.0968 -0.0850 48 MET D C 6902 O O . MET E 48 ? 1.4411 1.0156 0.7252 0.2605 0.1128 -0.1113 48 MET D O 6903 C CB . MET E 48 ? 1.2348 0.9550 0.5545 0.2546 0.1195 -0.0295 48 MET D CB 6904 C CG . MET E 48 ? 1.3019 1.0552 0.5841 0.2575 0.1168 -0.0135 48 MET D CG 6905 S SD . MET E 48 ? 1.5063 1.3357 0.8123 0.2933 0.1619 0.0424 48 MET D SD 6906 C CE . MET E 48 ? 1.2748 1.1506 0.7092 0.2681 0.1613 0.0784 48 MET D CE 6907 N N . GLY E 49 ? 1.2568 0.9137 0.6734 0.2123 0.0886 -0.0629 49 GLY D N 6908 C CA . GLY E 49 ? 1.2437 0.8875 0.7007 0.2149 0.0963 -0.0643 49 GLY D CA 6909 C C . GLY E 49 ? 1.2171 0.9024 0.7582 0.1847 0.0838 -0.0392 49 GLY D C 6910 O O . GLY E 49 ? 1.2294 0.9487 0.8007 0.1613 0.0711 -0.0222 49 GLY D O 6911 N N . GLY E 50 ? 1.1753 0.8562 0.7526 0.1853 0.0884 -0.0368 50 GLY D N 6912 C CA . GLY E 50 ? 1.1102 0.8271 0.7572 0.1566 0.0763 -0.0164 50 GLY D CA 6913 C C . GLY E 50 ? 1.1358 0.8754 0.8200 0.1707 0.0932 0.0037 50 GLY D C 6914 O O . GLY E 50 ? 1.1937 0.9170 0.8545 0.2052 0.1174 0.0024 50 GLY D O 6915 N N . ILE E 51 ? 1.0728 0.8496 0.8138 0.1441 0.0813 0.0231 51 ILE D N 6916 C CA . ILE E 51 ? 1.0263 0.8365 0.8088 0.1523 0.0922 0.0485 51 ILE D CA 6917 C C . ILE E 51 ? 0.9637 0.7901 0.7878 0.1147 0.0681 0.0521 51 ILE D C 6918 O O . ILE E 51 ? 0.8712 0.6974 0.7021 0.0829 0.0491 0.0443 51 ILE D O 6919 C CB . ILE E 51 ? 1.0198 0.8957 0.8324 0.1702 0.1151 0.0917 51 ILE D CB 6920 C CG1 . ILE E 51 ? 1.0099 0.9182 0.8605 0.1891 0.1316 0.1212 51 ILE D CG1 6921 C CG2 . ILE E 51 ? 0.9552 0.8805 0.8084 0.1359 0.0995 0.1129 51 ILE D CG2 6922 C CD1 . ILE E 51 ? 0.9959 0.9766 0.8889 0.2042 0.1525 0.1712 51 ILE D CD1 6923 N N . ILE E 52 ? 0.9576 0.7963 0.8071 0.1199 0.0710 0.0646 52 ILE D N 6924 C CA . ILE E 52 ? 0.9208 0.7803 0.8033 0.0870 0.0500 0.0708 52 ILE D CA 6925 C C . ILE E 52 ? 0.8633 0.7984 0.7939 0.0792 0.0517 0.1135 52 ILE D C 6926 O O . ILE E 52 ? 0.8792 0.8434 0.8328 0.1017 0.0661 0.1400 52 ILE D O 6927 C CB . ILE E 52 ? 0.9788 0.8037 0.8586 0.0940 0.0477 0.0581 52 ILE D CB 6928 C CG1 . ILE E 52 ? 1.0260 0.7765 0.8635 0.1007 0.0441 0.0184 52 ILE D CG1 6929 C CG2 . ILE E 52 ? 0.9516 0.7977 0.8559 0.0603 0.0265 0.0637 52 ILE D CG2 6930 C CD1 . ILE E 52 ? 1.0823 0.7942 0.9211 0.1130 0.0461 0.0080 52 ILE D CD1 6931 N N . PRO E 53 A 0.8736 0.8406 0.8234 0.0462 0.0366 0.1220 52 PRO D N 6932 C CA . PRO E 53 A 0.8904 0.9311 0.8884 0.0308 0.0325 0.1625 52 PRO D CA 6933 C C . PRO E 53 A 0.8881 0.9665 0.9144 0.0225 0.0228 0.1842 52 PRO D C 6934 O O . PRO E 53 A 0.8450 0.9902 0.9145 0.0243 0.0256 0.2267 52 PRO D O 6935 C CB . PRO E 53 A 0.9209 0.9609 0.9238 -0.0122 0.0120 0.1509 52 PRO D CB 6936 C CG . PRO E 53 A 0.9265 0.9070 0.8901 -0.0047 0.0168 0.1176 52 PRO D CG 6937 C CD . PRO E 53 A 0.9142 0.8452 0.8435 0.0201 0.0225 0.0937 52 PRO D CD 6938 N N . ILE E 54 ? 0.9469 0.9880 0.9526 0.0138 0.0116 0.1599 53 ILE D N 6939 C CA . ILE E 54 ? 0.9501 1.0281 0.9786 0.0051 0.0012 0.1812 53 ILE D CA 6940 C C . ILE E 54 ? 0.9484 1.0410 0.9962 0.0483 0.0253 0.2079 53 ILE D C 6941 O O . ILE E 54 ? 0.9474 1.1054 1.0369 0.0506 0.0254 0.2509 53 ILE D O 6942 C CB . ILE E 54 ? 0.9939 1.0277 0.9940 -0.0164 -0.0156 0.1493 53 ILE D CB 6943 C CG1 . ILE E 54 ? 1.0294 1.0421 1.0104 -0.0565 -0.0339 0.1230 53 ILE D CG1 6944 C CG2 . ILE E 54 ? 0.9898 1.0680 1.0103 -0.0252 -0.0266 0.1748 53 ILE D CG2 6945 C CD1 . ILE E 54 ? 1.0212 1.0922 1.0268 -0.0923 -0.0518 0.1449 53 ILE D CD1 6946 N N . PHE E 55 ? 0.9373 0.9681 0.9559 0.0818 0.0458 0.1832 54 PHE D N 6947 C CA . PHE E 55 ? 0.9284 0.9547 0.9603 0.1245 0.0728 0.2011 54 PHE D CA 6948 C C . PHE E 55 ? 0.9743 1.0073 1.0073 0.1625 0.1046 0.2171 54 PHE D C 6949 O O . PHE E 55 ? 0.9850 1.0496 1.0504 0.1948 0.1299 0.2537 54 PHE D O 6950 C CB . PHE E 55 ? 0.8887 0.8358 0.8875 0.1369 0.0760 0.1628 54 PHE D CB 6951 C CG . PHE E 55 ? 0.7777 0.7169 0.7761 0.1058 0.0505 0.1507 54 PHE D CG 6952 C CD1 . PHE E 55 ? 0.7603 0.7642 0.7907 0.0840 0.0351 0.1827 54 PHE D CD1 6953 C CD2 . PHE E 55 ? 0.7477 0.6176 0.7130 0.0982 0.0418 0.1097 54 PHE D CD2 6954 C CE1 . PHE E 55 ? 0.7571 0.7530 0.7791 0.0579 0.0147 0.1715 54 PHE D CE1 6955 C CE2 . PHE E 55 ? 0.7578 0.6214 0.7236 0.0733 0.0230 0.1021 54 PHE D CE2 6956 C CZ . PHE E 55 ? 0.7639 0.6887 0.7543 0.0544 0.0110 0.1317 54 PHE D CZ 6957 N N . GLY E 56 ? 1.0038 1.0088 1.0023 0.1605 0.1058 0.1927 55 GLY D N 6958 C CA . GLY E 56 ? 1.0316 1.0385 1.0198 0.1976 0.1375 0.2044 55 GLY D CA 6959 C C . GLY E 56 ? 1.0911 1.0132 1.0190 0.2274 0.1554 0.1620 55 GLY D C 6960 O O . GLY E 56 ? 1.1546 1.0637 1.0574 0.2622 0.1847 0.1636 55 GLY D O 6961 N N . THR E 57 ? 1.1117 0.9758 1.0151 0.2128 0.1374 0.1245 56 THR D N 6962 C CA . THR E 57 ? 1.1610 0.9411 1.0088 0.2331 0.1467 0.0814 56 THR D CA 6963 C C . THR E 57 ? 1.1917 0.9466 0.9890 0.2278 0.1410 0.0546 56 THR D C 6964 O O . THR E 57 ? 1.1543 0.9073 0.9463 0.1932 0.1130 0.0391 56 THR D O 6965 C CB . THR E 57 ? 1.1671 0.8981 1.0110 0.2132 0.1244 0.0527 56 THR D CB 6966 O OG1 . THR E 57 ? 1.2460 1.0033 1.1369 0.2203 0.1309 0.0811 56 THR D OG1 6967 C CG2 . THR E 57 ? 1.1955 0.8394 0.9860 0.2302 0.1303 0.0090 56 THR D CG2 6968 N N . ALA E 58 ? 1.2244 0.9606 0.9842 0.2639 0.1701 0.0513 57 ALA D N 6969 C CA . ALA E 58 ? 1.1949 0.9122 0.9017 0.2634 0.1674 0.0301 57 ALA D CA 6970 C C . ALA E 58 ? 1.2075 0.8377 0.8445 0.2739 0.1656 -0.0197 57 ALA D C 6971 O O . ALA E 58 ? 1.2589 0.8427 0.8776 0.3021 0.1869 -0.0324 57 ALA D O 6972 C CB . ALA E 58 ? 1.1788 0.9410 0.8850 0.2949 0.2002 0.0628 57 ALA D CB 6973 N N . SER E 59 ? 1.1865 0.7943 0.7875 0.2498 0.1394 -0.0464 58 SER D N 6974 C CA . SER E 59 ? 1.2378 0.7688 0.7701 0.2533 0.1307 -0.0927 58 SER D CA 6975 C C . SER E 59 ? 1.2459 0.7781 0.7169 0.2646 0.1367 -0.1005 58 SER D C 6976 O O . SER E 59 ? 1.1851 0.7658 0.6718 0.2470 0.1252 -0.0814 58 SER D O 6977 C CB . SER E 59 ? 1.2831 0.7853 0.8265 0.2136 0.0909 -0.1158 58 SER D CB 6978 O OG . SER E 59 ? 1.3409 0.8412 0.9359 0.2056 0.0871 -0.1080 58 SER D OG 6979 N N . TYR E 60 ? 1.3800 0.8567 0.7794 0.2945 0.1562 -0.1282 59 TYR D N 6980 C CA . TYR E 60 ? 1.4669 0.9426 0.7955 0.3092 0.1645 -0.1367 59 TYR D CA 6981 C C . TYR E 60 ? 1.5577 0.9730 0.8238 0.2899 0.1352 -0.1827 59 TYR D C 6982 O O . TYR E 60 ? 1.5774 0.9509 0.8523 0.2795 0.1261 -0.2060 59 TYR D O 6983 C CB . TYR E 60 ? 1.5105 0.9909 0.8101 0.3603 0.2158 -0.1214 59 TYR D CB 6984 C CG . TYR E 60 ? 1.4298 0.9886 0.8118 0.3732 0.2405 -0.0650 59 TYR D CG 6985 C CD1 . TYR E 60 ? 1.4008 1.0380 0.8249 0.3596 0.2349 -0.0257 59 TYR D CD1 6986 C CD2 . TYR E 60 ? 1.4012 0.9574 0.8234 0.3975 0.2685 -0.0483 59 TYR D CD2 6987 C CE1 . TYR E 60 ? 1.3533 1.0631 0.8549 0.3663 0.2527 0.0261 59 TYR D CE1 6988 C CE2 . TYR E 60 ? 1.3552 0.9901 0.8560 0.4060 0.2868 0.0073 59 TYR D CE2 6989 C CZ . TYR E 60 ? 1.3489 1.0599 0.8880 0.3887 0.2770 0.0431 59 TYR D CZ 6990 O OH . TYR E 60 ? 1.3392 1.1294 0.9586 0.3922 0.2906 0.0987 59 TYR D OH 6991 N N . ALA E 61 ? 1.6186 1.0483 0.8423 0.2778 0.1171 -0.1868 60 ALA D N 6992 C CA . ALA E 61 ? 1.6670 1.0644 0.8475 0.2534 0.0859 -0.2196 60 ALA D CA 6993 C C . ALA E 61 ? 1.7873 1.1507 0.9182 0.2767 0.1089 -0.2404 60 ALA D C 6994 O O . ALA E 61 ? 1.8767 1.2513 0.9975 0.3149 0.1506 -0.2230 60 ALA D O 6995 C CB . ALA E 61 ? 1.6502 1.0795 0.7950 0.2414 0.0668 -0.2115 60 ALA D CB 6996 N N . GLN E 62 ? 1.7974 1.1207 0.9002 0.2534 0.0832 -0.2759 61 GLN D N 6997 C CA . GLN E 62 ? 1.8447 1.1250 0.8979 0.2707 0.1030 -0.3033 61 GLN D CA 6998 C C . GLN E 62 ? 1.8825 1.1791 0.8644 0.3003 0.1287 -0.2975 61 GLN D C 6999 O O . GLN E 62 ? 1.9673 1.2401 0.9170 0.3315 0.1645 -0.3042 61 GLN D O 7000 C CB . GLN E 62 ? 1.8985 1.1380 0.9364 0.2350 0.0665 -0.3429 61 GLN D CB 7001 C CG . GLN E 62 ? 2.0264 1.2105 1.0245 0.2481 0.0857 -0.3775 61 GLN D CG 7002 C CD . GLN E 62 ? 2.0991 1.2457 1.0968 0.2103 0.0492 -0.4147 61 GLN D CD 7003 O OE1 . GLN E 62 ? 2.0827 1.2484 1.1131 0.1751 0.0099 -0.4107 61 GLN D OE1 7004 N NE2 . GLN E 62 ? 2.1942 1.2874 1.1578 0.2181 0.0636 -0.4498 61 GLN D NE2 7005 N N . LYS E 63 ? 1.8392 1.1787 0.8001 0.2915 0.1124 -0.2819 62 LYS D N 7006 C CA . LYS E 63 ? 1.8802 1.2464 0.7789 0.3177 0.1351 -0.2707 62 LYS D CA 7007 C C . LYS E 63 ? 1.9419 1.3453 0.8653 0.3619 0.1846 -0.2296 62 LYS D C 7008 O O . LYS E 63 ? 2.0081 1.4048 0.8929 0.3957 0.2210 -0.2271 62 LYS D O 7009 C CB . LYS E 63 ? 1.7534 1.1650 0.6344 0.2958 0.1044 -0.2575 62 LYS D CB 7010 C CG . LYS E 63 ? 1.7457 1.1328 0.6064 0.2518 0.0542 -0.2898 62 LYS D CG 7011 C CD . LYS E 63 ? 1.7914 1.2199 0.6008 0.2421 0.0356 -0.2802 62 LYS D CD 7012 C CE . LYS E 63 ? 1.7064 1.2025 0.5504 0.2528 0.0449 -0.2305 62 LYS D CE 7013 N NZ . LYS E 63 ? 1.7225 1.2664 0.5222 0.2457 0.0299 -0.2138 62 LYS D NZ 7014 N N . PHE E 64 ? 1.9326 1.3774 0.9229 0.3608 0.1864 -0.1956 63 PHE D N 7015 C CA . PHE E 64 ? 1.9341 1.4280 0.9636 0.3979 0.2304 -0.1494 63 PHE D CA 7016 C C . PHE E 64 ? 1.9396 1.4089 1.0167 0.4138 0.2540 -0.1461 63 PHE D C 7017 O O . PHE E 64 ? 1.9248 1.4396 1.0623 0.4313 0.2784 -0.1057 63 PHE D O 7018 C CB . PHE E 64 ? 1.8556 1.4159 0.9340 0.3869 0.2222 -0.1109 63 PHE D CB 7019 C CG . PHE E 64 ? 1.8979 1.4824 0.9418 0.3643 0.1924 -0.1114 63 PHE D CG 7020 C CD1 . PHE E 64 ? 1.9500 1.5812 0.9653 0.3844 0.2110 -0.0851 63 PHE D CD1 7021 C CD2 . PHE E 64 ? 1.8819 1.4465 0.9290 0.3230 0.1460 -0.1331 63 PHE D CD2 7022 C CE1 . PHE E 64 ? 1.9678 1.6275 0.9571 0.3639 0.1842 -0.0799 63 PHE D CE1 7023 C CE2 . PHE E 64 ? 1.8948 1.4864 0.9158 0.3029 0.1189 -0.1271 63 PHE D CE2 7024 C CZ . PHE E 64 ? 1.9409 1.5815 0.9325 0.3234 0.1381 -0.1000 63 PHE D CZ 7025 N N . GLN E 65 ? 1.9641 1.3672 1.0192 0.4060 0.2466 -0.1856 64 GLN D N 7026 C CA . GLN E 65 ? 1.9167 1.2937 1.0191 0.4176 0.2658 -0.1835 64 GLN D CA 7027 C C . GLN E 65 ? 1.9265 1.3295 1.0453 0.4653 0.3201 -0.1449 64 GLN D C 7028 O O . GLN E 65 ? 1.8902 1.3270 1.0780 0.4783 0.3391 -0.1087 64 GLN D O 7029 C CB . GLN E 65 ? 1.9772 1.2811 1.0498 0.4012 0.2509 -0.2323 64 GLN D CB 7030 C CG . GLN E 65 ? 1.9716 1.2477 1.0944 0.4130 0.2715 -0.2297 64 GLN D CG 7031 C CD . GLN E 65 ? 1.8712 1.1667 1.0712 0.3895 0.2492 -0.2154 64 GLN D CD 7032 O OE1 . GLN E 65 ? 1.8568 1.1627 1.0660 0.3545 0.2092 -0.2243 64 GLN D OE1 7033 N NE2 . GLN E 65 ? 1.8183 1.1206 1.0754 0.4089 0.2757 -0.1905 64 GLN D NE2 7034 N N . GLY E 66 ? 1.9631 1.3536 1.0212 0.4909 0.3450 -0.1498 65 GLY D N 7035 C CA . GLY E 66 ? 1.9766 1.3885 1.0490 0.5373 0.3977 -0.1113 65 GLY D CA 7036 C C . GLY E 66 ? 1.9550 1.4362 1.0256 0.5593 0.4169 -0.0679 65 GLY D C 7037 O O . GLY E 66 ? 2.0277 1.5175 1.0821 0.5972 0.4572 -0.0445 65 GLY D O 7038 N N . ARG E 67 ? 1.8730 1.4047 0.9643 0.5356 0.3893 -0.0545 66 ARG D N 7039 C CA . ARG E 67 ? 1.8413 1.4464 0.9423 0.5513 0.4040 -0.0101 66 ARG D CA 7040 C C . ARG E 67 ? 1.7387 1.4226 0.9313 0.5416 0.4016 0.0390 66 ARG D C 7041 O O . ARG E 67 ? 1.7339 1.4843 0.9820 0.5657 0.4317 0.0948 66 ARG D O 7042 C CB . ARG E 67 ? 1.8228 1.4226 0.8536 0.5313 0.3750 -0.0372 66 ARG D CB 7043 C CG . ARG E 67 ? 1.8913 1.4728 0.8465 0.5593 0.3987 -0.0460 66 ARG D CG 7044 C CD . ARG E 67 ? 1.9158 1.4840 0.7965 0.5329 0.3638 -0.0809 66 ARG D CD 7045 N NE . ARG E 67 ? 1.8182 1.4522 0.7349 0.5102 0.3388 -0.0526 66 ARG D NE 7046 C CZ . ARG E 67 ? 1.7880 1.4910 0.7173 0.5257 0.3538 -0.0086 66 ARG D CZ 7047 N NH1 . ARG E 67 ? 1.8574 1.5725 0.7638 0.5655 0.3931 0.0122 66 ARG D NH1 7048 N NH2 . ARG E 67 ? 1.7202 1.4797 0.6888 0.5014 0.3304 0.0171 66 ARG D NH2 7049 N N . VAL E 68 ? 1.6629 1.3402 0.8742 0.5045 0.3652 0.0193 67 VAL D N 7050 C CA . VAL E 68 ? 1.5708 1.3201 0.8606 0.4888 0.3605 0.0602 67 VAL D CA 7051 C C . VAL E 68 ? 1.5163 1.2728 0.8866 0.4825 0.3619 0.0745 67 VAL D C 7052 O O . VAL E 68 ? 1.5504 1.2414 0.8959 0.4914 0.3663 0.0410 67 VAL D O 7053 C CB . VAL E 68 ? 1.5704 1.3192 0.8603 0.4375 0.3072 0.0390 67 VAL D CB 7054 C CG1 . VAL E 68 ? 1.5502 1.2419 0.8505 0.4041 0.2712 -0.0021 67 VAL D CG1 7055 C CG2 . VAL E 68 ? 1.5130 1.3490 0.8960 0.4110 0.2944 0.0902 67 VAL D CG2 7056 N N . THR E 69 ? 1.4213 1.2591 0.8912 0.4646 0.3561 0.1263 68 THR D N 7057 C CA . THR E 69 ? 1.3083 1.1689 0.8612 0.4519 0.3506 0.1473 68 THR D CA 7058 C C . THR E 69 ? 1.1860 1.1091 0.8216 0.4009 0.3116 0.1731 68 THR D C 7059 O O . THR E 69 ? 1.1556 1.1412 0.8268 0.3946 0.3137 0.2105 68 THR D O 7060 C CB . THR E 69 ? 1.2763 1.1779 0.8695 0.4983 0.4010 0.1968 68 THR D CB 7061 O OG1 . THR E 69 ? 1.3628 1.1934 0.8769 0.5465 0.4409 0.1681 68 THR D OG1 7062 C CG2 . THR E 69 ? 1.1756 1.1137 0.8601 0.4813 0.3906 0.2257 68 THR D CG2 7063 N N . ILE E 70 ? 1.1373 1.0402 0.8019 0.3651 0.2779 0.1526 69 ILE D N 7064 C CA . ILE E 70 ? 1.0893 1.0363 0.8192 0.3151 0.2409 0.1674 69 ILE D CA 7065 C C . ILE E 70 ? 1.0624 1.0524 0.8691 0.3026 0.2363 0.1984 69 ILE D C 7066 O O . ILE E 70 ? 1.1163 1.0731 0.9203 0.3089 0.2366 0.1830 69 ILE D O 7067 C CB . ILE E 70 ? 1.1202 1.0124 0.8181 0.2779 0.2015 0.1190 69 ILE D CB 7068 C CG1 . ILE E 70 ? 1.1511 1.0116 0.7779 0.2853 0.2005 0.0941 69 ILE D CG1 7069 C CG2 . ILE E 70 ? 1.0885 1.0181 0.8499 0.2291 0.1691 0.1321 69 ILE D CG2 7070 C CD1 . ILE E 70 ? 1.1313 0.9381 0.7268 0.2531 0.1639 0.0502 69 ILE D CD1 7071 N N . THR E 71 ? 0.9878 1.0536 0.8643 0.2835 0.2307 0.2441 70 THR D N 7072 C CA . THR E 71 ? 0.9558 1.0738 0.9062 0.2655 0.2206 0.2782 70 THR D CA 7073 C C . THR E 71 ? 0.9358 1.0850 0.9301 0.2088 0.1809 0.2816 70 THR D C 7074 O O . THR E 71 ? 0.9791 1.1211 0.9605 0.1905 0.1701 0.2702 70 THR D O 7075 C CB . THR E 71 ? 0.9747 1.1634 0.9776 0.2986 0.2551 0.3399 70 THR D CB 7076 O OG1 . THR E 71 ? 1.0496 1.2059 0.9985 0.3544 0.2994 0.3356 70 THR D OG1 7077 C CG2 . THR E 71 ? 0.9531 1.1792 1.0142 0.2961 0.2526 0.3701 70 THR D CG2 7078 N N . ALA E 72 ? 0.9301 1.1121 0.9739 0.1813 0.1604 0.2975 71 ALA D N 7079 C CA . ALA E 72 ? 0.9193 1.1251 0.9988 0.1263 0.1238 0.2977 71 ALA D CA 7080 C C . ALA E 72 ? 0.9597 1.2345 1.1058 0.1052 0.1101 0.3393 71 ALA D C 7081 O O . ALA E 72 ? 1.0085 1.2884 1.1612 0.1185 0.1135 0.3468 71 ALA D O 7082 C CB . ALA E 72 ? 0.8924 1.0308 0.9287 0.0992 0.0980 0.2439 71 ALA D CB 7083 N N . ASP E 73 ? 0.9520 1.2812 1.1498 0.0711 0.0937 0.3683 72 ASP D N 7084 C CA . ASP E 73 ? 0.9666 1.3645 1.2267 0.0405 0.0718 0.4066 72 ASP D CA 7085 C C . ASP E 73 ? 1.0013 1.3781 1.2526 -0.0175 0.0304 0.3740 72 ASP D C 7086 O O . ASP E 73 ? 0.9806 1.3485 1.2380 -0.0517 0.0152 0.3621 72 ASP D O 7087 C CB . ASP E 73 ? 0.9311 1.4078 1.2610 0.0373 0.0785 0.4647 72 ASP D CB 7088 C CG . ASP E 73 ? 0.9521 1.4666 1.3032 0.0957 0.1216 0.5104 72 ASP D CG 7089 O OD1 . ASP E 73 ? 0.9254 1.4318 1.2642 0.1272 0.1377 0.5133 72 ASP D OD1 7090 O OD2 . ASP E 73 ? 1.0143 1.5652 1.3957 0.1118 0.1423 0.5452 72 ASP D OD2 7091 N N . LYS E 74 ? 1.0805 1.4478 1.3173 -0.0268 0.0151 0.3608 73 LYS D N 7092 C CA . LYS E 74 ? 1.1113 1.4529 1.3282 -0.0772 -0.0200 0.3272 73 LYS D CA 7093 C C . LYS E 74 ? 1.1130 1.5183 1.3801 -0.1269 -0.0501 0.3565 73 LYS D C 7094 O O . LYS E 74 ? 1.1441 1.5255 1.3939 -0.1740 -0.0779 0.3275 73 LYS D O 7095 C CB . LYS E 74 ? 1.1725 1.4921 1.3606 -0.0699 -0.0255 0.3105 73 LYS D CB 7096 C CG . LYS E 74 ? 1.2182 1.4890 1.3655 -0.1099 -0.0519 0.2652 73 LYS D CG 7097 C CD . LYS E 74 ? 1.2158 1.4110 1.3218 -0.1098 -0.0443 0.2198 73 LYS D CD 7098 C CE . LYS E 74 ? 1.2095 1.3573 1.2804 -0.1484 -0.0656 0.1794 73 LYS D CE 7099 N NZ . LYS E 74 ? 1.2213 1.4008 1.3124 -0.1993 -0.0915 0.1864 73 LYS D NZ 7100 N N . SER E 75 ? 1.4469 2.1411 1.2429 -0.2878 -0.1371 0.3193 74 SER D N 7101 C CA . SER E 75 ? 1.4981 2.2215 1.2544 -0.3618 -0.1838 0.3295 74 SER D CA 7102 C C . SER E 75 ? 1.4813 2.1195 1.1939 -0.3990 -0.1822 0.2875 74 SER D C 7103 O O . SER E 75 ? 1.5824 2.1615 1.2014 -0.4600 -0.2092 0.2608 74 SER D O 7104 C CB . SER E 75 ? 1.4793 2.3451 1.3342 -0.3703 -0.2132 0.4001 74 SER D CB 7105 O OG . SER E 75 ? 1.4204 2.3143 1.3628 -0.3345 -0.1886 0.4158 74 SER D OG 7106 N N . THR E 76 ? 1.3924 2.0171 1.1660 -0.3614 -0.1504 0.2817 75 THR D N 7107 C CA . THR E 76 ? 1.3719 1.9205 1.1181 -0.3885 -0.1433 0.2491 75 THR D CA 7108 C C . THR E 76 ? 1.3586 1.7913 1.0582 -0.3479 -0.0971 0.1968 75 THR D C 7109 O O . THR E 76 ? 1.3371 1.6926 1.0075 -0.3612 -0.0831 0.1674 75 THR D O 7110 C CB . THR E 76 ? 1.2412 1.8638 1.0887 -0.3774 -0.1403 0.2869 75 THR D CB 7111 O OG1 . THR E 76 ? 1.1244 1.7677 1.0347 -0.2996 -0.1017 0.2948 75 THR D OG1 7112 C CG2 . THR E 76 ? 1.2055 1.9581 1.1145 -0.4161 -0.1838 0.3507 75 THR D CG2 7113 N N . SER E 77 ? 1.3779 1.8039 1.0778 -0.2990 -0.0739 0.1919 76 SER D N 7114 C CA . SER E 77 ? 1.3698 1.7068 1.0424 -0.2577 -0.0318 0.1548 76 SER D CA 7115 C C . SER E 77 ? 1.3130 1.6347 1.0409 -0.2269 -0.0079 0.1485 76 SER D C 7116 O O . SER E 77 ? 1.3489 1.5876 1.0409 -0.2215 0.0171 0.1169 76 SER D O 7117 C CB . SER E 77 ? 1.4952 1.7246 1.0523 -0.2878 -0.0234 0.1130 76 SER D CB 7118 O OG . SER E 77 ? 1.5064 1.6666 1.0468 -0.2424 0.0206 0.0892 76 SER D OG 7119 N N . THR E 78 ? 1.2132 1.6148 1.0244 -0.2026 -0.0131 0.1816 77 THR D N 7120 C CA . THR E 78 ? 1.0598 1.4539 0.9172 -0.1685 0.0084 0.1793 77 THR D CA 7121 C C . THR E 78 ? 0.9142 1.3327 0.8218 -0.1083 0.0226 0.1898 77 THR D C 7122 O O . THR E 78 ? 0.8109 1.2877 0.7492 -0.0939 0.0118 0.2177 77 THR D O 7123 C CB . THR E 78 ? 1.0055 1.4613 0.9073 -0.1910 -0.0059 0.2098 77 THR D CB 7124 O OG1 . THR E 78 ? 0.9954 1.5540 0.9553 -0.1794 -0.0218 0.2563 77 THR D OG1 7125 C CG2 . THR E 78 ? 1.0321 1.4580 0.8842 -0.2613 -0.0288 0.2013 77 THR D CG2 7126 N N . ALA E 79 ? 0.9324 1.3012 0.8450 -0.0744 0.0450 0.1687 78 ALA D N 7127 C CA . ALA E 79 ? 0.8774 1.2507 0.8254 -0.0230 0.0532 0.1728 78 ALA D CA 7128 C C . ALA E 79 ? 0.9006 1.2945 0.8785 0.0057 0.0612 0.1827 78 ALA D C 7129 O O . ALA E 79 ? 0.9590 1.3436 0.9311 -0.0086 0.0682 0.1784 78 ALA D O 7130 C CB . ALA E 79 ? 0.8603 1.1677 0.7915 -0.0067 0.0665 0.1468 78 ALA D CB 7131 N N . TYR E 80 ? 0.8637 1.2791 0.8677 0.0486 0.0629 0.1971 79 TYR D N 7132 C CA . TYR E 80 ? 0.8785 1.3088 0.8974 0.0857 0.0753 0.2073 79 TYR D CA 7133 C C . TYR E 80 ? 0.8867 1.2627 0.8918 0.1329 0.0803 0.1877 79 TYR D C 7134 O O . TYR E 80 ? 0.8669 1.2128 0.8693 0.1399 0.0714 0.1791 79 TYR D O 7135 C CB . TYR E 80 ? 0.8710 1.3845 0.9273 0.0974 0.0758 0.2523 79 TYR D CB 7136 C CG . TYR E 80 ? 0.8450 1.4216 0.9206 0.0440 0.0622 0.2786 79 TYR D CG 7137 C CD1 . TYR E 80 ? 0.8139 1.4118 0.9015 0.0249 0.0675 0.2901 79 TYR D CD1 7138 C CD2 . TYR E 80 ? 0.8524 1.4662 0.9324 0.0094 0.0408 0.2944 79 TYR D CD2 7139 C CE1 . TYR E 80 ? 0.8337 1.4824 0.9388 -0.0328 0.0480 0.3150 79 TYR D CE1 7140 C CE2 . TYR E 80 ? 0.8721 1.5386 0.9614 -0.0470 0.0195 0.3173 79 TYR D CE2 7141 C CZ . TYR E 80 ? 0.8631 1.5441 0.9658 -0.0707 0.0214 0.3268 79 TYR D CZ 7142 O OH . TYR E 80 ? 0.8710 1.5977 0.9829 -0.1354 -0.0065 0.3503 79 TYR D OH 7143 N N . MET E 81 ? 0.9170 1.2785 0.9101 0.1625 0.0921 0.1826 80 MET D N 7144 C CA . MET E 81 ? 0.9569 1.2601 0.9219 0.2049 0.0913 0.1621 80 MET D CA 7145 C C . MET E 81 ? 0.9535 1.2707 0.9030 0.2507 0.1099 0.1752 80 MET D C 7146 O O . MET E 81 ? 0.9262 1.2600 0.8729 0.2488 0.1216 0.1799 80 MET D O 7147 C CB . MET E 81 ? 0.9768 1.2247 0.9236 0.1905 0.0827 0.1321 80 MET D CB 7148 C CG . MET E 81 ? 1.0144 1.1996 0.9297 0.2220 0.0699 0.1104 80 MET D CG 7149 S SD . MET E 81 ? 0.9852 1.1548 0.8562 0.2617 0.0807 0.1043 80 MET D SD 7150 C CE . MET E 81 ? 0.9750 1.1689 0.8658 0.2279 0.0906 0.1076 80 MET D CE 7151 N N . GLU E 82 ? 0.9893 1.2955 0.9256 0.2955 0.1165 0.1839 81 GLU D N 7152 C CA . GLU E 82 ? 1.0385 1.3554 0.9512 0.3501 0.1421 0.2004 81 GLU D CA 7153 C C . GLU E 82 ? 1.1117 1.3319 0.9511 0.3942 0.1384 0.1654 81 GLU D C 7154 O O . GLU E 82 ? 1.1498 1.3113 0.9654 0.4131 0.1289 0.1518 81 GLU D O 7155 C CB . GLU E 82 ? 1.0373 1.4188 0.9852 0.3775 0.1610 0.2457 81 GLU D CB 7156 C CG . GLU E 82 ? 1.0766 1.4905 1.0119 0.4374 0.1973 0.2768 81 GLU D CG 7157 C CD . GLU E 82 ? 1.0954 1.5996 1.0870 0.4604 0.2184 0.3364 81 GLU D CD 7158 O OE1 . GLU E 82 ? 1.1668 1.7073 1.1562 0.5173 0.2550 0.3723 81 GLU D OE1 7159 O OE2 . GLU E 82 ? 1.0403 1.5844 1.0790 0.4240 0.1998 0.3520 81 GLU D OE2 7160 N N . LEU E 83 ? 1.1031 1.3025 0.9026 0.4080 0.1435 0.1517 82 LEU D N 7161 C CA . LEU E 83 ? 1.1160 1.2213 0.8318 0.4446 0.1336 0.1166 82 LEU D CA 7162 C C . LEU E 83 ? 1.1637 1.2672 0.8248 0.5130 0.1694 0.1318 82 LEU D C 7163 O O . LEU E 83 ? 1.1908 1.3446 0.8552 0.5236 0.1911 0.1521 82 LEU D O 7164 C CB . LEU E 83 ? 1.0423 1.1216 0.7427 0.4135 0.1099 0.0912 82 LEU D CB 7165 C CG . LEU E 83 ? 1.0979 1.0816 0.7121 0.4355 0.0848 0.0538 82 LEU D CG 7166 C CD1 . LEU E 83 ? 1.1813 1.0871 0.7764 0.4296 0.0556 0.0298 82 LEU D CD1 7167 C CD2 . LEU E 83 ? 1.0188 1.0039 0.6384 0.4018 0.0622 0.0427 82 LEU D CD2 7168 N N . SER E 84 A 1.2126 1.2543 0.8216 0.5627 0.1793 0.1249 82 SER D N 7169 C CA . SER E 84 A 1.2999 1.3317 0.8475 0.6397 0.2221 0.1420 82 SER D CA 7170 C C . SER E 84 A 1.4608 1.3696 0.8794 0.6766 0.2104 0.0943 82 SER D C 7171 O O . SER E 84 A 1.5127 1.3479 0.8999 0.6376 0.1633 0.0509 82 SER D O 7172 C CB . SER E 84 A 1.3224 1.3608 0.8857 0.6834 0.2504 0.1711 82 SER D CB 7173 O OG . SER E 84 A 1.3604 1.2927 0.8853 0.6792 0.2228 0.1346 82 SER D OG 7174 N N . SER E 85 B 1.5295 1.4196 0.8764 0.7422 0.2479 0.1082 82 SER D N 7175 C CA . SER E 85 B 1.5223 1.2943 0.7336 0.7737 0.2344 0.0678 82 SER D CA 7176 C C . SER E 85 B 1.7134 1.4788 0.8976 0.7442 0.2035 0.0365 82 SER D C 7177 O O . SER E 85 B 1.5756 1.2360 0.6785 0.7289 0.1583 -0.0138 82 SER D O 7178 C CB . SER E 85 B 1.6399 1.2685 0.7673 0.7881 0.2106 0.0214 82 SER D CB 7179 O OG . SER E 85 B 1.9026 1.4104 0.8912 0.8127 0.1919 -0.0182 82 SER D OG 7180 N N . LEU E 86 C 1.5793 1.4594 0.8415 0.7227 0.2202 0.0736 82 LEU D N 7181 C CA . LEU E 86 C 1.5977 1.4926 0.8665 0.6785 0.1891 0.0598 82 LEU D CA 7182 C C . LEU E 86 C 1.7909 1.6058 0.9261 0.7160 0.1782 0.0300 82 LEU D C 7183 O O . LEU E 86 C 1.8493 1.6516 0.9405 0.7611 0.2021 0.0498 82 LEU D O 7184 C CB . LEU E 86 C 1.4775 1.5005 0.8488 0.6561 0.2175 0.1102 82 LEU D CB 7185 C CG . LEU E 86 C 1.3499 1.4524 0.8485 0.6010 0.2159 0.1359 82 LEU D CG 7186 C CD1 . LEU E 86 C 1.2767 1.4875 0.8556 0.5828 0.2439 0.1848 82 LEU D CD1 7187 C CD2 . LEU E 86 C 1.2690 1.3366 0.7992 0.5360 0.1666 0.1026 82 LEU D CD2 7188 N N . ARG E 87 ? 1.8972 1.6656 1.0099 0.6700 0.1227 -0.0040 83 ARG D N 7189 C CA . ARG E 87 ? 2.0184 1.7223 1.0104 0.6913 0.0998 -0.0299 83 ARG D CA 7190 C C . ARG E 87 ? 1.9235 1.7084 0.9758 0.6542 0.0888 -0.0068 83 ARG D C 7191 O O . ARG E 87 ? 1.8018 1.6736 0.9805 0.6109 0.0974 0.0221 83 ARG D O 7192 C CB . ARG E 87 ? 2.1718 1.7470 1.0773 0.6682 0.0360 -0.0851 83 ARG D CB 7193 C CG . ARG E 87 ? 2.3665 1.8371 1.2003 0.7057 0.0453 -0.1116 83 ARG D CG 7194 C CD . ARG E 87 ? 2.5530 1.8859 1.2996 0.6735 -0.0248 -0.1661 83 ARG D CD 7195 N NE . ARG E 87 ? 2.7266 1.9419 1.3975 0.7111 -0.0139 -0.1916 83 ARG D NE 7196 C CZ . ARG E 87 ? 2.8650 1.9394 1.4534 0.6876 -0.0694 -0.2385 83 ARG D CZ 7197 N NH1 . ARG E 87 ? 2.9051 1.9476 1.4779 0.6246 -0.1438 -0.2634 83 ARG D NH1 7198 N NH2 . ARG E 87 ? 2.9392 1.9196 1.4857 0.7165 -0.0531 -0.2477 83 ARG D NH2 7199 N N . SER E 88 ? 1.9739 1.7241 0.9287 0.6725 0.0698 -0.0193 84 SER D N 7200 C CA . SER E 88 ? 1.7928 1.6158 0.7974 0.6451 0.0613 0.0070 84 SER D CA 7201 C C . SER E 88 ? 1.6674 1.5044 0.7614 0.5712 0.0099 0.0002 84 SER D C 7202 O O . SER E 88 ? 1.5554 1.4694 0.7400 0.5418 0.0169 0.0316 84 SER D O 7203 C CB . SER E 88 ? 1.8171 1.5996 0.7155 0.6740 0.0456 -0.0030 84 SER D CB 7204 O OG . SER E 88 ? 1.9239 1.5952 0.7153 0.6610 -0.0163 -0.0537 84 SER D OG 7205 N N . GLU E 89 ? 1.7014 1.4614 0.7706 0.5437 -0.0383 -0.0372 85 GLU D N 7206 C CA . GLU E 89 ? 1.6390 1.4133 0.7924 0.4774 -0.0868 -0.0383 85 GLU D CA 7207 C C . GLU E 89 ? 1.5076 1.3486 0.7974 0.4449 -0.0594 -0.0154 85 GLU D C 7208 O O . GLU E 89 ? 1.4355 1.3046 0.8082 0.3963 -0.0841 -0.0065 85 GLU D O 7209 C CB . GLU E 89 ? 1.7727 1.4421 0.8584 0.4548 -0.1497 -0.0804 85 GLU D CB 7210 C CG . GLU E 89 ? 1.9806 1.5615 0.9089 0.4805 -0.1872 -0.1117 85 GLU D CG 7211 C CD . GLU E 89 ? 2.1413 1.6332 0.9402 0.5465 -0.1535 -0.1400 85 GLU D CD 7212 O OE1 . GLU E 89 ? 2.2754 1.7140 0.9364 0.5890 -0.1560 -0.1564 85 GLU D OE1 7213 O OE2 . GLU E 89 ? 2.1373 1.6129 0.9694 0.5596 -0.1223 -0.1429 85 GLU D OE2 7214 N N . ASP E 90 ? 1.4590 1.3273 0.7688 0.4731 -0.0082 -0.0025 86 ASP D N 7215 C CA . ASP E 90 ? 1.2918 1.2193 0.7150 0.4421 0.0150 0.0178 86 ASP D CA 7216 C C . ASP E 90 ? 1.1576 1.1690 0.6583 0.4248 0.0441 0.0536 86 ASP D C 7217 O O . ASP E 90 ? 1.0392 1.0919 0.6257 0.3908 0.0571 0.0679 86 ASP D O 7218 C CB . ASP E 90 ? 1.2596 1.1880 0.6774 0.4748 0.0516 0.0227 86 ASP D CB 7219 C CG . ASP E 90 ? 1.3508 1.1852 0.6998 0.4912 0.0279 -0.0112 86 ASP D CG 7220 O OD1 . ASP E 90 ? 1.4188 1.1990 0.7608 0.4559 -0.0215 -0.0360 86 ASP D OD1 7221 O OD2 . ASP E 90 ? 1.3718 1.1860 0.6773 0.5398 0.0600 -0.0089 86 ASP D OD2 7222 N N . THR E 91 ? 1.1657 1.1940 0.6277 0.4493 0.0545 0.0678 87 THR D N 7223 C CA . THR E 91 ? 1.0013 1.0964 0.5293 0.4360 0.0828 0.1036 87 THR D CA 7224 C C . THR E 91 ? 1.0273 1.1323 0.6256 0.3881 0.0606 0.1064 87 THR D C 7225 O O . THR E 91 ? 1.0668 1.1583 0.6471 0.3817 0.0275 0.1035 87 THR D O 7226 C CB . THR E 91 ? 1.0618 1.1693 0.5301 0.4738 0.0945 0.1212 87 THR D CB 7227 O OG1 . THR E 91 ? 1.1300 1.2290 0.5282 0.5266 0.1227 0.1230 87 THR D OG1 7228 C CG2 . THR E 91 ? 0.9966 1.1664 0.5382 0.4601 0.1273 0.1622 87 THR D CG2 7229 N N . ALA E 92 ? 0.9470 1.0770 0.6227 0.3561 0.0792 0.1152 88 ALA D N 7230 C CA . ALA E 92 ? 0.9397 1.0736 0.6778 0.3177 0.0675 0.1189 88 ALA D CA 7231 C C . ALA E 92 ? 0.9088 1.0661 0.7098 0.2906 0.1008 0.1316 88 ALA D C 7232 O O . ALA E 92 ? 0.9278 1.1041 0.7316 0.2944 0.1251 0.1387 88 ALA D O 7233 C CB . ALA E 92 ? 0.9826 1.0809 0.7179 0.3000 0.0258 0.0951 88 ALA D CB 7234 N N . VAL E 93 ? 0.8486 1.0034 0.6968 0.2636 0.1012 0.1368 89 VAL D N 7235 C CA . VAL E 93 ? 0.7995 0.9563 0.6883 0.2353 0.1279 0.1410 89 VAL D CA 7236 C C . VAL E 93 ? 0.7799 0.9248 0.6805 0.2156 0.1115 0.1226 89 VAL D C 7237 O O . VAL E 93 ? 0.7800 0.9133 0.6915 0.2110 0.0873 0.1172 89 VAL D O 7238 C CB . VAL E 93 ? 0.8396 0.9892 0.7618 0.2249 0.1480 0.1584 89 VAL D CB 7239 C CG1 . VAL E 93 ? 0.8383 0.9698 0.7783 0.1963 0.1762 0.1565 89 VAL D CG1 7240 C CG2 . VAL E 93 ? 0.8372 0.9995 0.7515 0.2470 0.1629 0.1821 89 VAL D CG2 7241 N N . TYR E 94 ? 0.7985 0.9522 0.7020 0.2026 0.1229 0.1187 90 TYR D N 7242 C CA . TYR E 94 ? 0.8010 0.9489 0.7135 0.1870 0.1089 0.1059 90 TYR D CA 7243 C C . TYR E 94 ? 0.7950 0.9362 0.7302 0.1547 0.1254 0.1072 90 TYR D C 7244 O O . TYR E 94 ? 0.8059 0.9513 0.7400 0.1372 0.1452 0.1129 90 TYR D O 7245 C CB . TYR E 94 ? 0.8152 0.9820 0.7123 0.1989 0.1075 0.1051 90 TYR D CB 7246 C CG . TYR E 94 ? 0.8791 1.0327 0.7352 0.2374 0.0929 0.0978 90 TYR D CG 7247 C CD1 . TYR E 94 ? 0.8971 1.0608 0.7248 0.2655 0.1053 0.1075 90 TYR D CD1 7248 C CD2 . TYR E 94 ? 0.8753 0.9975 0.7129 0.2467 0.0675 0.0811 90 TYR D CD2 7249 C CE1 . TYR E 94 ? 0.9114 1.0511 0.6816 0.3047 0.0938 0.0973 90 TYR D CE1 7250 C CE2 . TYR E 94 ? 0.9148 1.0034 0.6957 0.2822 0.0536 0.0684 90 TYR D CE2 7251 C CZ . TYR E 94 ? 0.9593 1.0552 0.7009 0.3125 0.0673 0.0748 90 TYR D CZ 7252 O OH . TYR E 94 ? 1.0859 1.1376 0.7524 0.3516 0.0552 0.0590 90 TYR D OH 7253 N N . TYR E 95 ? 0.7891 0.9163 0.7405 0.1462 0.1164 0.1035 91 TYR D N 7254 C CA . TYR E 95 ? 0.7811 0.8938 0.7402 0.1231 0.1357 0.1040 91 TYR D CA 7255 C C . TYR E 95 ? 0.7865 0.9063 0.7470 0.1090 0.1238 0.0981 91 TYR D C 7256 O O . TYR E 95 ? 0.7619 0.8893 0.7324 0.1186 0.0996 0.0965 91 TYR D O 7257 C CB . TYR E 95 ? 0.7884 0.8877 0.7705 0.1299 0.1454 0.1157 91 TYR D CB 7258 C CG . TYR E 95 ? 0.8285 0.9230 0.8145 0.1455 0.1609 0.1288 91 TYR D CG 7259 C CD1 . TYR E 95 ? 0.8506 0.9154 0.8242 0.1405 0.1974 0.1329 91 TYR D CD1 7260 C CD2 . TYR E 95 ? 0.8644 0.9779 0.8607 0.1649 0.1379 0.1378 91 TYR D CD2 7261 C CE1 . TYR E 95 ? 0.8793 0.9385 0.8604 0.1577 0.2147 0.1501 91 TYR D CE1 7262 C CE2 . TYR E 95 ? 0.8965 1.0130 0.8978 0.1809 0.1516 0.1554 91 TYR D CE2 7263 C CZ . TYR E 95 ? 0.8856 0.9775 0.8842 0.1791 0.1922 0.1638 91 TYR D CZ 7264 O OH . TYR E 95 ? 0.8949 0.9883 0.9021 0.1979 0.2089 0.1863 91 TYR D OH 7265 N N . CYS E 96 ? 0.8231 0.9341 0.7678 0.0854 0.1397 0.0951 92 CYS D N 7266 C CA . CYS E 96 ? 0.8374 0.9557 0.7809 0.0721 0.1320 0.0943 92 CYS D CA 7267 C C . CYS E 96 ? 0.8769 0.9671 0.8148 0.0674 0.1541 0.0970 92 CYS D C 7268 O O . CYS E 96 ? 0.9704 1.0259 0.8818 0.0618 0.1807 0.0928 92 CYS D O 7269 C CB . CYS E 96 ? 0.8684 1.0054 0.7903 0.0483 0.1282 0.0927 92 CYS D CB 7270 S SG . CYS E 96 ? 1.1290 1.2295 1.0068 0.0141 0.1493 0.0843 92 CYS D SG 7271 N N . ALA E 97 ? 0.8235 0.9244 0.7854 0.0727 0.1465 0.1070 93 ALA D N 7272 C CA . ALA E 97 ? 0.8128 0.8966 0.7767 0.0768 0.1727 0.1187 93 ALA D CA 7273 C C . ALA E 97 ? 0.7888 0.8810 0.7406 0.0664 0.1732 0.1240 93 ALA D C 7274 O O . ALA E 97 ? 0.7798 0.8988 0.7457 0.0605 0.1469 0.1260 93 ALA D O 7275 C CB . ALA E 97 ? 0.8083 0.9075 0.8287 0.0958 0.1674 0.1406 93 ALA D CB 7276 N N . ARG E 98 ? 0.7859 0.8517 0.7064 0.0685 0.2068 0.1284 94 ARG D N 7277 C CA . ARG E 98 ? 0.8129 0.8860 0.7127 0.0624 0.2124 0.1369 94 ARG D CA 7278 C C . ARG E 98 ? 0.8267 0.9228 0.7821 0.0828 0.2249 0.1712 94 ARG D C 7279 O O . ARG E 98 ? 0.8784 0.9653 0.8544 0.1029 0.2526 0.1872 94 ARG D O 7280 C CB . ARG E 98 ? 0.9112 0.9326 0.7208 0.0513 0.2419 0.1186 94 ARG D CB 7281 C CG . ARG E 98 ? 0.9677 0.9977 0.7373 0.0419 0.2427 0.1245 94 ARG D CG 7282 C CD . ARG E 98 ? 1.0468 1.0089 0.7083 0.0332 0.2731 0.1036 94 ARG D CD 7283 N NE . ARG E 98 ? 1.0896 1.0137 0.7352 0.0682 0.3248 0.1172 94 ARG D NE 7284 C CZ . ARG E 98 ? 1.2033 1.0606 0.7473 0.0749 0.3623 0.1050 94 ARG D CZ 7285 N NH1 . ARG E 98 ? 1.2805 1.1004 0.7266 0.0407 0.3452 0.0758 94 ARG D NH1 7286 N NH2 . ARG E 98 ? 1.2374 1.0650 0.7743 0.1166 0.4166 0.1246 94 ARG D NH2 7287 N N . VAL E 99 ? 0.7894 0.9197 0.7761 0.0782 0.2052 0.1887 95 VAL D N 7288 C CA . VAL E 99 ? 0.7694 0.9272 0.8154 0.0920 0.2157 0.2289 95 VAL D CA 7289 C C . VAL E 99 ? 0.8054 0.9475 0.8010 0.1055 0.2639 0.2416 95 VAL D C 7290 O O . VAL E 99 ? 0.8514 1.0004 0.8125 0.0991 0.2660 0.2459 95 VAL D O 7291 C CB . VAL E 99 ? 0.7503 0.9409 0.8457 0.0818 0.1800 0.2465 95 VAL D CB 7292 C CG1 . VAL E 99 ? 0.7161 0.9380 0.8888 0.0903 0.1857 0.2944 95 VAL D CG1 7293 C CG2 . VAL E 99 ? 0.7361 0.9233 0.8535 0.0734 0.1366 0.2264 95 VAL D CG2 7294 N N . GLY E 100 ? 0.8056 0.9238 0.7909 0.1280 0.3050 0.2493 96 GLY D N 7295 C CA . GLY E 100 ? 0.8524 0.9372 0.7703 0.1497 0.3599 0.2573 96 GLY D CA 7296 C C . GLY E 100 ? 0.9573 1.0893 0.9286 0.1707 0.3828 0.3110 96 GLY D C 7297 O O . GLY E 100 ? 0.9912 1.1150 0.9040 0.1762 0.4050 0.3164 96 GLY D O 7298 N N . TYR E 101 ? 0.9701 1.1551 1.0533 0.1805 0.3754 0.3548 97 TYR D N 7299 C CA . TYR E 101 ? 0.9906 1.2319 1.1464 0.1982 0.3965 0.4178 97 TYR D CA 7300 C C . TYR E 101 ? 0.9839 1.2789 1.2363 0.1691 0.3391 0.4415 97 TYR D C 7301 O O . TYR E 101 ? 0.9942 1.3017 1.3078 0.1501 0.2933 0.4364 97 TYR D O 7302 C CB . TYR E 101 ? 0.9685 1.2354 1.1875 0.2323 0.4373 0.4648 97 TYR D CB 7303 C CG . TYR E 101 ? 1.0885 1.2799 1.2091 0.2658 0.4870 0.4352 97 TYR D CG 7304 C CD1 . TYR E 101 ? 1.1866 1.3393 1.2382 0.2960 0.5271 0.4365 97 TYR D CD1 7305 C CD2 . TYR E 101 ? 1.1173 1.2678 1.2113 0.2670 0.4913 0.4055 97 TYR D CD2 7306 C CE1 . TYR E 101 ? 1.3060 1.3728 1.2613 0.3246 0.5691 0.4075 97 TYR D CE1 7307 C CE2 . TYR E 101 ? 1.2266 1.2937 1.2309 0.2946 0.5326 0.3783 97 TYR D CE2 7308 C CZ . TYR E 101 ? 1.3449 1.3661 1.2784 0.3225 0.5710 0.3787 97 TYR D CZ 7309 O OH . TYR E 101 ? 1.4922 1.4169 1.3304 0.3492 0.6119 0.3521 97 TYR D OH 7310 N N . CYS E 102 ? 0.9762 1.2952 1.2339 0.1666 0.3422 0.4672 98 CYS D N 7311 C CA . CYS E 102 ? 0.8734 1.2293 1.2160 0.1399 0.2919 0.4917 98 CYS D CA 7312 C C . CYS E 102 ? 0.8796 1.2905 1.3516 0.1374 0.2806 0.5528 98 CYS D C 7313 O O . CYS E 102 ? 0.9482 1.3938 1.4553 0.1651 0.3270 0.5999 98 CYS D O 7314 C CB . CYS E 102 ? 0.8087 1.1790 1.1263 0.1412 0.3040 0.5121 98 CYS D CB 7315 S SG . CYS E 102 ? 1.4407 1.7645 1.6255 0.1303 0.2952 0.4500 98 CYS D SG 7316 N N . SER E 103 ? 0.8423 1.2587 1.3826 0.1043 0.2183 0.5542 99 SER D N 7317 C CA . SER E 103 ? 0.8154 1.2824 1.4814 0.0883 0.1918 0.6134 99 SER D CA 7318 C C . SER E 103 ? 0.8350 1.3497 1.5717 0.0859 0.2042 0.6803 99 SER D C 7319 O O . SER E 103 ? 0.8865 1.3957 1.5666 0.1024 0.2384 0.6798 99 SER D O 7320 C CB . SER E 103 ? 0.7791 1.2153 1.4729 0.0503 0.1162 0.5844 99 SER D CB 7321 O OG . SER E 103 ? 0.7626 1.1617 1.4348 0.0316 0.0844 0.5634 99 SER D OG 7322 N N . SER E 104 ? 1.6841 0.7521 0.8246 -0.0883 0.4411 -0.0721 100 SER D N 7323 C CA . SER E 104 ? 1.7988 0.8125 0.9041 -0.1024 0.4600 -0.0721 100 SER D CA 7324 C C . SER E 104 ? 1.9320 0.8792 0.9809 -0.0913 0.4627 -0.0632 100 SER D C 7325 O O . SER E 104 ? 2.0427 0.9361 1.0535 -0.1168 0.4789 -0.0674 100 SER D O 7326 C CB . SER E 104 ? 1.8166 0.8351 0.9314 -0.1476 0.4795 -0.0849 100 SER D CB 7327 O OG . SER E 104 ? 1.8288 0.8384 0.9279 -0.1729 0.4788 -0.0906 100 SER D OG 7328 N N . THR E 105 A 1.9162 0.8653 0.9570 -0.0532 0.4492 -0.0500 100 THR D N 7329 C CA . THR E 105 A 1.9344 0.8234 0.9240 -0.0348 0.4543 -0.0385 100 THR D CA 7330 C C . THR E 105 A 1.8797 0.7783 0.8638 0.0136 0.4442 -0.0206 100 THR D C 7331 O O . THR E 105 A 1.9316 0.7805 0.8741 0.0353 0.4524 -0.0085 100 THR D O 7332 C CB . THR E 105 A 1.9819 0.8584 0.9600 -0.0487 0.4539 -0.0429 100 THR D CB 7333 O OG1 . THR E 105 A 2.0556 0.8989 1.0135 -0.0965 0.4673 -0.0568 100 THR D OG1 7334 C CG2 . THR E 105 A 2.0131 0.8338 0.9430 -0.0175 0.4587 -0.0272 100 THR D CG2 7335 N N . SER E 106 B 1.8054 0.7674 0.8286 0.0299 0.4275 -0.0182 100 SER D N 7336 C CA . SER E 106 B 1.8102 0.7908 0.8284 0.0728 0.4182 0.0001 100 SER D CA 7337 C C . SER E 106 B 1.7856 0.8398 0.8480 0.0765 0.3997 -0.0006 100 SER D C 7338 O O . SER E 106 B 1.7622 0.8493 0.8604 0.0488 0.3951 -0.0162 100 SER D O 7339 C CB . SER E 106 B 1.8325 0.7904 0.8272 0.1008 0.4231 0.0136 100 SER D CB 7340 O OG . SER E 106 B 1.8513 0.8372 0.8714 0.0872 0.4175 0.0055 100 SER D OG 7341 N N . CYS E 107 C 1.7597 0.8389 0.8163 0.1103 0.3900 0.0184 100 CYS D N 7342 C CA . CYS E 107 C 1.6131 0.7557 0.6996 0.1118 0.3714 0.0220 100 CYS D CA 7343 C C . CYS E 107 C 1.4752 0.6648 0.5835 0.1332 0.3610 0.0370 100 CYS D C 7344 O O . CYS E 107 C 1.3650 0.6209 0.5247 0.1287 0.3339 0.0413 100 CYS D O 7345 C CB . CYS E 107 C 1.6267 0.7697 0.6889 0.1245 0.3628 0.0366 100 CYS D CB 7346 S SG . CYS E 107 C 2.0190 1.1234 1.0702 0.0949 0.3698 0.0175 100 CYS D SG 7347 N N . ASN E 108 D 1.4800 0.6419 0.5687 0.1540 0.3744 0.0458 100 ASN D N 7348 C CA . ASN E 108 D 1.4787 0.6784 0.5868 0.1732 0.3705 0.0584 100 ASN D CA 7349 C C . ASN E 108 D 1.4830 0.6812 0.6126 0.1431 0.3713 0.0346 100 ASN D C 7350 O O . ASN E 108 D 1.4542 0.6827 0.6065 0.1510 0.3656 0.0394 100 ASN D O 7351 C CB . ASN E 108 D 1.4774 0.6481 0.5570 0.2142 0.3850 0.0818 100 ASN D CB 7352 C CG . ASN E 108 D 1.6609 0.7461 0.6997 0.2066 0.4050 0.0692 100 ASN D CG 7353 O OD1 . ASN E 108 D 1.6474 0.6966 0.6725 0.1784 0.4079 0.0524 100 ASN D OD1 7354 N ND2 . ASN E 108 D 1.6966 0.7458 0.7126 0.2310 0.4196 0.0798 100 ASN D ND2 7355 N N . ARG E 109 E 1.5310 0.6988 0.6591 0.1073 0.3759 0.0116 100 ARG D N 7356 C CA . ARG E 109 E 1.5317 0.7053 0.6813 0.0728 0.3745 -0.0094 100 ARG D CA 7357 C C . ARG E 109 E 1.5394 0.7463 0.7271 0.0427 0.3655 -0.0253 100 ARG D C 7358 O O . ARG E 109 E 1.6318 0.8152 0.8026 0.0361 0.3742 -0.0285 100 ARG D O 7359 C CB . ARG E 109 E 1.5806 0.6863 0.6928 0.0545 0.3898 -0.0167 100 ARG D CB 7360 C CG . ARG E 109 E 1.6115 0.6794 0.6904 0.0801 0.3980 -0.0030 100 ARG D CG 7361 C CD . ARG E 109 E 1.6761 0.6670 0.7077 0.0539 0.4124 -0.0116 100 ARG D CD 7362 N NE . ARG E 109 E 1.7176 0.6573 0.7159 0.0471 0.4246 -0.0112 100 ARG D NE 7363 C CZ . ARG E 109 E 1.7623 0.6479 0.7173 0.0775 0.4377 0.0049 100 ARG D CZ 7364 N NH1 . ARG E 109 E 1.7583 0.6370 0.7005 0.1189 0.4419 0.0230 100 ARG D NH1 7365 N NH2 . ARG E 109 E 1.8263 0.6645 0.7507 0.0683 0.4484 0.0041 100 ARG D NH2 7366 N N . GLY E 110 F 1.4863 0.7502 0.7323 0.0259 0.3461 -0.0329 100 GLY D N 7367 C CA . GLY E 110 F 1.4245 0.7261 0.7168 0.0020 0.3364 -0.0441 100 GLY D CA 7368 C C . GLY E 110 F 1.3918 0.7597 0.7460 -0.0049 0.3126 -0.0465 100 GLY D C 7369 O O . GLY E 110 F 1.3830 0.7648 0.7452 0.0007 0.3046 -0.0434 100 GLY D O 7370 N N . ALA E 111 G 1.3433 0.7461 0.7359 -0.0158 0.3035 -0.0514 100 ALA D N 7371 C CA . ALA E 111 G 1.2229 0.6836 0.6706 -0.0220 0.2826 -0.0537 100 ALA D CA 7372 C C . ALA E 111 G 1.1234 0.6147 0.5789 -0.0013 0.2618 -0.0410 100 ALA D C 7373 O O . ALA E 111 G 1.0918 0.5694 0.5209 0.0117 0.2607 -0.0316 100 ALA D O 7374 C CB . ALA E 111 G 1.2137 0.6929 0.6941 -0.0398 0.2862 -0.0623 100 ALA D CB 7375 N N . PHE E 112 H 1.0761 0.6096 0.5666 -0.0010 0.2440 -0.0395 100 PHE D N 7376 C CA . PHE E 112 H 1.0634 0.6332 0.5665 0.0135 0.2224 -0.0261 100 PHE D CA 7377 C C . PHE E 112 H 1.1232 0.7218 0.6547 0.0018 0.2071 -0.0308 100 PHE D C 7378 O O . PHE E 112 H 1.1263 0.7488 0.6928 -0.0100 0.2022 -0.0400 100 PHE D O 7379 C CB . PHE E 112 H 1.0902 0.6842 0.6089 0.0224 0.2143 -0.0199 100 PHE D CB 7380 C CG . PHE E 112 H 1.2046 0.7594 0.6853 0.0370 0.2331 -0.0142 100 PHE D CG 7381 C CD1 . PHE E 112 H 1.2719 0.7889 0.7097 0.0530 0.2479 -0.0047 100 PHE D CD1 7382 C CD2 . PHE E 112 H 1.2350 0.7831 0.7151 0.0353 0.2374 -0.0178 100 PHE D CD2 7383 C CE1 . PHE E 112 H 1.3051 0.7766 0.6996 0.0694 0.2689 0.0015 100 PHE D CE1 7384 C CE2 . PHE E 112 H 1.2631 0.7610 0.6952 0.0495 0.2584 -0.0125 100 PHE D CE2 7385 C CZ . PHE E 112 H 1.2868 0.7455 0.6758 0.0678 0.2753 -0.0027 100 PHE D CZ 7386 N N . ASP E 113 ? 1.1409 0.7325 0.6516 0.0050 0.1998 -0.0233 101 ASP D N 7387 C CA . ASP E 113 ? 1.0918 0.6920 0.6112 -0.0063 0.1893 -0.0279 101 ASP D CA 7388 C C . ASP E 113 ? 1.0295 0.6649 0.5571 -0.0056 0.1613 -0.0155 101 ASP D C 7389 O O . ASP E 113 ? 1.0446 0.6930 0.5866 -0.0157 0.1508 -0.0205 101 ASP D O 7390 C CB . ASP E 113 ? 1.1855 0.7414 0.6644 -0.0093 0.2011 -0.0296 101 ASP D CB 7391 C CG . ASP E 113 ? 1.2142 0.7545 0.6524 0.0005 0.1931 -0.0135 101 ASP D CG 7392 O OD1 . ASP E 113 ? 1.2460 0.8066 0.6892 0.0141 0.1871 -0.0007 101 ASP D OD1 7393 O OD2 . ASP E 113 ? 1.1831 0.6895 0.5822 -0.0043 0.1938 -0.0119 101 ASP D OD2 7394 N N . ILE E 114 ? 0.9865 0.6379 0.5042 0.0066 0.1503 0.0029 102 ILE D N 7395 C CA . ILE E 114 ? 0.9959 0.6890 0.5248 0.0047 0.1228 0.0192 102 ILE D CA 7396 C C . ILE E 114 ? 1.0588 0.7930 0.6189 0.0190 0.1191 0.0302 102 ILE D C 7397 O O . ILE E 114 ? 1.1253 0.8587 0.6766 0.0386 0.1288 0.0435 102 ILE D O 7398 C CB . ILE E 114 ? 1.0811 0.7709 0.5753 0.0052 0.1083 0.0394 102 ILE D CB 7399 C CG1 . ILE E 114 ? 1.1115 0.7502 0.5636 -0.0099 0.1128 0.0284 102 ILE D CG1 7400 C CG2 . ILE E 114 ? 1.1239 0.8649 0.6335 -0.0021 0.0774 0.0595 102 ILE D CG2 7401 C CD1 . ILE E 114 ? 1.1220 0.7530 0.5757 -0.0287 0.1057 0.0152 102 ILE D CD1 7402 N N . TRP E 115 ? 1.0406 0.8055 0.6324 0.0109 0.1074 0.0255 103 TRP D N 7403 C CA . TRP E 115 ? 0.9874 0.7870 0.6066 0.0232 0.1055 0.0345 103 TRP D CA 7404 C C . TRP E 115 ? 0.9875 0.8382 0.6238 0.0207 0.0800 0.0555 103 TRP D C 7405 O O . TRP E 115 ? 0.9606 0.8165 0.5876 0.0025 0.0608 0.0581 103 TRP D O 7406 C CB . TRP E 115 ? 0.9446 0.7412 0.5874 0.0152 0.1120 0.0143 103 TRP D CB 7407 C CG . TRP E 115 ? 0.9032 0.6598 0.5349 0.0141 0.1351 -0.0023 103 TRP D CG 7408 C CD1 . TRP E 115 ? 0.8899 0.6150 0.5080 0.0041 0.1464 -0.0149 103 TRP D CD1 7409 C CD2 . TRP E 115 ? 0.8982 0.6394 0.5275 0.0199 0.1501 -0.0070 103 TRP D CD2 7410 N NE1 . TRP E 115 ? 0.9519 0.6505 0.5650 0.0015 0.1657 -0.0258 103 TRP D NE1 7411 C CE2 . TRP E 115 ? 0.9186 0.6225 0.5341 0.0092 0.1672 -0.0219 103 TRP D CE2 7412 C CE3 . TRP E 115 ? 0.8908 0.6415 0.5228 0.0322 0.1520 0.0010 103 TRP D CE3 7413 C CZ2 . TRP E 115 ? 0.9420 0.6168 0.5434 0.0056 0.1827 -0.0295 103 TRP D CZ2 7414 C CZ3 . TRP E 115 ? 0.9344 0.6483 0.5466 0.0315 0.1697 -0.0078 103 TRP D CZ3 7415 C CH2 . TRP E 115 ? 0.9754 0.6513 0.5710 0.0160 0.1832 -0.0230 103 TRP D CH2 7416 N N . GLY E 116 ? 1.0462 0.9310 0.7033 0.0377 0.0813 0.0716 104 GLY D N 7417 C CA . GLY E 116 ? 1.0362 0.9779 0.7178 0.0346 0.0590 0.0936 104 GLY D CA 7418 C C . GLY E 116 ? 1.0193 0.9738 0.7251 0.0214 0.0516 0.0793 104 GLY D C 7419 O O . GLY E 116 ? 1.0402 0.9632 0.7462 0.0173 0.0635 0.0549 104 GLY D O 7420 N N . GLN E 117 ? 0.9951 0.9979 0.7218 0.0135 0.0311 0.0964 105 GLN D N 7421 C CA . GLN E 117 ? 0.9849 0.9986 0.7311 0.0008 0.0231 0.0845 105 GLN D CA 7422 C C . GLN E 117 ? 0.9687 0.9879 0.7330 0.0208 0.0405 0.0835 105 GLN D C 7423 O O . GLN E 117 ? 0.9638 0.9811 0.7402 0.0130 0.0384 0.0696 105 GLN D O 7424 C CB . GLN E 117 ? 1.0251 1.0844 0.7820 -0.0184 -0.0046 0.1035 105 GLN D CB 7425 C CG . GLN E 117 ? 1.0410 1.1625 0.8277 -0.0035 -0.0078 0.1363 105 GLN D CG 7426 C CD . GLN E 117 ? 1.0974 1.2476 0.8815 0.0082 -0.0111 0.1666 105 GLN D CD 7427 O OE1 . GLN E 117 ? 1.1599 1.2772 0.9152 0.0049 -0.0106 0.1611 105 GLN D OE1 7428 N NE2 . GLN E 117 ? 1.0672 1.2811 0.8823 0.0231 -0.0135 0.2013 105 GLN D NE2 7429 N N . GLY E 118 ? 0.9470 0.9668 0.7066 0.0473 0.0588 0.0991 106 GLY D N 7430 C CA . GLY E 118 ? 0.8810 0.8914 0.6427 0.0680 0.0796 0.0996 106 GLY D CA 7431 C C . GLY E 118 ? 0.8391 0.9037 0.6255 0.0845 0.0782 0.1303 106 GLY D C 7432 O O . GLY E 118 ? 0.7533 0.8684 0.5639 0.0697 0.0551 0.1447 106 GLY D O 7433 N N . THR E 119 ? 0.8854 0.9365 0.6616 0.1150 0.1049 0.1418 107 THR D N 7434 C CA . THR E 119 ? 0.8629 0.9638 0.6628 0.1374 0.1114 0.1739 107 THR D CA 7435 C C . THR E 119 ? 0.8958 0.9614 0.6808 0.1506 0.1338 0.1641 107 THR D C 7436 O O . THR E 119 ? 0.9538 0.9599 0.6998 0.1697 0.1616 0.1568 107 THR D O 7437 C CB . THR E 119 ? 0.8412 0.9648 0.6400 0.1720 0.1275 0.2097 107 THR D CB 7438 O OG1 . THR E 119 ? 0.7778 0.9392 0.5893 0.1567 0.1023 0.2225 107 THR D OG1 7439 C CG2 . THR E 119 ? 0.7662 0.9454 0.5939 0.1996 0.1393 0.2466 107 THR D CG2 7440 N N . MET E 120 ? 0.9003 0.9963 0.7095 0.1380 0.1216 0.1639 108 MET D N 7441 C CA . MET E 120 ? 0.9502 1.0132 0.7427 0.1482 0.1405 0.1562 108 MET D CA 7442 C C . MET E 120 ? 0.9809 1.0563 0.7696 0.1900 0.1713 0.1903 108 MET D C 7443 O O . MET E 120 ? 0.9762 1.1243 0.8044 0.2019 0.1666 0.2246 108 MET D O 7444 C CB . MET E 120 ? 0.9456 1.0369 0.7636 0.1227 0.1182 0.1470 108 MET D CB 7445 C CG . MET E 120 ? 0.9885 1.0473 0.7876 0.1318 0.1356 0.1409 108 MET D CG 7446 S SD . MET E 120 ? 1.3553 1.3195 1.1008 0.1200 0.1460 0.1024 108 MET D SD 7447 C CE . MET E 120 ? 1.1728 1.1516 0.9437 0.0778 0.1088 0.0741 108 MET D CE 7448 N N . VAL E 121 ? 1.0389 1.0416 0.7772 0.2117 0.2039 0.1827 109 VAL D N 7449 C CA . VAL E 121 ? 1.0663 1.0633 0.7885 0.2567 0.2410 0.2141 109 VAL D CA 7450 C C . VAL E 121 ? 1.0814 1.0147 0.7608 0.2608 0.2624 0.2000 109 VAL D C 7451 O O . VAL E 121 ? 1.0893 0.9367 0.7117 0.2498 0.2720 0.1713 109 VAL D O 7452 C CB . VAL E 121 ? 1.0531 1.0060 0.7356 0.2881 0.2692 0.2253 109 VAL D CB 7453 C CG1 . VAL E 121 ? 1.0597 0.9935 0.7159 0.3397 0.3141 0.2580 109 VAL D CG1 7454 C CG2 . VAL E 121 ? 0.9710 0.9881 0.6932 0.2862 0.2482 0.2435 109 VAL D CG2 7455 N N . THR E 122 ? 1.0834 1.0587 0.7882 0.2738 0.2687 0.2215 110 THR D N 7456 C CA . THR E 122 ? 1.0998 1.0157 0.7620 0.2780 0.2890 0.2108 110 THR D CA 7457 C C . THR E 122 ? 1.1606 1.0396 0.7826 0.3304 0.3397 0.2410 110 THR D C 7458 O O . THR E 122 ? 1.1583 1.1078 0.8225 0.3635 0.3538 0.2826 110 THR D O 7459 C CB . THR E 122 ? 1.0535 1.0276 0.7612 0.2577 0.2665 0.2124 110 THR D CB 7460 O OG1 . THR E 122 ? 1.0571 1.0575 0.7952 0.2125 0.2229 0.1855 110 THR D OG1 7461 C CG2 . THR E 122 ? 1.0577 0.9629 0.7147 0.2601 0.2863 0.1996 110 THR D CG2 7462 N N . VAL E 123 ? 1.2412 1.0079 0.7784 0.3372 0.3680 0.2222 111 VAL D N 7463 C CA . VAL E 123 ? 1.3414 1.0491 0.8212 0.3878 0.4218 0.2478 111 VAL D CA 7464 C C . VAL E 123 ? 1.4376 1.0817 0.8742 0.3812 0.4323 0.2337 111 VAL D C 7465 O O . VAL E 123 ? 1.5294 1.0809 0.8998 0.3518 0.4274 0.1986 111 VAL D O 7466 C CB . VAL E 123 ? 1.4068 1.0185 0.8234 0.3988 0.4387 0.2354 111 VAL D CB 7467 C CG1 . VAL E 123 ? 1.4693 1.0178 0.8513 0.4451 0.4752 0.2562 111 VAL D CG1 7468 C CG2 . VAL E 123 ? 1.3698 1.0378 0.8215 0.4051 0.4296 0.2484 111 VAL D CG2 7469 N N . SER E 124 ? 1.4269 1.1231 0.9028 0.4063 0.4444 0.2624 112 SER D N 7470 C CA . SER E 124 ? 1.4358 1.0787 0.8758 0.4010 0.4535 0.2518 112 SER D CA 7471 C C . SER E 124 ? 1.4437 1.1184 0.9141 0.4477 0.4818 0.2912 112 SER D C 7472 O O . SER E 124 ? 1.3590 1.1421 0.9061 0.4709 0.4817 0.3289 112 SER D O 7473 C CB . SER E 124 ? 1.3824 1.0714 0.8479 0.3568 0.4208 0.2330 112 SER D CB 7474 O OG . SER E 124 ? 1.4954 1.1269 0.9168 0.3502 0.4304 0.2220 112 SER D OG 7475 N N . SER E 125 ? 1.5223 1.1022 0.9314 0.4602 0.5053 0.2845 113 SER D N 7476 C CA . SER E 125 ? 1.5163 1.1128 0.9455 0.5062 0.5356 0.3214 113 SER D CA 7477 C C . SER E 125 ? 1.3434 1.0367 0.8368 0.4938 0.5227 0.3346 113 SER D C 7478 O O . SER E 125 ? 1.3539 1.0979 0.8890 0.5285 0.5421 0.3717 113 SER D O 7479 C CB . SER E 125 ? 1.5865 1.0392 0.9205 0.5212 0.5654 0.3092 113 SER D CB 7480 O OG . SER E 125 ? 1.6052 0.9668 0.8794 0.5363 0.5809 0.3039 113 SER D OG 7481 N N . ALA E 126 ? 1.4105 1.1279 0.9105 0.4443 0.4899 0.3062 114 ALA D N 7482 C CA . ALA E 126 ? 1.3862 1.1860 0.9389 0.4257 0.4745 0.3152 114 ALA D CA 7483 C C . ALA E 126 ? 1.2982 1.2449 0.9542 0.4387 0.4654 0.3582 114 ALA D C 7484 O O . ALA E 126 ? 1.2288 1.2262 0.9186 0.4421 0.4548 0.3697 114 ALA D O 7485 C CB . ALA E 126 ? 1.1695 0.9560 0.7005 0.3719 0.4407 0.2777 114 ALA D CB 7486 N N . SER E 127 ? 1.3122 1.3266 1.0167 0.4432 0.4680 0.3830 115 SER D N 7487 C CA . SER E 127 ? 1.2737 1.4335 1.0785 0.4468 0.4543 0.4262 115 SER D CA 7488 C C . SER E 127 ? 1.1979 1.4301 1.0439 0.3921 0.4108 0.4135 115 SER D C 7489 O O . SER E 127 ? 1.1904 1.3577 0.9967 0.3549 0.3872 0.3691 115 SER D O 7490 C CB . SER E 127 ? 1.3345 1.5326 1.1741 0.4800 0.4785 0.4642 115 SER D CB 7491 O OG . SER E 127 ? 1.3235 1.6670 1.2617 0.4776 0.4605 0.5083 115 SER D OG 7492 N N . THR E 128 ? 1.0650 1.4212 0.9970 0.3806 0.3843 0.4444 116 THR D N 7493 C CA . THR E 128 ? 0.9702 1.3825 0.9464 0.3222 0.3274 0.4251 116 THR D CA 7494 C C . THR E 128 ? 0.9880 1.4073 0.9687 0.3017 0.3234 0.4213 116 THR D C 7495 O O . THR E 128 ? 1.0396 1.5124 1.0507 0.3262 0.3511 0.4616 116 THR D O 7496 C CB . THR E 128 ? 0.8988 1.4381 0.9572 0.3119 0.3007 0.4636 116 THR D CB 7497 O OG1 . THR E 128 ? 0.9581 1.4881 1.0094 0.3305 0.3032 0.4666 116 THR D OG1 7498 C CG2 . THR E 128 ? 0.8021 1.3803 0.8889 0.2493 0.2440 0.4414 116 THR D CG2 7499 N N . LYS E 129 ? 0.9398 1.3059 0.8907 0.2583 0.2903 0.3748 117 LYS D N 7500 C CA . LYS E 129 ? 0.9491 1.3087 0.8946 0.2368 0.2843 0.3661 117 LYS D CA 7501 C C . LYS E 129 ? 0.9005 1.2700 0.8582 0.1804 0.2307 0.3337 117 LYS D C 7502 O O . LYS E 129 ? 0.8839 1.2081 0.8180 0.1603 0.2060 0.2984 117 LYS D O 7503 C CB . LYS E 129 ? 0.9825 1.2254 0.8467 0.2553 0.3161 0.3416 117 LYS D CB 7504 C CG . LYS E 129 ? 0.9194 1.1437 0.7688 0.2341 0.3107 0.3303 117 LYS D CG 7505 C CD . LYS E 129 ? 0.9870 1.0863 0.7461 0.2458 0.3357 0.3023 117 LYS D CD 7506 C CE . LYS E 129 ? 1.0150 1.0938 0.7567 0.2237 0.3280 0.2908 117 LYS D CE 7507 N NZ . LYS E 129 ? 0.9824 1.0864 0.7496 0.1729 0.2735 0.2627 117 LYS D NZ 7508 N N . GLY E 130 ? 0.8821 1.3089 0.8743 0.1559 0.2155 0.3476 118 GLY D N 7509 C CA . GLY E 130 ? 0.8543 1.2818 0.8489 0.1050 0.1697 0.3195 118 GLY D CA 7510 C C . GLY E 130 ? 0.8712 1.2028 0.8061 0.0934 0.1662 0.2772 118 GLY D C 7511 O O . GLY E 130 ? 0.9066 1.1865 0.8042 0.1176 0.1981 0.2770 118 GLY D O 7512 N N . PRO E 131 ? 0.8529 1.1583 0.7756 0.0569 0.1281 0.2430 119 PRO D N 7513 C CA . PRO E 131 ? 0.8651 1.0873 0.7365 0.0438 0.1190 0.2043 119 PRO D CA 7514 C C . PRO E 131 ? 0.9009 1.1245 0.7669 0.0251 0.1127 0.2050 119 PRO D C 7515 O O . PRO E 131 ? 0.8350 1.1267 0.7396 0.0090 0.1039 0.2291 119 PRO D O 7516 C CB . PRO E 131 ? 0.7592 0.9688 0.6305 0.0167 0.0831 0.1758 119 PRO D CB 7517 C CG . PRO E 131 ? 0.7454 1.0348 0.6646 -0.0008 0.0647 0.1988 119 PRO D CG 7518 C CD . PRO E 131 ? 0.8169 1.1664 0.7699 0.0285 0.0931 0.2405 119 PRO D CD 7519 N N . SER E 132 ? 1.0029 1.1506 0.8185 0.0247 0.1160 0.1795 120 SER D N 7520 C CA . SER E 132 ? 1.0418 1.1764 0.8428 0.0048 0.1064 0.1737 120 SER D CA 7521 C C . SER E 132 ? 1.0899 1.1865 0.8714 -0.0245 0.0696 0.1390 120 SER D C 7522 O O . SER E 132 ? 1.1707 1.2135 0.9232 -0.0213 0.0635 0.1138 120 SER D O 7523 C CB . SER E 132 ? 1.0869 1.1616 0.8404 0.0265 0.1378 0.1739 120 SER D CB 7524 O OG . SER E 132 ? 1.1233 1.2312 0.8932 0.0588 0.1775 0.2093 120 SER D OG 7525 N N . VAL E 133 ? 1.0603 1.1847 0.8562 -0.0529 0.0462 0.1399 121 VAL D N 7526 C CA . VAL E 133 ? 1.0328 1.1235 0.8108 -0.0768 0.0145 0.1114 121 VAL D CA 7527 C C . VAL E 133 ? 1.0589 1.0997 0.7984 -0.0858 0.0093 0.0972 121 VAL D C 7528 O O . VAL E 133 ? 1.0921 1.1500 0.8324 -0.1000 0.0083 0.1092 121 VAL D O 7529 C CB . VAL E 133 ? 0.9817 1.1186 0.7859 -0.1044 -0.0093 0.1187 121 VAL D CB 7530 C CG1 . VAL E 133 ? 0.9500 1.0429 0.7296 -0.1221 -0.0358 0.0904 121 VAL D CG1 7531 C CG2 . VAL E 133 ? 0.9682 1.1564 0.8089 -0.0973 -0.0062 0.1353 121 VAL D CG2 7532 N N . PHE E 134 ? 1.0549 1.0355 0.7599 -0.0794 0.0046 0.0732 122 PHE D N 7533 C CA . PHE E 134 ? 1.0666 0.9965 0.7318 -0.0870 -0.0031 0.0596 122 PHE D CA 7534 C C . PHE E 134 ? 1.0750 0.9840 0.7327 -0.1028 -0.0336 0.0383 122 PHE D C 7535 O O . PHE E 134 ? 1.0639 0.9727 0.7332 -0.1005 -0.0440 0.0270 122 PHE D O 7536 C CB . PHE E 134 ? 1.0607 0.9341 0.6845 -0.0700 0.0135 0.0521 122 PHE D CB 7537 C CG . PHE E 134 ? 1.0703 0.9519 0.6924 -0.0477 0.0500 0.0736 122 PHE D CG 7538 C CD1 . PHE E 134 ? 1.0369 0.9337 0.6582 -0.0447 0.0692 0.0937 122 PHE D CD1 7539 C CD2 . PHE E 134 ? 1.0938 0.9656 0.7128 -0.0280 0.0677 0.0756 122 PHE D CD2 7540 C CE1 . PHE E 134 ? 1.0390 0.9454 0.6606 -0.0189 0.1074 0.1175 122 PHE D CE1 7541 C CE2 . PHE E 134 ? 1.0834 0.9572 0.6961 -0.0021 0.1058 0.0978 122 PHE D CE2 7542 C CZ . PHE E 134 ? 1.0652 0.9582 0.6811 0.0043 0.1266 0.1198 122 PHE D CZ 7543 N N . PRO E 135 ? 1.1080 0.9979 0.7450 -0.1171 -0.0457 0.0345 123 PRO D N 7544 C CA . PRO E 135 ? 1.1184 0.9858 0.7447 -0.1279 -0.0708 0.0183 123 PRO D CA 7545 C C . PRO E 135 ? 1.1197 0.9429 0.7224 -0.1197 -0.0812 0.0014 123 PRO D C 7546 O O . PRO E 135 ? 1.1612 0.9536 0.7363 -0.1138 -0.0732 0.0004 123 PRO D O 7547 C CB . PRO E 135 ? 1.1378 0.9956 0.7432 -0.1444 -0.0751 0.0238 123 PRO D CB 7548 C CG . PRO E 135 ? 1.1451 0.9989 0.7379 -0.1383 -0.0543 0.0355 123 PRO D CG 7549 C CD . PRO E 135 ? 1.1295 1.0180 0.7510 -0.1224 -0.0334 0.0479 123 PRO D CD 7550 N N . LEU E 136 ? 1.2568 0.8304 0.9503 -0.0831 0.2745 0.1094 124 LEU D N 7551 C CA . LEU E 136 ? 1.2267 0.7790 0.8615 -0.0600 0.2590 0.1208 124 LEU D CA 7552 C C . LEU E 136 ? 1.2354 0.7567 0.8823 -0.0537 0.2823 0.1381 124 LEU D C 7553 O O . LEU E 136 ? 1.2461 0.7674 0.9135 -0.0646 0.2703 0.1240 124 LEU D O 7554 C CB . LEU E 136 ? 1.1860 0.7582 0.8122 -0.0699 0.2187 0.0983 124 LEU D CB 7555 C CG . LEU E 136 ? 1.1179 0.7074 0.7301 -0.0739 0.1971 0.0844 124 LEU D CG 7556 C CD1 . LEU E 136 ? 1.0606 0.6638 0.6792 -0.0857 0.1710 0.0723 124 LEU D CD1 7557 C CD2 . LEU E 136 ? 1.1256 0.6979 0.6827 -0.0475 0.1904 0.0921 124 LEU D CD2 7558 N N . ALA E 137 ? 1.2635 0.7550 0.8928 -0.0297 0.3203 0.1724 125 ALA D N 7559 C CA . ALA E 137 ? 1.2998 0.7485 0.9385 -0.0178 0.3526 0.1975 125 ALA D CA 7560 C C . ALA E 137 ? 1.3563 0.8004 0.9430 0.0115 0.3256 0.1998 125 ALA D C 7561 O O . ALA E 137 ? 1.3771 0.8424 0.9066 0.0365 0.2932 0.1962 125 ALA D O 7562 C CB . ALA E 137 ? 1.3386 0.7549 0.9617 0.0101 0.4075 0.2447 125 ALA D CB 7563 N N . PRO E 138 ? 1.4103 0.8283 1.0231 0.0095 0.3366 0.2016 126 PRO D N 7564 C CA . PRO E 138 ? 1.4349 0.8554 1.0100 0.0416 0.3158 0.2065 126 PRO D CA 7565 C C . PRO E 138 ? 1.4660 0.8726 0.9646 0.0993 0.3227 0.2420 126 PRO D C 7566 O O . PRO E 138 ? 1.4953 0.8528 0.9764 0.1308 0.3628 0.2786 126 PRO D O 7567 C CB . PRO E 138 ? 1.4801 0.8574 1.0975 0.0345 0.3425 0.2080 126 PRO D CB 7568 C CG . PRO E 138 ? 1.4313 0.8043 1.1189 -0.0147 0.3528 0.1806 126 PRO D CG 7569 C CD . PRO E 138 ? 1.4164 0.8033 1.1040 -0.0233 0.3657 0.1924 126 PRO D CD 7570 N N . THR E 147 ? 1.6850 1.0961 1.3189 0.1912 0.3114 0.1698 135 THR D N 7571 C CA . THR E 147 ? 1.6151 1.1096 1.2739 0.1570 0.2817 0.1499 135 THR D CA 7572 C C . THR E 147 ? 1.5383 1.0555 1.1910 0.1313 0.2636 0.1584 135 THR D C 7573 O O . THR E 147 ? 1.5243 1.0953 1.1713 0.1478 0.2392 0.1720 135 THR D O 7574 C CB . THR E 147 ? 1.6204 1.2042 1.2995 0.1832 0.2641 0.1554 135 THR D CB 7575 O OG1 . THR E 147 ? 1.7185 1.2793 1.3924 0.2222 0.2848 0.1530 135 THR D OG1 7576 C CG2 . THR E 147 ? 1.5136 1.1659 1.2263 0.1470 0.2480 0.1390 135 THR D CG2 7577 N N . ALA E 148 ? 1.4802 0.9591 1.1369 0.0938 0.2727 0.1459 136 ALA D N 7578 C CA . ALA E 148 ? 1.4609 0.9551 1.1067 0.0737 0.2601 0.1525 136 ALA D CA 7579 C C . ALA E 148 ? 1.4026 0.9319 1.0724 0.0311 0.2434 0.1255 136 ALA D C 7580 O O . ALA E 148 ? 1.3850 0.9290 1.0741 0.0209 0.2421 0.1039 136 ALA D O 7581 C CB . ALA E 148 ? 1.5159 0.9391 1.1458 0.0757 0.2928 0.1725 136 ALA D CB 7582 N N . ALA E 149 ? 1.3496 0.8901 1.0091 0.0146 0.2320 0.1281 137 ALA D N 7583 C CA . ALA E 149 ? 1.2523 0.8213 0.9276 -0.0188 0.2174 0.1077 137 ALA D CA 7584 C C . ALA E 149 ? 1.2453 0.7889 0.9147 -0.0357 0.2275 0.1076 137 ALA D C 7585 O O . ALA E 149 ? 1.3011 0.8282 0.9420 -0.0198 0.2335 0.1277 137 ALA D O 7586 C CB . ALA E 149 ? 1.2110 0.8344 0.8908 -0.0213 0.1875 0.1087 137 ALA D CB 7587 N N . LEU E 150 ? 1.1998 0.7465 0.8940 -0.0613 0.2294 0.0849 138 LEU D N 7588 C CA . LEU E 150 ? 1.1781 0.7168 0.8823 -0.0780 0.2386 0.0827 138 LEU D CA 7589 C C . LEU E 150 ? 1.1344 0.7095 0.8500 -0.0964 0.2194 0.0576 138 LEU D C 7590 O O . LEU E 150 ? 1.0393 0.6368 0.7540 -0.0952 0.2059 0.0432 138 LEU D O 7591 C CB . LEU E 150 ? 1.2025 0.6984 0.9454 -0.0869 0.2703 0.0823 138 LEU D CB 7592 C CG . LEU E 150 ? 1.2221 0.7042 1.0031 -0.0981 0.2691 0.0490 138 LEU D CG 7593 C CD1 . LEU E 150 ? 1.2169 0.7260 1.0408 -0.1244 0.2555 0.0107 138 LEU D CD1 7594 C CD2 . LEU E 150 ? 1.3160 0.7331 1.1220 -0.0931 0.3025 0.0617 138 LEU D CD2 7595 N N . GLY E 151 ? 1.1996 0.7824 0.9217 -0.1062 0.2219 0.0563 139 GLY D N 7596 C CA . GLY E 151 ? 1.1769 0.7941 0.9039 -0.1150 0.2042 0.0356 139 GLY D CA 7597 C C . GLY E 151 ? 1.1628 0.7921 0.9011 -0.1201 0.2097 0.0360 139 GLY D C 7598 O O . GLY E 151 ? 1.1669 0.7794 0.9182 -0.1196 0.2337 0.0528 139 GLY D O 7599 N N . CYS E 152 ? 1.1401 0.8004 0.8720 -0.1190 0.1919 0.0216 140 CYS D N 7600 C CA . CYS E 152 ? 1.1296 0.8104 0.8707 -0.1170 0.1946 0.0209 140 CYS D CA 7601 C C . CYS E 152 ? 1.1284 0.8045 0.8167 -0.1017 0.1808 0.0323 140 CYS D C 7602 O O . CYS E 152 ? 1.1313 0.8022 0.7948 -0.0987 0.1667 0.0339 140 CYS D O 7603 C CB . CYS E 152 ? 1.1097 0.8344 0.8977 -0.1232 0.1831 -0.0119 140 CYS D CB 7604 S SG . CYS E 152 ? 1.5276 1.2542 1.4033 -0.1487 0.1946 -0.0384 140 CYS D SG 7605 N N . LEU E 153 ? 1.1283 0.8032 0.8039 -0.0907 0.1887 0.0416 141 LEU D N 7606 C CA . LEU E 153 ? 1.1427 0.8025 0.7703 -0.0745 0.1747 0.0466 141 LEU D CA 7607 C C . LEU E 153 ? 1.1628 0.8546 0.7986 -0.0615 0.1736 0.0381 141 LEU D C 7608 O O . LEU E 153 ? 1.2038 0.9100 0.8501 -0.0506 0.1890 0.0423 141 LEU D O 7609 C CB . LEU E 153 ? 1.1455 0.7696 0.7305 -0.0590 0.1788 0.0599 141 LEU D CB 7610 C CG . LEU E 153 ? 1.1205 0.7133 0.6571 -0.0438 0.1586 0.0566 141 LEU D CG 7611 C CD1 . LEU E 153 ? 1.0965 0.6748 0.6383 -0.0600 0.1382 0.0538 141 LEU D CD1 7612 C CD2 . LEU E 153 ? 1.1340 0.6945 0.6208 -0.0199 0.1566 0.0593 141 LEU D CD2 7613 N N . VAL E 154 ? 1.1203 0.8274 0.7498 -0.0562 0.1582 0.0295 142 VAL D N 7614 C CA . VAL E 154 ? 1.1392 0.8794 0.7671 -0.0339 0.1523 0.0221 142 VAL D CA 7615 C C . VAL E 154 ? 1.1961 0.8938 0.7707 -0.0118 0.1516 0.0369 142 VAL D C 7616 O O . VAL E 154 ? 1.2661 0.9293 0.8067 -0.0050 0.1442 0.0464 142 VAL D O 7617 C CB . VAL E 154 ? 1.1903 0.9600 0.8147 -0.0233 0.1368 0.0098 142 VAL D CB 7618 C CG1 . VAL E 154 ? 1.2306 1.0440 0.8512 0.0089 0.1269 0.0006 142 VAL D CG1 7619 C CG2 . VAL E 154 ? 1.1609 0.9609 0.8312 -0.0423 0.1321 -0.0139 142 VAL D CG2 7620 N N . LYS E 155 ? 1.1663 0.8625 0.7356 0.0015 0.1629 0.0401 143 LYS D N 7621 C CA . LYS E 155 ? 1.1669 0.8107 0.6790 0.0258 0.1602 0.0472 143 LYS D CA 7622 C C . LYS E 155 ? 1.1398 0.8088 0.6424 0.0617 0.1644 0.0466 143 LYS D C 7623 O O . LYS E 155 ? 1.0675 0.8041 0.6172 0.0678 0.1752 0.0419 143 LYS D O 7624 C CB . LYS E 155 ? 1.1446 0.7566 0.6321 0.0288 0.1686 0.0506 143 LYS D CB 7625 C CG . LYS E 155 ? 1.1882 0.7354 0.6098 0.0551 0.1568 0.0462 143 LYS D CG 7626 C CD . LYS E 155 ? 1.2359 0.7589 0.6188 0.0705 0.1608 0.0449 143 LYS D CD 7627 C CE . LYS E 155 ? 1.3606 0.8193 0.6721 0.1048 0.1433 0.0292 143 LYS D CE 7628 N NZ . LYS E 155 ? 1.3882 0.7892 0.6974 0.0838 0.1105 0.0136 143 LYS D NZ 7629 N N . ASP E 156 ? 1.2070 0.8213 0.6573 0.0851 0.1563 0.0512 144 ASP D N 7630 C CA . ASP E 156 ? 1.2711 0.8917 0.6959 0.1293 0.1607 0.0531 144 ASP D CA 7631 C C . ASP E 156 ? 1.2467 0.9481 0.7072 0.1469 0.1580 0.0505 144 ASP D C 7632 O O . ASP E 156 ? 1.2616 1.0424 0.7756 0.1512 0.1651 0.0418 144 ASP D O 7633 C CB . ASP E 156 ? 1.3102 0.9406 0.7260 0.1510 0.1776 0.0516 144 ASP D CB 7634 C CG . ASP E 156 ? 1.3669 0.9176 0.7275 0.1505 0.1726 0.0470 144 ASP D CG 7635 O OD1 . ASP E 156 ? 1.4299 0.9056 0.7555 0.1449 0.1529 0.0411 144 ASP D OD1 7636 O OD2 . ASP E 156 ? 1.3361 0.9003 0.6915 0.1580 0.1885 0.0492 144 ASP D OD2 7637 N N . TYR E 157 ? 1.2413 0.9253 0.6756 0.1602 0.1481 0.0584 145 TYR D N 7638 C CA . TYR E 157 ? 1.2458 1.0041 0.6934 0.1928 0.1385 0.0532 145 TYR D CA 7639 C C . TYR E 157 ? 1.2970 1.0031 0.6785 0.2342 0.1390 0.0759 145 TYR D C 7640 O O . TYR E 157 ? 1.3283 0.9405 0.6723 0.2233 0.1484 0.0957 145 TYR D O 7641 C CB . TYR E 157 ? 1.1751 0.9992 0.6726 0.1657 0.1251 0.0346 145 TYR D CB 7642 C CG . TYR E 157 ? 1.1676 0.9417 0.6357 0.1469 0.1251 0.0471 145 TYR D CG 7643 C CD1 . TYR E 157 ? 1.1424 0.8742 0.6255 0.1011 0.1323 0.0498 145 TYR D CD1 7644 C CD2 . TYR E 157 ? 1.2021 0.9773 0.6269 0.1815 0.1211 0.0596 145 TYR D CD2 7645 C CE1 . TYR E 157 ? 1.1526 0.8504 0.6209 0.0856 0.1355 0.0632 145 TYR D CE1 7646 C CE2 . TYR E 157 ? 1.2146 0.9501 0.6173 0.1684 0.1301 0.0778 145 TYR D CE2 7647 C CZ . TYR E 157 ? 1.2051 0.9053 0.6363 0.1179 0.1373 0.0787 145 TYR D CZ 7648 O OH . TYR E 157 ? 1.2332 0.9052 0.6540 0.1064 0.1493 0.0985 145 TYR D OH 7649 N N . PHE E 158 ? 1.2906 1.0597 0.6643 0.2833 0.1294 0.0735 146 PHE D N 7650 C CA . PHE E 158 ? 1.3661 1.0888 0.6694 0.3363 0.1351 0.1018 146 PHE D CA 7651 C C . PHE E 158 ? 1.3996 1.2239 0.7008 0.3903 0.1143 0.0903 146 PHE D C 7652 O O . PHE E 158 ? 1.3869 1.3077 0.7400 0.4037 0.0975 0.0622 146 PHE D O 7653 C CB . PHE E 158 ? 1.4398 1.0833 0.6993 0.3673 0.1502 0.1183 146 PHE D CB 7654 C CG . PHE E 158 ? 1.5185 1.0888 0.7058 0.4205 0.1642 0.1547 146 PHE D CG 7655 C CD1 . PHE E 158 ? 1.5102 0.9628 0.6697 0.3985 0.1846 0.1843 146 PHE D CD1 7656 C CD2 . PHE E 158 ? 1.4909 1.1113 0.6451 0.4941 0.1591 0.1618 146 PHE D CD2 7657 C CE1 . PHE E 158 ? 1.6025 0.9774 0.7026 0.4467 0.2070 0.2258 146 PHE D CE1 7658 C CE2 . PHE E 158 ? 1.6126 1.1571 0.6926 0.5506 0.1779 0.2027 146 PHE D CE2 7659 C CZ . PHE E 158 ? 1.6630 1.0787 0.7158 0.5258 0.2056 0.2377 146 PHE D CZ 7660 N N . PRO E 159 ? 1.4999 1.3083 0.7440 0.4251 0.1157 0.1120 147 PRO D N 7661 C CA . PRO E 159 ? 1.5545 1.2609 0.7575 0.4054 0.1428 0.1499 147 PRO D CA 7662 C C . PRO E 159 ? 1.5033 1.2440 0.7346 0.3649 0.1358 0.1354 147 PRO D C 7663 O O . PRO E 159 ? 1.4223 1.2372 0.7150 0.3316 0.1124 0.0933 147 PRO D O 7664 C CB . PRO E 159 ? 1.6639 1.3421 0.7835 0.4833 0.1573 0.1902 147 PRO D CB 7665 C CG . PRO E 159 ? 1.6521 1.4602 0.7716 0.5370 0.1205 0.1565 147 PRO D CG 7666 C CD . PRO E 159 ? 1.5674 1.4536 0.7751 0.5010 0.0954 0.1080 147 PRO D CD 7667 N N . GLU E 160 ? 1.2223 0.9338 0.7189 0.2200 0.0308 0.1313 148 GLU D N 7668 C CA . GLU E 160 ? 1.1634 0.8604 0.6267 0.1935 0.0248 0.1293 148 GLU D CA 7669 C C . GLU E 160 ? 1.2041 0.8998 0.6282 0.2202 -0.0244 0.1398 148 GLU D C 7670 O O . GLU E 160 ? 1.2572 0.9336 0.6516 0.2660 -0.0477 0.1523 148 GLU D O 7671 C CB . GLU E 160 ? 1.2249 0.8263 0.6221 0.1787 0.0744 0.1282 148 GLU D CB 7672 C CG . GLU E 160 ? 1.2099 0.8278 0.6557 0.1437 0.1170 0.1050 148 GLU D CG 7673 C CD . GLU E 160 ? 1.1969 0.8680 0.6810 0.1057 0.1133 0.0882 148 GLU D CD 7674 O OE1 . GLU E 160 ? 1.1324 0.8634 0.6449 0.1029 0.0759 0.0930 148 GLU D OE1 7675 O OE2 . GLU E 160 ? 1.2631 0.9156 0.7534 0.0794 0.1494 0.0679 148 GLU D OE2 7676 N N . PRO E 161 ? 1.1897 0.9067 0.6130 0.1948 -0.0426 0.1318 149 PRO D N 7677 C CA . PRO E 161 ? 1.2014 0.9447 0.6622 0.1488 -0.0216 0.1186 149 PRO D CA 7678 C C . PRO E 161 ? 1.1886 1.0223 0.7294 0.1293 -0.0506 0.1089 149 PRO D C 7679 O O . PRO E 161 ? 1.1668 1.0543 0.7512 0.1455 -0.0829 0.1070 149 PRO D O 7680 C CB . PRO E 161 ? 1.2211 0.8918 0.6010 0.1414 -0.0122 0.1195 149 PRO D CB 7681 C CG . PRO E 161 ? 1.2286 0.8700 0.5410 0.1814 -0.0533 0.1301 149 PRO D CG 7682 C CD . PRO E 161 ? 1.2040 0.8925 0.5601 0.2159 -0.0804 0.1359 149 PRO D CD 7683 N N . VAL E 162 ? 1.2339 1.0817 0.7969 0.0959 -0.0356 0.1014 150 VAL D N 7684 C CA . VAL E 162 ? 1.2231 1.1324 0.8473 0.0753 -0.0534 0.0955 150 VAL D CA 7685 C C . VAL E 162 ? 1.2619 1.1423 0.8610 0.0534 -0.0498 0.0895 150 VAL D C 7686 O O . VAL E 162 ? 1.3199 1.1617 0.8894 0.0445 -0.0222 0.0877 150 VAL D O 7687 C CB . VAL E 162 ? 1.1816 1.1434 0.8681 0.0619 -0.0334 0.0967 150 VAL D CB 7688 C CG1 . VAL E 162 ? 1.1976 1.2010 0.9250 0.0809 -0.0384 0.0984 150 VAL D CG1 7689 C CG2 . VAL E 162 ? 1.1941 1.1311 0.8597 0.0537 -0.0008 0.0940 150 VAL D CG2 7690 N N . THR E 163 ? 1.2417 1.1431 0.8603 0.0440 -0.0760 0.0814 151 THR D N 7691 C CA . THR E 163 ? 1.2469 1.1187 0.8452 0.0242 -0.0718 0.0730 151 THR D CA 7692 C C . THR E 163 ? 1.1983 1.1051 0.8596 0.0008 -0.0594 0.0741 151 THR D C 7693 O O . THR E 163 ? 1.2253 1.1802 0.9455 -0.0058 -0.0671 0.0744 151 THR D O 7694 C CB . THR E 163 ? 1.3087 1.1685 0.8768 0.0280 -0.1065 0.0580 151 THR D CB 7695 O OG1 . THR E 163 ? 1.3006 1.2265 0.9414 0.0222 -0.1342 0.0467 151 THR D OG1 7696 C CG2 . THR E 163 ? 1.3762 1.1901 0.8613 0.0604 -0.1200 0.0627 151 THR D CG2 7697 N N . VAL E 164 ? 1.1648 1.0447 0.8136 -0.0093 -0.0369 0.0748 152 VAL D N 7698 C CA . VAL E 164 ? 1.1407 1.0394 0.8331 -0.0225 -0.0239 0.0814 152 VAL D CA 7699 C C . VAL E 164 ? 1.1512 1.0128 0.8322 -0.0347 -0.0192 0.0723 152 VAL D C 7700 O O . VAL E 164 ? 1.1705 0.9973 0.8160 -0.0318 -0.0079 0.0648 152 VAL D O 7701 C CB . VAL E 164 ? 1.1193 1.0330 0.8175 -0.0139 -0.0031 0.0913 152 VAL D CB 7702 C CG1 . VAL E 164 ? 1.0749 0.9975 0.7991 -0.0178 0.0079 0.1032 152 VAL D CG1 7703 C CG2 . VAL E 164 ? 1.1421 1.0896 0.8521 -0.0032 -0.0030 0.0969 152 VAL D CG2 7704 N N . SER E 165 ? 1.1309 0.9978 0.8474 -0.0503 -0.0227 0.0702 153 SER D N 7705 C CA . SER E 165 ? 1.1530 0.9807 0.8662 -0.0622 -0.0136 0.0613 153 SER D CA 7706 C C . SER E 165 ? 1.1155 0.9441 0.8700 -0.0682 0.0067 0.0784 153 SER D C 7707 O O . SER E 165 ? 1.0776 0.9375 0.8583 -0.0658 0.0137 0.0957 153 SER D O 7708 C CB . SER E 165 ? 1.2001 1.0139 0.9053 -0.0771 -0.0349 0.0349 153 SER D CB 7709 O OG . SER E 165 ? 1.1990 1.0515 0.9607 -0.0921 -0.0467 0.0282 153 SER D OG 7710 N N . TRP E 166 ? 1.1474 0.9340 0.9015 -0.0738 0.0205 0.0749 154 TRP D N 7711 C CA . TRP E 166 ? 1.1764 0.9441 0.9559 -0.0736 0.0446 0.0962 154 TRP D CA 7712 C C . TRP E 166 ? 1.2452 0.9720 1.0495 -0.0991 0.0555 0.0808 154 TRP D C 7713 O O . TRP E 166 ? 1.2684 0.9634 1.0564 -0.1059 0.0509 0.0567 154 TRP D O 7714 C CB . TRP E 166 ? 1.1802 0.9318 0.9385 -0.0453 0.0558 0.1117 154 TRP D CB 7715 C CG . TRP E 166 ? 1.1575 0.9537 0.9037 -0.0232 0.0492 0.1245 154 TRP D CG 7716 C CD1 . TRP E 166 ? 1.1198 0.9405 0.8502 -0.0154 0.0382 0.1092 154 TRP D CD1 7717 C CD2 . TRP E 166 ? 1.1577 0.9741 0.9031 -0.0076 0.0575 0.1518 154 TRP D CD2 7718 N NE1 . TRP E 166 ? 1.0794 0.9396 0.8077 0.0019 0.0363 0.1205 154 TRP D NE1 7719 C CE2 . TRP E 166 ? 1.0887 0.9485 0.8209 0.0089 0.0457 0.1468 154 TRP D CE2 7720 C CE3 . TRP E 166 ? 1.2108 1.0056 0.9598 -0.0065 0.0787 0.1793 154 TRP D CE3 7721 C CZ2 . TRP E 166 ? 1.0583 0.9471 0.7783 0.0278 0.0483 0.1650 154 TRP D CZ2 7722 C CZ3 . TRP E 166 ? 1.1927 1.0098 0.9208 0.0144 0.0851 0.2031 154 TRP D CZ3 7723 C CH2 . TRP E 166 ? 1.1210 0.9879 0.8335 0.0322 0.0668 0.1942 154 TRP D CH2 7724 N N . ASN E 167 ? 1.2979 1.0224 1.1420 -0.1154 0.0754 0.0921 155 ASN D N 7725 C CA . ASN E 167 ? 1.3565 1.0432 1.2389 -0.1471 0.0927 0.0728 155 ASN D CA 7726 C C . ASN E 167 ? 1.3390 1.0474 1.2338 -0.1709 0.0608 0.0249 155 ASN D C 7727 O O . ASN E 167 ? 1.3729 1.0404 1.2684 -0.1877 0.0640 -0.0028 155 ASN D O 7728 C CB . ASN E 167 ? 1.4042 1.0166 1.2677 -0.1365 0.1194 0.0838 155 ASN D CB 7729 C CG . ASN E 167 ? 1.4017 0.9872 1.2464 -0.1065 0.1477 0.1321 155 ASN D CG 7730 O OD1 . ASN E 167 ? 1.3637 0.9906 1.1940 -0.0883 0.1420 0.1554 155 ASN D OD1 7731 N ND2 . ASN E 167 ? 1.4505 0.9624 1.2888 -0.0976 0.1781 0.1467 155 ASN D ND2 7732 N N . SER E 168 ? 1.2913 1.0623 1.1906 -0.1681 0.0291 0.0147 156 SER D N 7733 C CA . SER E 168 ? 1.2972 1.0972 1.1971 -0.1798 -0.0106 -0.0282 156 SER D CA 7734 C C . SER E 168 ? 1.3098 1.0664 1.1391 -0.1697 -0.0245 -0.0456 156 SER D C 7735 O O . SER E 168 ? 1.3512 1.1027 1.1724 -0.1846 -0.0468 -0.0858 156 SER D O 7736 C CB . SER E 168 ? 1.3474 1.1610 1.3234 -0.2190 -0.0078 -0.0651 156 SER D CB 7737 O OG . SER E 168 ? 1.3218 1.1802 1.3687 -0.2312 0.0096 -0.0541 156 SER D OG 7738 N N . GLY E 169 ? 1.2765 1.0047 1.0566 -0.1449 -0.0099 -0.0195 157 GLY D N 7739 C CA . GLY E 169 ? 1.2571 0.9438 0.9725 -0.1353 -0.0127 -0.0346 157 GLY D CA 7740 C C . GLY E 169 ? 1.2764 0.9052 0.9936 -0.1386 0.0190 -0.0364 157 GLY D C 7741 O O . GLY E 169 ? 1.3161 0.9098 0.9873 -0.1292 0.0267 -0.0473 157 GLY D O 7742 N N . ALA E 170 ? 1.3186 0.9317 1.0880 -0.1504 0.0423 -0.0251 158 ALA D N 7743 C CA . ALA E 170 ? 1.3664 0.9167 1.1405 -0.1481 0.0744 -0.0233 158 ALA D CA 7744 C C . ALA E 170 ? 1.3866 0.9310 1.1378 -0.1119 0.0869 0.0037 158 ALA D C 7745 O O . ALA E 170 ? 1.3914 0.9056 1.1186 -0.1025 0.0958 -0.0120 158 ALA D O 7746 C CB . ALA E 170 ? 1.3926 0.9168 1.2200 -0.1641 0.1027 -0.0093 158 ALA D CB 7747 N N . LEU E 171 ? 1.3818 0.9597 1.1441 -0.0920 0.0878 0.0393 159 LEU D N 7748 C CA . LEU E 171 ? 1.3166 0.9082 1.0662 -0.0570 0.0913 0.0574 159 LEU D CA 7749 C C . LEU E 171 ? 1.3387 0.9655 1.0594 -0.0546 0.0745 0.0408 159 LEU D C 7750 O O . LEU E 171 ? 1.2993 0.9625 1.0114 -0.0618 0.0569 0.0430 159 LEU D O 7751 C CB . LEU E 171 ? 1.2058 0.8222 0.9663 -0.0356 0.0947 0.0962 159 LEU D CB 7752 C CG . LEU E 171 ? 1.1727 0.7807 0.9309 0.0059 0.1033 0.1180 159 LEU D CG 7753 C CD1 . LEU E 171 ? 1.1954 0.8250 0.9449 0.0273 0.1035 0.1556 159 LEU D CD1 7754 C CD2 . LEU E 171 ? 1.0963 0.7391 0.8525 0.0240 0.0922 0.0971 159 LEU D CD2 7755 N N . THR E 172 ? 1.4410 1.0519 1.1487 -0.0438 0.0852 0.0239 160 THR D N 7756 C CA . THR E 172 ? 1.4586 1.0854 1.1348 -0.0444 0.0824 0.0075 160 THR D CA 7757 C C . THR E 172 ? 1.4532 1.0965 1.1489 -0.0230 0.0990 0.0013 160 THR D C 7758 O O . THR E 172 ? 1.4309 1.1001 1.1181 -0.0214 0.1017 -0.0060 160 THR D O 7759 C CB . THR E 172 ? 1.5486 1.1313 1.1770 -0.0640 0.0846 -0.0220 160 THR D CB 7760 O OG1 . THR E 172 ? 1.6203 1.2006 1.2076 -0.0610 0.0939 -0.0331 160 THR D OG1 7761 C CG2 . THR E 172 ? 1.5918 1.1253 1.2284 -0.0663 0.1061 -0.0406 160 THR D CG2 7762 N N . SER E 173 ? 1.4896 1.1183 1.2174 -0.0057 0.1114 0.0012 161 SER D N 7763 C CA . SER E 173 ? 1.4498 1.1051 1.2128 0.0178 0.1238 -0.0125 161 SER D CA 7764 C C . SER E 173 ? 1.3625 1.0765 1.1581 0.0476 0.1055 0.0080 161 SER D C 7765 O O . SER E 173 ? 1.3399 1.0501 1.1315 0.0598 0.0932 0.0390 161 SER D O 7766 C CB . SER E 173 ? 1.4924 1.1065 1.2771 0.0297 0.1440 -0.0261 161 SER D CB 7767 O OG . SER E 173 ? 1.5359 1.0966 1.2834 0.0027 0.1628 -0.0520 161 SER D OG 7768 N N . GLY E 174 ? 1.3294 1.0957 1.1552 0.0583 0.1067 -0.0125 162 GLY D N 7769 C CA . GLY E 174 ? 1.2791 1.1104 1.1332 0.0875 0.0845 -0.0035 162 GLY D CA 7770 C C . GLY E 174 ? 1.2202 1.0726 1.0435 0.0752 0.0690 0.0156 162 GLY D C 7771 O O . GLY E 174 ? 1.2307 1.1222 1.0564 0.0987 0.0492 0.0325 162 GLY D O 7772 N N . VAL E 175 ? 1.1773 1.0023 0.9669 0.0424 0.0778 0.0123 163 VAL D N 7773 C CA . VAL E 175 ? 1.1629 1.0048 0.9277 0.0317 0.0653 0.0284 163 VAL D CA 7774 C C . VAL E 175 ? 1.1704 1.0380 0.9372 0.0210 0.0739 0.0051 163 VAL D C 7775 O O . VAL E 175 ? 1.2453 1.0843 1.0022 0.0050 0.0964 -0.0169 163 VAL D O 7776 C CB . VAL E 175 ? 1.1241 0.9216 0.8526 0.0084 0.0633 0.0417 163 VAL D CB 7777 C CG1 . VAL E 175 ? 1.0953 0.9179 0.8102 0.0022 0.0504 0.0562 163 VAL D CG1 7778 C CG2 . VAL E 175 ? 1.1264 0.8914 0.8608 0.0115 0.0632 0.0590 163 VAL D CG2 7779 N N . HIS E 176 ? 1.0921 1.0062 0.8671 0.0294 0.0614 0.0094 164 HIS D N 7780 C CA . HIS E 176 ? 1.0357 0.9690 0.8160 0.0175 0.0735 -0.0138 164 HIS D CA 7781 C C . HIS E 176 ? 1.0310 0.9682 0.7831 0.0126 0.0643 0.0047 164 HIS D C 7782 O O . HIS E 176 ? 1.0346 1.0132 0.7947 0.0267 0.0485 0.0142 164 HIS D O 7783 C CB . HIS E 176 ? 1.0180 1.0161 0.8525 0.0323 0.0702 -0.0442 164 HIS D CB 7784 C CG . HIS E 176 ? 1.0734 1.0774 0.9531 0.0343 0.0863 -0.0751 164 HIS D CG 7785 N ND1 . HIS E 176 ? 1.1213 1.0993 1.0120 0.0092 0.1240 -0.1055 164 HIS D ND1 7786 C CD2 . HIS E 176 ? 1.0893 1.1196 1.0067 0.0608 0.0737 -0.0804 164 HIS D CD2 7787 C CE1 . HIS E 176 ? 1.1291 1.1238 1.0706 0.0164 0.1357 -0.1320 164 HIS D CE1 7788 N NE2 . HIS E 176 ? 1.0872 1.1164 1.0485 0.0500 0.1026 -0.1177 164 HIS D NE2 7789 N N . THR E 177 ? 1.0329 0.9254 0.7475 -0.0032 0.0741 0.0095 165 THR D N 7790 C CA . THR E 177 ? 0.9820 0.8781 0.6764 -0.0042 0.0675 0.0227 165 THR D CA 7791 C C . THR E 177 ? 0.9694 0.8656 0.6670 -0.0103 0.0899 -0.0004 165 THR D C 7792 O O . THR E 177 ? 1.0088 0.8542 0.6786 -0.0210 0.1146 -0.0100 165 THR D O 7793 C CB . THR E 177 ? 0.9721 0.8246 0.6251 -0.0100 0.0595 0.0393 165 THR D CB 7794 O OG1 . THR E 177 ? 0.9491 0.8020 0.6105 -0.0108 0.0434 0.0529 165 THR D OG1 7795 C CG2 . THR E 177 ? 0.9426 0.8072 0.5864 -0.0046 0.0506 0.0513 165 THR D CG2 7796 N N . PHE E 178 ? 0.9545 0.9016 0.6811 -0.0036 0.0849 -0.0106 166 PHE D N 7797 C CA . PHE E 178 ? 0.9866 0.9391 0.7294 -0.0130 0.1087 -0.0411 166 PHE D CA 7798 C C . PHE E 178 ? 1.0081 0.9134 0.7114 -0.0165 0.1227 -0.0287 166 PHE D C 7799 O O . PHE E 178 ? 1.0106 0.9122 0.6903 -0.0060 0.1031 -0.0001 166 PHE D O 7800 C CB . PHE E 178 ? 0.9579 0.9833 0.7392 -0.0029 0.0938 -0.0610 166 PHE D CB 7801 C CG . PHE E 178 ? 0.9607 1.0358 0.7836 0.0079 0.0796 -0.0811 166 PHE D CG 7802 C CD1 . PHE E 178 ? 0.9556 1.0464 0.7687 0.0299 0.0521 -0.0533 166 PHE D CD1 7803 C CD2 . PHE E 178 ? 0.9718 1.0766 0.8482 -0.0025 0.0961 -0.1296 166 PHE D CD2 7804 C CE1 . PHE E 178 ? 0.9625 1.0948 0.8099 0.0489 0.0367 -0.0690 166 PHE D CE1 7805 C CE2 . PHE E 178 ? 0.9573 1.1181 0.8814 0.0137 0.0779 -0.1518 166 PHE D CE2 7806 C CZ . PHE E 178 ? 0.9592 1.1323 0.8645 0.0432 0.0457 -0.1192 166 PHE D CZ 7807 N N . PRO E 179 ? 1.0244 0.8912 0.7241 -0.0300 0.1597 -0.0517 167 PRO D N 7808 C CA . PRO E 179 ? 1.0086 0.8201 0.6665 -0.0269 0.1774 -0.0393 167 PRO D CA 7809 C C . PRO E 179 ? 0.9803 0.8360 0.6560 -0.0159 0.1614 -0.0368 167 PRO D C 7810 O O . PRO E 179 ? 0.9655 0.8784 0.6852 -0.0206 0.1599 -0.0648 167 PRO D O 7811 C CB . PRO E 179 ? 1.0393 0.8043 0.7038 -0.0476 0.2300 -0.0718 167 PRO D CB 7812 C CG . PRO E 179 ? 1.0661 0.8469 0.7622 -0.0617 0.2397 -0.0936 167 PRO D CG 7813 C CD . PRO E 179 ? 1.0520 0.9186 0.7894 -0.0487 0.1926 -0.0912 167 PRO D CD 7814 N N . ALA E 180 ? 0.9909 0.8250 0.6339 0.0008 0.1483 -0.0072 168 ALA D N 7815 C CA . ALA E 180 ? 0.9699 0.8422 0.6305 0.0120 0.1393 -0.0053 168 ALA D CA 7816 C C . ALA E 180 ? 0.9564 0.8104 0.6288 0.0035 0.1747 -0.0361 168 ALA D C 7817 O O . ALA E 180 ? 0.9920 0.7800 0.6454 -0.0067 0.2104 -0.0470 168 ALA D O 7818 C CB . ALA E 180 ? 1.0148 0.8695 0.6503 0.0328 0.1212 0.0269 168 ALA D CB 7819 N N . VAL E 181 ? 0.8704 0.7772 0.5708 0.0063 0.1697 -0.0521 169 VAL D N 7820 C CA . VAL E 181 ? 0.8830 0.7769 0.6001 -0.0038 0.2029 -0.0886 169 VAL D CA 7821 C C . VAL E 181 ? 0.9305 0.8162 0.6369 0.0154 0.2054 -0.0752 169 VAL D C 7822 O O . VAL E 181 ? 0.8664 0.7877 0.5701 0.0329 0.1778 -0.0478 169 VAL D O 7823 C CB . VAL E 181 ? 0.8557 0.8243 0.6182 -0.0180 0.1966 -0.1349 169 VAL D CB 7824 C CG1 . VAL E 181 ? 0.8150 0.8492 0.5772 -0.0013 0.1693 -0.1309 169 VAL D CG1 7825 C CG2 . VAL E 181 ? 0.9277 0.8734 0.7201 -0.0416 0.2388 -0.1869 169 VAL D CG2 7826 N N . LEU E 182 ? 1.0225 0.8577 0.7280 0.0114 0.2436 -0.0965 170 LEU D N 7827 C CA . LEU E 182 ? 1.0379 0.8571 0.7365 0.0330 0.2515 -0.0866 170 LEU D CA 7828 C C . LEU E 182 ? 1.0671 0.9472 0.7976 0.0257 0.2553 -0.1254 170 LEU D C 7829 O O . LEU E 182 ? 1.1252 0.9992 0.8769 0.0040 0.2834 -0.1729 170 LEU D O 7830 C CB . LEU E 182 ? 1.1032 0.8164 0.7721 0.0397 0.2947 -0.0827 170 LEU D CB 7831 C CG . LEU E 182 ? 1.0849 0.7684 0.7462 0.0701 0.3052 -0.0698 170 LEU D CG 7832 C CD1 . LEU E 182 ? 1.0232 0.7438 0.6787 0.1033 0.2610 -0.0271 170 LEU D CD1 7833 C CD2 . LEU E 182 ? 1.1494 0.7109 0.7704 0.0801 0.3529 -0.0633 170 LEU D CD2 7834 N N . GLN E 183 ? 1.0539 0.9922 0.7873 0.0425 0.2295 -0.1087 171 GLN D N 7835 C CA . GLN E 183 ? 1.0878 1.0815 0.8338 0.0408 0.2322 -0.1413 171 GLN D CA 7836 C C . GLN E 183 ? 1.1455 1.0975 0.8965 0.0482 0.2684 -0.1606 171 GLN D C 7837 O O . GLN E 183 ? 1.1992 1.0792 0.9417 0.0614 0.2878 -0.1401 171 GLN D O 7838 C CB . GLN E 183 ? 1.0822 1.1374 0.8210 0.0561 0.2038 -0.1128 171 GLN D CB 7839 C CG . GLN E 183 ? 1.0718 1.1630 0.8032 0.0507 0.1722 -0.0960 171 GLN D CG 7840 C CD . GLN E 183 ? 1.0097 1.1354 0.7329 0.0643 0.1548 -0.0578 171 GLN D CD 7841 O OE1 . GLN E 183 ? 1.0195 1.1861 0.7251 0.0663 0.1404 -0.0556 171 GLN D OE1 7842 N NE2 . GLN E 183 ? 0.9656 1.0732 0.7025 0.0751 0.1573 -0.0287 171 GLN D NE2 7843 N N . SER E 184 ? 1.1084 1.1016 0.8667 0.0435 0.2772 -0.2003 172 SER D N 7844 C CA . SER E 184 ? 1.1185 1.0724 0.8846 0.0483 0.3157 -0.2273 172 SER D CA 7845 C C . SER E 184 ? 1.0993 1.0422 0.8644 0.0814 0.3184 -0.1882 172 SER D C 7846 O O . SER E 184 ? 1.1254 1.0190 0.8980 0.0949 0.3511 -0.1980 172 SER D O 7847 C CB . SER E 184 ? 1.1549 1.1629 0.9247 0.0343 0.3210 -0.2866 172 SER D CB 7848 O OG . SER E 184 ? 1.1649 1.2445 0.9118 0.0489 0.2935 -0.2715 172 SER D OG 7849 N N . SER E 185 ? 1.0464 1.0355 0.8093 0.0946 0.2862 -0.1470 173 SER D N 7850 C CA . SER E 185 ? 1.0160 1.0140 0.7963 0.1236 0.2854 -0.1154 173 SER D CA 7851 C C . SER E 185 ? 1.1012 1.0403 0.8850 0.1462 0.2795 -0.0808 173 SER D C 7852 O O . SER E 185 ? 1.1772 1.1215 0.9848 0.1762 0.2765 -0.0601 173 SER D O 7853 C CB . SER E 185 ? 0.9110 0.9805 0.6953 0.1238 0.2596 -0.0903 173 SER D CB 7854 O OG . SER E 185 ? 0.8625 0.9346 0.6377 0.1137 0.2288 -0.0647 173 SER D OG 7855 N N . GLY E 186 ? 1.1189 1.0038 0.8776 0.1343 0.2778 -0.0766 174 GLY D N 7856 C CA . GLY E 186 ? 1.1754 0.9956 0.9145 0.1585 0.2702 -0.0418 174 GLY D CA 7857 C C . GLY E 186 ? 1.1846 1.0422 0.9211 0.1603 0.2261 -0.0086 174 GLY D C 7858 O O . GLY E 186 ? 1.2605 1.0768 0.9746 0.1827 0.2093 0.0198 174 GLY D O 7859 N N . LEU E 187 ? 1.1278 1.0589 0.8814 0.1387 0.2079 -0.0131 175 LEU D N 7860 C CA . LEU E 187 ? 1.0586 1.0240 0.8152 0.1349 0.1716 0.0134 175 LEU D CA 7861 C C . LEU E 187 ? 1.0113 0.9653 0.7425 0.1076 0.1658 0.0072 175 LEU D C 7862 O O . LEU E 187 ? 1.0544 1.0066 0.7808 0.0885 0.1845 -0.0225 175 LEU D O 7863 C CB . LEU E 187 ? 0.9863 1.0305 0.7794 0.1327 0.1618 0.0184 175 LEU D CB 7864 C CG . LEU E 187 ? 1.0057 1.0756 0.8394 0.1571 0.1732 0.0183 175 LEU D CG 7865 C CD1 . LEU E 187 ? 0.9930 1.1340 0.8591 0.1477 0.1762 0.0213 175 LEU D CD1 7866 C CD2 . LEU E 187 ? 1.0308 1.0821 0.8818 0.1879 0.1512 0.0382 175 LEU D CD2 7867 N N . TYR E 188 ? 0.9524 0.9038 0.6736 0.1063 0.1391 0.0301 176 TYR D N 7868 C CA . TYR E 188 ? 0.9908 0.9306 0.6928 0.0838 0.1346 0.0251 176 TYR D CA 7869 C C . TYR E 188 ? 1.0532 1.0563 0.7730 0.0707 0.1160 0.0282 176 TYR D C 7870 O O . TYR E 188 ? 1.0175 1.0608 0.7584 0.0771 0.1036 0.0443 176 TYR D O 7871 C CB . TYR E 188 ? 0.9562 0.8432 0.6246 0.0907 0.1213 0.0458 176 TYR D CB 7872 C CG . TYR E 188 ? 1.0028 0.8063 0.6312 0.1080 0.1441 0.0491 176 TYR D CG 7873 C CD1 . TYR E 188 ? 0.9856 0.7259 0.5860 0.0912 0.1800 0.0323 176 TYR D CD1 7874 C CD2 . TYR E 188 ? 1.0511 0.8361 0.6709 0.1433 0.1326 0.0685 176 TYR D CD2 7875 C CE1 . TYR E 188 ? 1.0726 0.7187 0.6264 0.1073 0.2107 0.0396 176 TYR D CE1 7876 C CE2 . TYR E 188 ? 1.1320 0.8269 0.7017 0.1671 0.1549 0.0775 176 TYR D CE2 7877 C CZ . TYR E 188 ? 1.1359 0.7542 0.6670 0.1481 0.1973 0.0654 176 TYR D CZ 7878 O OH . TYR E 188 ? 1.2328 0.7445 0.7046 0.1718 0.2290 0.0784 176 TYR D OH 7879 N N . SER E 189 ? 1.1272 1.1362 0.8407 0.0539 0.1172 0.0118 177 SER D N 7880 C CA . SER E 189 ? 1.1027 1.1583 0.8217 0.0487 0.0998 0.0181 177 SER D CA 7881 C C . SER E 189 ? 1.0838 1.1231 0.7965 0.0375 0.0912 0.0157 177 SER D C 7882 O O . SER E 189 ? 1.0874 1.1175 0.8035 0.0276 0.1033 -0.0124 177 SER D O 7883 C CB . SER E 189 ? 1.1627 1.2626 0.8821 0.0499 0.1059 -0.0054 177 SER D CB 7884 O OG . SER E 189 ? 1.1717 1.3058 0.8815 0.0533 0.0892 0.0064 177 SER D OG 7885 N N . LEU E 190 ? 1.0520 1.0890 0.7628 0.0373 0.0738 0.0407 178 LEU D N 7886 C CA . LEU E 190 ? 0.9986 1.0156 0.7035 0.0285 0.0677 0.0394 178 LEU D CA 7887 C C . LEU E 190 ? 1.0069 1.0580 0.7189 0.0313 0.0546 0.0467 178 LEU D C 7888 O O . LEU E 190 ? 1.0272 1.1010 0.7397 0.0381 0.0497 0.0660 178 LEU D O 7889 C CB . LEU E 190 ? 0.9645 0.9409 0.6537 0.0274 0.0585 0.0577 178 LEU D CB 7890 C CG . LEU E 190 ? 0.9541 0.8992 0.6292 0.0181 0.0557 0.0562 178 LEU D CG 7891 C CD1 . LEU E 190 ? 1.0399 0.9268 0.6760 0.0201 0.0581 0.0602 178 LEU D CD1 7892 C CD2 . LEU E 190 ? 0.8736 0.8370 0.5623 0.0157 0.0382 0.0724 178 LEU D CD2 7893 N N . SER E 191 ? 1.0282 1.0786 0.7455 0.0283 0.0529 0.0316 179 SER D N 7894 C CA . SER E 191 ? 1.0428 1.1157 0.7623 0.0389 0.0389 0.0410 179 SER D CA 7895 C C . SER E 191 ? 1.0182 1.0580 0.7407 0.0325 0.0368 0.0466 179 SER D C 7896 O O . SER E 191 ? 1.0313 1.0468 0.7583 0.0213 0.0478 0.0272 179 SER D O 7897 C CB . SER E 191 ? 1.1007 1.2201 0.8314 0.0508 0.0326 0.0116 179 SER D CB 7898 O OG . SER E 191 ? 1.1542 1.2717 0.9118 0.0370 0.0449 -0.0263 179 SER D OG 7899 N N . SER E 192 ? 0.9659 0.9976 0.6832 0.0384 0.0287 0.0723 180 SER D N 7900 C CA . SER E 192 ? 0.9916 0.9891 0.7119 0.0329 0.0283 0.0758 180 SER D CA 7901 C C . SER E 192 ? 1.0135 1.0158 0.7342 0.0521 0.0219 0.0916 180 SER D C 7902 O O . SER E 192 ? 1.0418 1.0419 0.7490 0.0594 0.0229 0.1186 180 SER D O 7903 C CB . SER E 192 ? 1.0234 0.9864 0.7361 0.0166 0.0279 0.0898 180 SER D CB 7904 O OG . SER E 192 ? 1.0680 0.9949 0.7790 0.0094 0.0287 0.0873 180 SER D OG 7905 N N . VAL E 193 ? 1.0039 1.0087 0.7398 0.0623 0.0193 0.0750 181 VAL D N 7906 C CA . VAL E 193 ? 1.0095 1.0155 0.7432 0.0905 0.0108 0.0902 181 VAL D CA 7907 C C . VAL E 193 ? 1.0321 0.9976 0.7801 0.0881 0.0178 0.0881 181 VAL D C 7908 O O . VAL E 193 ? 1.0149 0.9625 0.7751 0.0666 0.0282 0.0661 181 VAL D O 7909 C CB . VAL E 193 ? 0.9641 1.0292 0.7106 0.1195 -0.0067 0.0676 181 VAL D CB 7910 C CG1 . VAL E 193 ? 0.9519 1.0532 0.6743 0.1259 -0.0137 0.0696 181 VAL D CG1 7911 C CG2 . VAL E 193 ? 0.8811 0.9710 0.6740 0.1066 -0.0019 0.0213 181 VAL D CG2 7912 N N . VAL E 194 ? 1.0732 1.0164 0.8120 0.1126 0.0158 0.1121 182 VAL D N 7913 C CA . VAL E 194 ? 1.1254 1.0250 0.8785 0.1146 0.0251 0.1104 182 VAL D CA 7914 C C . VAL E 194 ? 1.1943 1.0910 0.9440 0.1611 0.0162 0.1276 182 VAL D C 7915 O O . VAL E 194 ? 1.2063 1.0859 0.9187 0.1829 0.0152 0.1635 182 VAL D O 7916 C CB . VAL E 194 ? 1.1919 1.0301 0.9325 0.0848 0.0418 0.1270 182 VAL D CB 7917 C CG1 . VAL E 194 ? 1.2726 1.1007 0.9904 0.0833 0.0472 0.1611 182 VAL D CG1 7918 C CG2 . VAL E 194 ? 1.2168 1.0021 0.9670 0.0915 0.0541 0.1277 182 VAL D CG2 7919 N N . THR E 195 ? 1.2090 1.1199 0.9953 0.1795 0.0120 0.1023 183 THR D N 7920 C CA . THR E 195 ? 1.1939 1.1059 0.9821 0.2330 -0.0014 0.1155 183 THR D CA 7921 C C . THR E 195 ? 1.1640 0.9899 0.9404 0.2371 0.0209 0.1417 183 THR D C 7922 O O . THR E 195 ? 1.1485 0.9388 0.9470 0.2058 0.0412 0.1230 183 THR D O 7923 C CB . THR E 195 ? 1.1711 1.1506 1.0217 0.2554 -0.0172 0.0696 183 THR D CB 7924 O OG1 . THR E 195 ? 1.1648 1.1242 1.0545 0.2196 0.0086 0.0380 183 THR D OG1 7925 C CG2 . THR E 195 ? 1.1243 1.1901 0.9919 0.2543 -0.0390 0.0393 183 THR D CG2 7926 N N . VAL E 196 ? 1.1839 0.9697 0.9184 0.2765 0.0203 0.1846 184 VAL D N 7927 C CA . VAL E 196 ? 1.2367 0.9274 0.9562 0.2814 0.0485 0.2132 184 VAL D CA 7928 C C . VAL E 196 ? 1.3580 1.0259 1.0534 0.3539 0.0374 0.2424 184 VAL D C 7929 O O . VAL E 196 ? 1.3871 1.1063 1.0547 0.3991 0.0065 0.2522 184 VAL D O 7930 C CB . VAL E 196 ? 1.2331 0.8617 0.9138 0.2452 0.0772 0.2466 184 VAL D CB 7931 C CG1 . VAL E 196 ? 1.1707 0.8150 0.8789 0.1802 0.0847 0.2162 184 VAL D CG1 7932 C CG2 . VAL E 196 ? 1.2308 0.8774 0.8565 0.2695 0.0690 0.2809 184 VAL D CG2 7933 N N . PRO E 197 ? 1.4263 1.0153 1.1284 0.3691 0.0609 0.2547 185 PRO D N 7934 C CA . PRO E 197 ? 1.5448 1.0924 1.2135 0.4452 0.0540 0.2909 185 PRO D CA 7935 C C . PRO E 197 ? 1.6477 1.1401 1.2251 0.4709 0.0638 0.3510 185 PRO D C 7936 O O . PRO E 197 ? 1.6669 1.1165 1.2193 0.4202 0.0959 0.3684 185 PRO D O 7937 C CB . PRO E 197 ? 1.5844 1.0374 1.2771 0.4387 0.0916 0.2918 185 PRO D CB 7938 C CG . PRO E 197 ? 1.5067 0.9361 1.2212 0.3546 0.1214 0.2680 185 PRO D CG 7939 C CD . PRO E 197 ? 1.4058 0.9402 1.1443 0.3213 0.0932 0.2316 185 PRO D CD 7940 N N . SER E 198 ? 1.7266 1.2211 1.2539 0.5515 0.0371 0.3806 186 SER D N 7941 C CA . SER E 198 ? 1.8479 1.2892 1.2693 0.5855 0.0459 0.4393 186 SER D CA 7942 C C . SER E 198 ? 1.9853 1.2851 1.3633 0.5752 0.1062 0.4863 186 SER D C 7943 O O . SER E 198 ? 2.0803 1.3419 1.3953 0.5659 0.1304 0.5166 186 SER D O 7944 C CB . SER E 198 ? 1.9142 1.4175 1.2987 0.6672 -0.0076 0.4418 186 SER D CB 7945 O OG . SER E 198 ? 1.8232 1.4614 1.2539 0.6752 -0.0616 0.3927 186 SER D OG 7946 N N . SER E 199 ? 1.9951 1.2255 1.4186 0.5675 0.1339 0.4805 187 SER D N 7947 C CA . SER E 199 ? 2.1098 1.2177 1.5130 0.5466 0.1920 0.5085 187 SER D CA 7948 C C . SER E 199 ? 2.0732 1.1314 1.4990 0.4594 0.2436 0.5033 187 SER D C 7949 O O . SER E 199 ? 2.1624 1.1292 1.5821 0.4295 0.2960 0.5183 187 SER D O 7950 C CB . SER E 199 ? 2.1592 1.2159 1.6047 0.5774 0.1994 0.4981 187 SER D CB 7951 O OG . SER E 199 ? 2.2137 1.3165 1.6443 0.6600 0.1528 0.5029 187 SER D OG 7952 N N . SER E 200 ? 1.9429 1.0821 1.4086 0.4116 0.2245 0.4693 188 SER D N 7953 C CA . SER E 200 ? 1.9054 1.0309 1.4104 0.3249 0.2597 0.4489 188 SER D CA 7954 C C . SER E 200 ? 1.9129 1.0821 1.3857 0.3016 0.2608 0.4635 188 SER D C 7955 O O . SER E 200 ? 1.8514 1.0522 1.3694 0.2345 0.2718 0.4359 188 SER D O 7956 C CB . SER E 200 ? 1.7470 0.9448 1.3347 0.2750 0.2361 0.3834 188 SER D CB 7957 O OG . SER E 200 ? 1.6253 0.9429 1.2263 0.2821 0.1854 0.3563 188 SER D OG 7958 N N . LEU E 201 ? 1.9735 1.1515 1.3702 0.3586 0.2462 0.5013 189 LEU D N 7959 C CA . LEU E 201 ? 1.9521 1.1774 1.3171 0.3390 0.2475 0.5088 189 LEU D CA 7960 C C . LEU E 201 ? 2.0215 1.1696 1.3641 0.3104 0.3069 0.5337 189 LEU D C 7961 O O . LEU E 201 ? 2.0096 1.1816 1.3269 0.2937 0.3199 0.5415 189 LEU D O 7962 C CB . LEU E 201 ? 1.9842 1.2847 1.2941 0.4014 0.1959 0.5131 189 LEU D CB 7963 C CG . LEU E 201 ? 1.8578 1.2638 1.2027 0.4210 0.1360 0.4762 189 LEU D CG 7964 C CD1 . LEU E 201 ? 1.9098 1.3879 1.2044 0.4829 0.0864 0.4747 189 LEU D CD1 7965 C CD2 . LEU E 201 ? 1.6851 1.1661 1.0948 0.3477 0.1328 0.4325 189 LEU D CD2 7966 N N . GLY E 202 ? 1.6483 0.9012 1.5151 -0.0261 0.0562 0.1532 190 GLY D N 7967 C CA . GLY E 202 ? 1.7050 0.9586 1.6166 -0.0627 0.0283 0.1796 190 GLY D CA 7968 C C . GLY E 202 ? 1.8396 0.9903 1.7189 -0.0869 -0.0001 0.1414 190 GLY D C 7969 O O . GLY E 202 ? 1.8236 0.9648 1.7554 -0.1235 -0.0331 0.1652 190 GLY D O 7970 N N . THR E 203 ? 1.9922 1.0664 1.7875 -0.0634 0.0091 0.0855 191 THR D N 7971 C CA . THR E 203 ? 2.1351 1.0949 1.8742 -0.0759 -0.0252 0.0361 191 THR D CA 7972 C C . THR E 203 ? 2.1432 1.1152 1.8014 -0.0794 -0.0408 -0.0038 191 THR D C 7973 O O . THR E 203 ? 2.1858 1.1408 1.8397 -0.1180 -0.0900 -0.0160 191 THR D O 7974 C CB . THR E 203 ? 2.2870 1.1209 1.9737 -0.0314 -0.0025 -0.0014 191 THR D CB 7975 O OG1 . THR E 203 ? 2.3024 1.1251 2.0722 -0.0283 0.0124 0.0394 191 THR D OG1 7976 C CG2 . THR E 203 ? 2.4593 1.1585 2.0738 -0.0386 -0.0507 -0.0620 191 THR D CG2 7977 N N . GLN E 204 ? 2.1091 1.1148 1.7157 -0.0400 -0.0009 -0.0167 192 GLN D N 7978 C CA . GLN E 204 ? 2.0727 1.0961 1.6052 -0.0364 -0.0086 -0.0484 192 GLN D CA 7979 C C . GLN E 204 ? 1.9042 1.0489 1.4833 -0.0689 -0.0236 -0.0184 192 GLN D C 7980 O O . GLN E 204 ? 1.7740 1.0042 1.4158 -0.0658 -0.0056 0.0208 192 GLN D O 7981 C CB . GLN E 204 ? 2.0718 1.0923 1.5488 0.0220 0.0430 -0.0603 192 GLN D CB 7982 C CG . GLN E 204 ? 2.2175 1.1157 1.6173 0.0701 0.0636 -0.0964 192 GLN D CG 7983 C CD . GLN E 204 ? 2.3451 1.1505 1.6303 0.0729 0.0255 -0.1570 192 GLN D CD 7984 O OE1 . GLN E 204 ? 2.3291 1.1764 1.5891 0.0457 -0.0049 -0.1674 192 GLN D OE1 7985 N NE2 . GLN E 204 ? 2.4785 1.1527 1.6900 0.1094 0.0231 -0.1992 192 GLN D NE2 7986 N N . THR E 205 ? 1.9290 1.0772 1.4721 -0.0954 -0.0594 -0.0384 193 THR D N 7987 C CA . THR E 205 ? 1.8386 1.0977 1.4186 -0.1200 -0.0713 -0.0118 193 THR D CA 7988 C C . THR E 205 ? 1.8150 1.1148 1.3447 -0.0937 -0.0505 -0.0292 193 THR D C 7989 O O . THR E 205 ? 1.8780 1.1449 1.3400 -0.0946 -0.0666 -0.0607 193 THR D O 7990 C CB . THR E 205 ? 1.8456 1.1015 1.4434 -0.1699 -0.1256 -0.0075 193 THR D CB 7991 O OG1 . THR E 205 ? 1.9517 1.1186 1.4627 -0.1705 -0.1549 -0.0595 193 THR D OG1 7992 C CG2 . THR E 205 ? 1.8637 1.0922 1.5400 -0.1992 -0.1488 0.0255 193 THR D CG2 7993 N N . TYR E 206 ? 1.7015 1.0718 1.2695 -0.0696 -0.0197 -0.0060 194 TYR D N 7994 C CA . TYR E 206 ? 1.6432 1.0568 1.1919 -0.0448 -0.0014 -0.0113 194 TYR D CA 7995 C C . TYR E 206 ? 1.5441 1.0375 1.1079 -0.0682 -0.0254 -0.0036 194 TYR D C 7996 O O . TYR E 206 ? 1.4756 1.0395 1.0924 -0.0717 -0.0304 0.0204 194 TYR D O 7997 C CB . TYR E 206 ? 1.6109 1.0583 1.2122 -0.0119 0.0292 0.0127 194 TYR D CB 7998 C CG . TYR E 206 ? 1.7220 1.0999 1.3163 0.0178 0.0604 0.0134 194 TYR D CG 7999 C CD1 . TYR E 206 ? 1.8533 1.1550 1.3715 0.0431 0.0791 -0.0129 194 TYR D CD1 8000 C CD2 . TYR E 206 ? 1.6825 1.0704 1.3398 0.0264 0.0711 0.0409 194 TYR D CD2 8001 C CE1 . TYR E 206 ? 1.9207 1.1579 1.4282 0.0796 0.1129 -0.0109 194 TYR D CE1 8002 C CE2 . TYR E 206 ? 1.7392 1.0669 1.3981 0.0554 0.1023 0.0468 194 TYR D CE2 8003 C CZ . TYR E 206 ? 1.8585 1.1106 1.4435 0.0835 0.1256 0.0213 194 TYR D CZ 8004 O OH . TYR E 206 ? 1.9270 1.1183 1.5093 0.1216 0.1618 0.0284 194 TYR D OH 8005 N N . ILE E 207 ? 1.5695 1.0501 1.0802 -0.0784 -0.0408 -0.0246 195 ILE D N 8006 C CA . ILE E 207 ? 1.4770 1.0307 1.0031 -0.1005 -0.0631 -0.0151 195 ILE D CA 8007 C C . ILE E 207 ? 1.4928 1.0874 1.0083 -0.0756 -0.0464 -0.0170 195 ILE D C 8008 O O . ILE E 207 ? 1.4827 1.0382 0.9420 -0.0541 -0.0318 -0.0330 195 ILE D O 8009 C CB . ILE E 207 ? 1.4369 0.9586 0.9298 -0.1386 -0.1041 -0.0277 195 ILE D CB 8010 C CG1 . ILE E 207 ? 1.4357 0.9265 0.9696 -0.1687 -0.1270 -0.0124 195 ILE D CG1 8011 C CG2 . ILE E 207 ? 1.3061 0.9101 0.8207 -0.1582 -0.1228 -0.0113 195 ILE D CG2 8012 C CD1 . ILE E 207 ? 1.5060 0.9627 1.0344 -0.2126 -0.1801 -0.0168 195 ILE D CD1 8013 N N . CYS E 208 ? 1.5016 1.1752 1.0716 -0.0734 -0.0490 0.0020 196 CYS D N 8014 C CA . CYS E 208 ? 1.4643 1.1822 1.0500 -0.0534 -0.0401 0.0074 196 CYS D CA 8015 C C . CYS E 208 ? 1.4477 1.1944 1.0045 -0.0738 -0.0594 0.0037 196 CYS D C 8016 O O . CYS E 208 ? 1.4514 1.2378 1.0262 -0.0988 -0.0823 0.0119 196 CYS D O 8017 C CB . CYS E 208 ? 1.3959 1.1707 1.0525 -0.0387 -0.0451 0.0224 196 CYS D CB 8018 S SG . CYS E 208 ? 1.9082 1.7288 1.6175 -0.0143 -0.0432 0.0344 196 CYS D SG 8019 N N . ASN E 209 ? 1.4013 1.1344 0.9153 -0.0590 -0.0481 -0.0019 197 ASN D N 8020 C CA . ASN E 209 ? 1.3326 1.0925 0.8141 -0.0761 -0.0685 -0.0037 197 ASN D CA 8021 C C . ASN E 209 ? 1.2177 1.0499 0.7500 -0.0599 -0.0594 0.0192 197 ASN D C 8022 O O . ASN E 209 ? 1.2080 1.0435 0.7340 -0.0301 -0.0348 0.0309 197 ASN D O 8023 C CB . ASN E 209 ? 1.4268 1.1196 0.8071 -0.0671 -0.0698 -0.0278 197 ASN D CB 8024 C CG . ASN E 209 ? 1.5265 1.1328 0.8595 -0.0841 -0.0899 -0.0556 197 ASN D CG 8025 O OD1 . ASN E 209 ? 1.6420 1.1775 0.9219 -0.0546 -0.0694 -0.0741 197 ASN D OD1 8026 N ND2 . ASN E 209 ? 1.5025 1.1157 0.8639 -0.1293 -0.1299 -0.0530 197 ASN D ND2 8027 N N . VAL E 210 ? 1.2012 1.0931 0.7884 -0.0753 -0.0780 0.0306 198 VAL D N 8028 C CA . VAL E 210 ? 1.2429 1.1970 0.8889 -0.0605 -0.0767 0.0501 198 VAL D CA 8029 C C . VAL E 210 ? 1.4322 1.4281 1.0610 -0.0809 -0.0945 0.0585 198 VAL D C 8030 O O . VAL E 210 ? 1.3855 1.3921 1.0010 -0.1099 -0.1168 0.0569 198 VAL D O 8031 C CB . VAL E 210 ? 1.0865 1.0734 0.8028 -0.0501 -0.0872 0.0529 198 VAL D CB 8032 C CG1 . VAL E 210 ? 0.9979 1.0317 0.7827 -0.0314 -0.0932 0.0682 198 VAL D CG1 8033 C CG2 . VAL E 210 ? 1.0712 1.0176 0.8033 -0.0332 -0.0779 0.0457 198 VAL D CG2 8034 N N . ASN E 211 ? 1.6139 1.6399 1.2540 -0.0651 -0.0846 0.0761 199 ASN D N 8035 C CA . ASN E 211 ? 1.6355 1.7064 1.2628 -0.0816 -0.1013 0.0891 199 ASN D CA 8036 C C . ASN E 211 ? 1.5349 1.6716 1.2468 -0.0645 -0.0970 0.1184 199 ASN D C 8037 O O . ASN E 211 ? 1.5613 1.7051 1.3132 -0.0367 -0.0763 0.1382 199 ASN D O 8038 C CB . ASN E 211 ? 1.7539 1.7916 1.2850 -0.0786 -0.0994 0.0823 199 ASN D CB 8039 C CG . ASN E 211 ? 1.9036 1.8621 1.3505 -0.0960 -0.1158 0.0473 199 ASN D CG 8040 O OD1 . ASN E 211 ? 1.9631 1.9122 1.3820 -0.1320 -0.1539 0.0376 199 ASN D OD1 8041 N ND2 . ASN E 211 ? 1.9528 1.8532 1.3708 -0.0708 -0.0903 0.0325 199 ASN D ND2 8042 N N . HIS E 212 ? 1.3632 1.5495 1.1125 -0.0794 -0.1168 0.1270 200 HIS D N 8043 C CA . HIS E 212 ? 1.1745 1.4181 1.0056 -0.0639 -0.1184 0.1527 200 HIS D CA 8044 C C . HIS E 212 ? 1.1029 1.3975 0.9203 -0.0840 -0.1314 0.1740 200 HIS D C 8045 O O . HIS E 212 ? 1.0872 1.4074 0.9053 -0.1045 -0.1487 0.1750 200 HIS D O 8046 C CB . HIS E 212 ? 1.1100 1.3650 1.0058 -0.0490 -0.1303 0.1424 200 HIS D CB 8047 C CG . HIS E 212 ? 1.0557 1.3449 1.0450 -0.0254 -0.1383 0.1602 200 HIS D CG 8048 N ND1 . HIS E 212 ? 1.0227 1.3319 1.0574 -0.0076 -0.1562 0.1513 200 HIS D ND1 8049 C CD2 . HIS E 212 ? 1.0419 1.3474 1.0934 -0.0128 -0.1321 0.1896 200 HIS D CD2 8050 C CE1 . HIS E 212 ? 0.9891 1.3148 1.1111 0.0114 -0.1674 0.1676 200 HIS D CE1 8051 N NE2 . HIS E 212 ? 1.0014 1.3301 1.1447 0.0056 -0.1528 0.1962 200 HIS D NE2 8052 N N . LYS E 213 ? 1.0572 1.3734 0.8671 -0.0750 -0.1216 0.1986 201 LYS D N 8053 C CA . LYS E 213 ? 1.0445 1.4065 0.8281 -0.0930 -0.1369 0.2203 201 LYS D CA 8054 C C . LYS E 213 ? 1.0132 1.4439 0.8837 -0.0981 -0.1496 0.2461 201 LYS D C 8055 O O . LYS E 213 ? 1.0385 1.4976 0.8938 -0.1253 -0.1711 0.2532 201 LYS D O 8056 C CB . LYS E 213 ? 1.0633 1.4395 0.8145 -0.0700 -0.1181 0.2465 201 LYS D CB 8057 C CG . LYS E 213 ? 1.0823 1.5087 0.7998 -0.0836 -0.1369 0.2712 201 LYS D CG 8058 C CD . LYS E 213 ? 1.1326 1.5796 0.8070 -0.0489 -0.1126 0.3023 201 LYS D CD 8059 C CE . LYS E 213 ? 1.0982 1.5950 0.7270 -0.0602 -0.1366 0.3257 201 LYS D CE 8060 N NZ . LYS E 213 ? 1.1734 1.6982 0.7466 -0.0160 -0.1090 0.3610 201 LYS D NZ 8061 N N . PRO E 214 ? 0.9729 1.4282 0.9422 -0.0710 -0.1403 0.2627 202 PRO D N 8062 C CA . PRO E 214 ? 1.0054 1.5214 1.0491 -0.0701 -0.1525 0.2868 202 PRO D CA 8063 C C . PRO E 214 ? 1.0340 1.5532 1.0894 -0.0710 -0.1633 0.2674 202 PRO D C 8064 O O . PRO E 214 ? 1.0332 1.5992 1.1493 -0.0599 -0.1691 0.2855 202 PRO D O 8065 C CB . PRO E 214 ? 0.9439 1.4699 1.0946 -0.0384 -0.1468 0.3067 202 PRO D CB 8066 C CG . PRO E 214 ? 0.8737 1.3382 1.0202 -0.0239 -0.1389 0.2814 202 PRO D CG 8067 C CD . PRO E 214 ? 0.9203 1.3519 0.9504 -0.0409 -0.1250 0.2665 202 PRO D CD 8068 N N . SER E 215 ? 1.0582 1.5330 1.0578 -0.0784 -0.1627 0.2367 203 SER D N 8069 C CA . SER E 215 ? 1.0703 1.5577 1.0771 -0.0701 -0.1656 0.2282 203 SER D CA 8070 C C . SER E 215 ? 1.1563 1.6396 1.1050 -0.1052 -0.1715 0.2308 203 SER D C 8071 O O . SER E 215 ? 1.1913 1.6937 1.1472 -0.0979 -0.1685 0.2359 203 SER D O 8072 C CB . SER E 215 ? 1.0683 1.5104 1.0890 -0.0326 -0.1626 0.1937 203 SER D CB 8073 O OG . SER E 215 ? 1.1001 1.4837 1.0707 -0.0429 -0.1570 0.1708 203 SER D OG 8074 N N . ASN E 216 ? 1.2098 1.6675 1.1031 -0.1385 -0.1821 0.2301 204 ASN D N 8075 C CA . ASN E 216 ? 1.2816 1.7175 1.1266 -0.1766 -0.2010 0.2292 204 ASN D CA 8076 C C . ASN E 216 ? 1.2559 1.6515 1.0886 -0.1689 -0.1908 0.2085 204 ASN D C 8077 O O . ASN E 216 ? 1.2481 1.6653 1.0967 -0.1854 -0.1987 0.2285 204 ASN D O 8078 C CB . ASN E 216 ? 1.3379 1.8430 1.2244 -0.2028 -0.2212 0.2722 204 ASN D CB 8079 C CG . ASN E 216 ? 1.3834 1.9268 1.2736 -0.2180 -0.2391 0.2955 204 ASN D CG 8080 O OD1 . ASN E 216 ? 1.3643 1.9778 1.3190 -0.2077 -0.2345 0.3295 204 ASN D OD1 8081 N ND2 . ASN E 216 ? 1.4463 1.9433 1.2614 -0.2369 -0.2596 0.2777 204 ASN D ND2 8082 N N . THR E 217 ? 1.2371 1.5809 1.0515 -0.1431 -0.1733 0.1770 205 THR D N 8083 C CA . THR E 217 ? 1.2012 1.5078 1.0044 -0.1314 -0.1635 0.1580 205 THR D CA 8084 C C . THR E 217 ? 1.2135 1.4423 0.9573 -0.1434 -0.1621 0.1312 205 THR D C 8085 O O . THR E 217 ? 1.2601 1.4559 0.9953 -0.1220 -0.1476 0.1151 205 THR D O 8086 C CB . THR E 217 ? 1.1698 1.4794 1.0104 -0.0840 -0.1500 0.1433 205 THR D CB 8087 O OG1 . THR E 217 ? 1.1386 1.5106 1.0258 -0.0630 -0.1515 0.1622 205 THR D OG1 8088 C CG2 . THR E 217 ? 1.1765 1.4584 0.9998 -0.0686 -0.1431 0.1283 205 THR D CG2 8089 N N . LYS E 218 ? 1.1820 1.3825 0.8944 -0.1756 -0.1784 0.1315 206 LYS D N 8090 C CA . LYS E 218 ? 1.1871 1.3047 0.8410 -0.1824 -0.1785 0.1028 206 LYS D CA 8091 C C . LYS E 218 ? 1.1924 1.2913 0.8619 -0.1856 -0.1749 0.1040 206 LYS D C 8092 O O . LYS E 218 ? 1.2204 1.3474 0.9195 -0.2110 -0.1919 0.1311 206 LYS D O 8093 C CB . LYS E 218 ? 1.2387 1.3160 0.8326 -0.2156 -0.2115 0.0943 206 LYS D CB 8094 C CG . LYS E 218 ? 1.3353 1.3155 0.8612 -0.2183 -0.2167 0.0600 206 LYS D CG 8095 C CD . LYS E 218 ? 1.4555 1.3819 0.9076 -0.2440 -0.2613 0.0416 206 LYS D CD 8096 C CE . LYS E 218 ? 1.5535 1.3708 0.9339 -0.2405 -0.2703 0.0017 206 LYS D CE 8097 N NZ . LYS E 218 ? 1.5326 1.3185 0.8713 -0.1901 -0.2194 -0.0177 206 LYS D NZ 8098 N N . VAL E 219 ? 1.1802 1.2387 0.8401 -0.1591 -0.1527 0.0833 207 VAL D N 8099 C CA . VAL E 219 ? 1.1805 1.2250 0.8544 -0.1560 -0.1463 0.0871 207 VAL D CA 8100 C C . VAL E 219 ? 1.2858 1.2442 0.9174 -0.1587 -0.1410 0.0618 207 VAL D C 8101 O O . VAL E 219 ? 1.2715 1.1946 0.8803 -0.1353 -0.1235 0.0419 207 VAL D O 8102 C CB . VAL E 219 ? 1.0357 1.1178 0.7436 -0.1139 -0.1286 0.0885 207 VAL D CB 8103 C CG1 . VAL E 219 ? 0.9997 1.0735 0.7127 -0.1055 -0.1213 0.0964 207 VAL D CG1 8104 C CG2 . VAL E 219 ? 0.9711 1.1312 0.7133 -0.1006 -0.1319 0.1097 207 VAL D CG2 8105 N N . ASP E 220 ? 1.3818 1.3093 1.0133 -0.1850 -0.1558 0.0693 208 ASP D N 8106 C CA . ASP E 220 ? 1.4481 1.2896 1.0449 -0.1850 -0.1517 0.0463 208 ASP D CA 8107 C C . ASP E 220 ? 1.4244 1.2759 1.0612 -0.1730 -0.1360 0.0636 208 ASP D C 8108 O O . ASP E 220 ? 1.4931 1.3343 1.1556 -0.1971 -0.1502 0.0844 208 ASP D O 8109 C CB . ASP E 220 ? 1.5657 1.3434 1.1313 -0.2236 -0.1902 0.0365 208 ASP D CB 8110 C CG . ASP E 220 ? 1.6634 1.4157 1.1635 -0.2269 -0.2089 0.0114 208 ASP D CG 8111 O OD1 . ASP E 220 ? 1.7734 1.4374 1.2075 -0.2355 -0.2348 -0.0203 208 ASP D OD1 8112 O OD2 . ASP E 220 ? 1.6379 1.4555 1.1482 -0.2167 -0.1999 0.0226 208 ASP D OD2 8113 N N . LYS E 221 ? 1.3600 1.2323 1.0083 -0.1355 -0.1117 0.0586 209 LYS D N 8114 C CA . LYS E 221 ? 1.3014 1.1896 0.9779 -0.1163 -0.1001 0.0738 209 LYS D CA 8115 C C . LYS E 221 ? 1.2703 1.0841 0.9339 -0.1134 -0.0889 0.0610 209 LYS D C 8116 O O . LYS E 221 ? 1.2405 1.0119 0.8846 -0.0955 -0.0752 0.0389 209 LYS D O 8117 C CB . LYS E 221 ? 1.2299 1.1647 0.9223 -0.0753 -0.0928 0.0694 209 LYS D CB 8118 C CG . LYS E 221 ? 1.2312 1.1740 0.9357 -0.0464 -0.0866 0.0771 209 LYS D CG 8119 C CD . LYS E 221 ? 1.2794 1.2704 0.9967 -0.0509 -0.0846 0.1157 209 LYS D CD 8120 C CE . LYS E 221 ? 1.3274 1.3288 1.0459 -0.0168 -0.0772 0.1265 209 LYS D CE 8121 N NZ . LYS E 221 ? 1.3654 1.4231 1.1037 -0.0165 -0.0682 0.1781 209 LYS D NZ 8122 N N . LYS E 222 ? 1.2555 1.0596 0.9400 -0.1284 -0.0926 0.0831 210 LYS D N 8123 C CA . LYS E 222 ? 1.2596 0.9972 0.9417 -0.1234 -0.0814 0.0766 210 LYS D CA 8124 C C . LYS E 222 ? 1.2087 0.9765 0.9125 -0.0871 -0.0644 0.0862 210 LYS D C 8125 O O . LYS E 222 ? 1.1833 1.0169 0.9090 -0.0737 -0.0659 0.1131 210 LYS D O 8126 C CB . LYS E 222 ? 1.2665 0.9784 0.9770 -0.1566 -0.0977 0.1015 210 LYS D CB 8127 C CG . LYS E 222 ? 1.2640 0.9109 0.9828 -0.1496 -0.0857 0.1006 210 LYS D CG 8128 C CD . LYS E 222 ? 1.3127 0.9404 1.0820 -0.1835 -0.1068 0.1343 210 LYS D CD 8129 C CE . LYS E 222 ? 1.3955 0.9596 1.1802 -0.1740 -0.0935 0.1364 210 LYS D CE 8130 N NZ . LYS E 222 ? 1.4585 1.0026 1.3114 -0.2081 -0.1175 0.1761 210 LYS D NZ 8131 N N . VAL E 223 ? 1.1953 0.9166 0.8915 -0.0666 -0.0498 0.0674 211 VAL D N 8132 C CA . VAL E 223 ? 1.1526 0.8924 0.8757 -0.0352 -0.0440 0.0759 211 VAL D CA 8133 C C . VAL E 223 ? 1.2288 0.9412 0.9699 -0.0377 -0.0354 0.0968 211 VAL D C 8134 O O . VAL E 223 ? 1.2948 0.9376 1.0297 -0.0477 -0.0236 0.0898 211 VAL D O 8135 C CB . VAL E 223 ? 1.0964 0.8100 0.8300 -0.0128 -0.0350 0.0604 211 VAL D CB 8136 C CG1 . VAL E 223 ? 1.0422 0.7675 0.8149 0.0146 -0.0410 0.0716 211 VAL D CG1 8137 C CG2 . VAL E 223 ? 1.0528 0.8001 0.7851 -0.0087 -0.0449 0.0480 211 VAL D CG2 8138 N N . GLU E 224 ? 1.2305 0.9976 0.9897 -0.0228 -0.0407 0.1236 212 GLU D N 8139 C CA . GLU E 224 ? 1.3195 1.0752 1.1046 -0.0219 -0.0321 0.1535 212 GLU D CA 8140 C C . GLU E 224 ? 1.4066 1.1874 1.2009 0.0165 -0.0360 0.1597 212 GLU D C 8141 O O . GLU E 224 ? 1.4318 1.2629 1.2087 0.0446 -0.0531 0.1517 212 GLU D O 8142 C CB . GLU E 224 ? 1.3233 1.1300 1.1287 -0.0376 -0.0346 0.1965 212 GLU D CB 8143 C CG . GLU E 224 ? 1.3407 1.1249 1.1514 -0.0802 -0.0450 0.1956 212 GLU D CG 8144 C CD . GLU E 224 ? 1.3152 1.1577 1.1764 -0.0981 -0.0499 0.2548 212 GLU D CD 8145 O OE1 . GLU E 224 ? 1.3010 1.1619 1.1763 -0.1266 -0.0654 0.2649 212 GLU D OE1 8146 O OE2 . GLU E 224 ? 1.2964 1.1725 1.1918 -0.0828 -0.0386 0.2989 212 GLU D OE2 8147 N N . PRO E 225 ? 1.4630 1.2035 1.2837 0.0201 -0.0251 0.1725 213 PRO D N 8148 C CA . PRO E 225 ? 1.4845 1.2435 1.3205 0.0536 -0.0361 0.1815 213 PRO D CA 8149 C C . PRO E 225 ? 1.5146 1.3442 1.3379 0.0781 -0.0453 0.2136 213 PRO D C 8150 O O . PRO E 225 ? 1.5381 1.3966 1.3678 0.0643 -0.0314 0.2477 213 PRO D O 8151 C CB . PRO E 225 ? 1.4917 1.1882 1.3650 0.0465 -0.0155 0.1943 213 PRO D CB 8152 C CG . PRO E 225 ? 1.5030 1.1618 1.3756 0.0143 0.0018 0.2025 213 PRO D CG 8153 C CD . PRO E 225 ? 1.4891 1.1581 1.3265 -0.0047 -0.0066 0.1778 213 PRO D CD 8154 N N . LYS E 226 ? 1.5171 1.3749 1.3248 0.1175 -0.0719 0.2063 214 LYS D N 8155 C CA . LYS E 226 ? 1.5440 1.4695 1.3195 0.1563 -0.0807 0.2349 214 LYS D CA 8156 C C . LYS E 226 ? 1.5645 1.4836 1.3425 0.1896 -0.1099 0.2340 214 LYS D C 8157 O O . LYS E 226 ? 1.5417 1.4075 1.3625 0.1781 -0.1223 0.2174 214 LYS D O 8158 C CB . LYS E 226 ? 1.5502 1.5319 1.2664 0.1873 -0.0952 0.2176 214 LYS D CB 8159 C CG . LYS E 226 ? 1.5499 1.5084 1.2422 0.2124 -0.1386 0.1630 214 LYS D CG 8160 C CD . LYS E 226 ? 1.5588 1.5696 1.1840 0.2548 -0.1530 0.1456 214 LYS D CD 8161 C CE . LYS E 226 ? 1.5567 1.5330 1.1656 0.2822 -0.2073 0.0887 214 LYS D CE 8162 N NZ . LYS E 226 ? 1.5875 1.6054 1.1224 0.3333 -0.2228 0.0662 214 LYS D NZ 8163 N N . ASP F 1 ? 1.6847 1.0545 1.9609 -0.1881 -0.0998 -0.2390 1 ASP E N 8164 C CA . ASP F 1 ? 1.6877 1.0925 1.9400 -0.1616 -0.1267 -0.2319 1 ASP E CA 8165 C C . ASP F 1 ? 1.7275 1.1737 1.8722 -0.1657 -0.1253 -0.2118 1 ASP E C 8166 O O . ASP F 1 ? 1.7593 1.2249 1.8581 -0.1951 -0.0975 -0.2056 1 ASP E O 8167 C CB . ASP F 1 ? 1.6124 1.0596 1.9193 -0.1658 -0.0995 -0.2572 1 ASP E CB 8168 C CG . ASP F 1 ? 1.5746 0.9832 2.0004 -0.1504 -0.1044 -0.2722 1 ASP E CG 8169 O OD1 . ASP F 1 ? 1.5013 0.9370 1.9734 -0.1384 -0.1010 -0.2827 1 ASP E OD1 8170 O OD2 . ASP F 1 ? 1.6149 0.9783 2.0824 -0.1473 -0.1080 -0.2652 1 ASP E OD2 8171 N N . ILE F 2 ? 1.7227 1.1795 1.8324 -0.1363 -0.1540 -0.2007 2 ILE E N 8172 C CA . ILE F 2 ? 1.7211 1.2172 1.7399 -0.1338 -0.1463 -0.1812 2 ILE E CA 8173 C C . ILE F 2 ? 1.6642 1.2276 1.6926 -0.1310 -0.1300 -0.1906 2 ILE E C 8174 O O . ILE F 2 ? 1.6863 1.2413 1.7299 -0.1028 -0.1552 -0.1949 2 ILE E O 8175 C CB . ILE F 2 ? 1.7883 1.2294 1.7368 -0.1014 -0.1870 -0.1588 2 ILE E CB 8176 C CG1 . ILE F 2 ? 1.8546 1.2193 1.7966 -0.1026 -0.2123 -0.1467 2 ILE E CG1 8177 C CG2 . ILE F 2 ? 1.8110 1.2882 1.6690 -0.0988 -0.1650 -0.1379 2 ILE E CG2 8178 C CD1 . ILE F 2 ? 1.8588 1.1617 1.8691 -0.0824 -0.2620 -0.1526 2 ILE E CD1 8179 N N . GLN F 3 ? 1.5767 1.2041 1.5965 -0.1623 -0.0918 -0.1919 3 GLN E N 8180 C CA . GLN F 3 ? 1.4430 1.1338 1.4790 -0.1655 -0.0762 -0.1996 3 GLN E CA 8181 C C . GLN F 3 ? 1.3876 1.1261 1.3686 -0.1497 -0.0743 -0.1751 3 GLN E C 8182 O O . GLN F 3 ? 1.3923 1.1397 1.3232 -0.1543 -0.0653 -0.1519 3 GLN E O 8183 C CB . GLN F 3 ? 1.3868 1.1151 1.4419 -0.2118 -0.0405 -0.2136 3 GLN E CB 8184 C CG . GLN F 3 ? 1.3485 1.1334 1.4193 -0.2198 -0.0264 -0.2216 3 GLN E CG 8185 C CD . GLN F 3 ? 1.3813 1.1737 1.4658 -0.2659 0.0050 -0.2428 3 GLN E CD 8186 O OE1 . GLN F 3 ? 1.4277 1.1740 1.5227 -0.2872 0.0182 -0.2577 3 GLN E OE1 8187 N NE2 . GLN F 3 ? 1.3728 1.2163 1.4513 -0.2827 0.0177 -0.2439 3 GLN E NE2 8188 N N . LEU F 4 ? 1.3310 1.0983 1.3274 -0.1304 -0.0790 -0.1792 4 LEU E N 8189 C CA . LEU F 4 ? 1.2729 1.0827 1.2287 -0.1108 -0.0735 -0.1571 4 LEU E CA 8190 C C . LEU F 4 ? 1.1811 1.0694 1.1652 -0.1291 -0.0530 -0.1556 4 LEU E C 8191 O O . LEU F 4 ? 1.1253 1.0175 1.1529 -0.1324 -0.0554 -0.1757 4 LEU E O 8192 C CB . LEU F 4 ? 1.2707 1.0309 1.2060 -0.0657 -0.1032 -0.1589 4 LEU E CB 8193 C CG . LEU F 4 ? 1.3377 1.0143 1.2170 -0.0432 -0.1306 -0.1521 4 LEU E CG 8194 C CD1 . LEU F 4 ? 1.3550 0.9729 1.2769 -0.0511 -0.1575 -0.1682 4 LEU E CD1 8195 C CD2 . LEU F 4 ? 1.3668 1.0026 1.2020 -0.0037 -0.1545 -0.1503 4 LEU E CD2 8196 N N . THR F 5 ? 1.1476 1.0976 1.1106 -0.1418 -0.0333 -0.1287 5 THR E N 8197 C CA . THR F 5 ? 1.0437 1.0704 1.0309 -0.1594 -0.0205 -0.1188 5 THR E CA 8198 C C . THR F 5 ? 1.0438 1.1020 1.0212 -0.1222 -0.0178 -0.0953 5 THR E C 8199 O O . THR F 5 ? 1.0718 1.1460 1.0235 -0.1108 -0.0044 -0.0681 5 THR E O 8200 C CB . THR F 5 ? 0.9877 1.0692 0.9742 -0.2085 -0.0042 -0.1015 5 THR E CB 8201 O OG1 . THR F 5 ? 1.0355 1.0758 1.0231 -0.2432 -0.0025 -0.1261 5 THR E OG1 8202 C CG2 . THR F 5 ? 0.8823 1.0377 0.8915 -0.2307 -0.0001 -0.0887 5 THR E CG2 8203 N N . GLN F 6 ? 1.0350 1.0982 1.0353 -0.1030 -0.0262 -0.1055 6 GLN E N 8204 C CA . GLN F 6 ? 1.0785 1.1585 1.0706 -0.0642 -0.0230 -0.0875 6 GLN E CA 8205 C C . GLN F 6 ? 1.0443 1.2131 1.0710 -0.0798 -0.0094 -0.0623 6 GLN E C 8206 O O . GLN F 6 ? 1.0217 1.2194 1.0766 -0.1104 -0.0133 -0.0711 6 GLN E O 8207 C CB . GLN F 6 ? 1.1283 1.1500 1.1236 -0.0306 -0.0454 -0.1120 6 GLN E CB 8208 C CG . GLN F 6 ? 1.1869 1.1927 1.1530 0.0143 -0.0437 -0.0996 6 GLN E CG 8209 C CD . GLN F 6 ? 1.2252 1.1532 1.1812 0.0437 -0.0744 -0.1251 6 GLN E CD 8210 O OE1 . GLN F 6 ? 1.1667 1.0572 1.1489 0.0325 -0.0976 -0.1489 6 GLN E OE1 8211 N NE2 . GLN F 6 ? 1.3189 1.2196 1.2409 0.0808 -0.0743 -0.1192 6 GLN E NE2 8212 N N . SER F 7 ? 1.0541 1.2621 1.0781 -0.0592 0.0079 -0.0290 7 SER E N 8213 C CA . SER F 7 ? 1.0658 1.3628 1.1339 -0.0722 0.0174 0.0037 7 SER E CA 8214 C C . SER F 7 ? 1.0502 1.3598 1.1253 -0.0244 0.0339 0.0272 7 SER E C 8215 O O . SER F 7 ? 1.0865 1.3543 1.1242 0.0085 0.0509 0.0318 7 SER E O 8216 C CB . SER F 7 ? 1.1293 1.4874 1.2132 -0.1136 0.0269 0.0331 7 SER E CB 8217 O OG . SER F 7 ? 1.1898 1.5376 1.2547 -0.0932 0.0486 0.0529 7 SER E OG 8218 N N . PRO F 8 ? 0.9938 1.3547 1.1119 -0.0207 0.0315 0.0426 8 PRO E N 8219 C CA . PRO F 8 ? 0.9583 1.3602 1.1066 -0.0610 0.0129 0.0390 8 PRO E CA 8220 C C . PRO F 8 ? 0.9966 1.3380 1.1328 -0.0543 -0.0037 -0.0026 8 PRO E C 8221 O O . PRO F 8 ? 1.0540 1.3287 1.1674 -0.0161 -0.0071 -0.0244 8 PRO E O 8222 C CB . PRO F 8 ? 0.9160 1.3939 1.1153 -0.0517 0.0187 0.0810 8 PRO E CB 8223 C CG . PRO F 8 ? 0.9398 1.3823 1.1311 0.0084 0.0384 0.0845 8 PRO E CG 8224 C CD . PRO F 8 ? 0.9929 1.3732 1.1305 0.0232 0.0514 0.0691 8 PRO E CD 8225 N N . SER F 9 ? 0.9749 1.3357 1.1249 -0.0930 -0.0139 -0.0121 9 SER E N 8226 C CA . SER F 9 ? 0.9824 1.2934 1.1352 -0.0888 -0.0231 -0.0473 9 SER E CA 8227 C C . SER F 9 ? 1.0130 1.3282 1.1890 -0.0510 -0.0257 -0.0387 9 SER E C 8228 O O . SER F 9 ? 1.0115 1.2676 1.1834 -0.0153 -0.0326 -0.0607 9 SER E O 8229 C CB . SER F 9 ? 0.9682 1.2936 1.1209 -0.1419 -0.0236 -0.0581 9 SER E CB 8230 O OG . SER F 9 ? 0.9825 1.3782 1.1467 -0.1660 -0.0262 -0.0232 9 SER E OG 8231 N N . SER F 10 ? 1.0677 1.4505 1.2690 -0.0610 -0.0236 -0.0046 10 SER E N 8232 C CA . SER F 10 ? 1.0490 1.4414 1.2772 -0.0260 -0.0239 0.0096 10 SER E CA 8233 C C . SER F 10 ? 1.0373 1.4753 1.2846 0.0030 -0.0102 0.0509 10 SER E C 8234 O O . SER F 10 ? 1.0987 1.5830 1.3514 -0.0153 -0.0030 0.0767 10 SER E O 8235 C CB . SER F 10 ? 1.0481 1.4765 1.2965 -0.0569 -0.0313 0.0194 10 SER E CB 8236 O OG . SER F 10 ? 1.0678 1.4503 1.3010 -0.0830 -0.0337 -0.0185 10 SER E OG 8237 N N . LEU F 11 ? 0.9833 1.4059 1.2454 0.0480 -0.0039 0.0578 11 LEU E N 8238 C CA . LEU F 11 ? 0.8735 1.3311 1.1600 0.0820 0.0183 0.0962 11 LEU E CA 8239 C C . LEU F 11 ? 0.7882 1.2388 1.1025 0.1208 0.0232 0.1069 11 LEU E C 8240 O O . LEU F 11 ? 0.7987 1.1763 1.0864 0.1461 0.0167 0.0739 11 LEU E O 8241 C CB . LEU F 11 ? 0.8660 1.2690 1.1067 0.1116 0.0379 0.0838 11 LEU E CB 8242 C CG . LEU F 11 ? 0.8968 1.3268 1.1585 0.1477 0.0736 0.1219 11 LEU E CG 8243 C CD1 . LEU F 11 ? 0.8944 1.4300 1.2200 0.1160 0.0795 0.1713 11 LEU E CD1 8244 C CD2 . LEU F 11 ? 0.9429 1.2963 1.1365 0.1761 0.0953 0.1032 11 LEU E CD2 8245 N N . SER F 12 ? 0.7280 1.2536 1.1011 0.1243 0.0321 0.1554 12 SER E N 8246 C CA . SER F 12 ? 0.7224 1.2445 1.1298 0.1633 0.0407 0.1716 12 SER E CA 8247 C C . SER F 12 ? 0.7239 1.2488 1.1516 0.2112 0.0795 0.1990 12 SER E C 8248 O O . SER F 12 ? 0.7224 1.3210 1.2006 0.2042 0.0946 0.2429 12 SER E O 8249 C CB . SER F 12 ? 0.6962 1.2953 1.1619 0.1347 0.0216 0.2098 12 SER E CB 8250 O OG . SER F 12 ? 0.6261 1.2044 1.0643 0.0974 -0.0047 0.1810 12 SER E OG 8251 N N . ALA F 13 ? 0.7633 1.2035 1.1518 0.2587 0.0970 0.1736 13 ALA E N 8252 C CA . ALA F 13 ? 0.8441 1.2644 1.2342 0.3071 0.1434 0.1925 13 ALA E CA 8253 C C . ALA F 13 ? 0.9038 1.2649 1.2911 0.3535 0.1570 0.1852 13 ALA E C 8254 O O . ALA F 13 ? 0.9346 1.2399 1.2915 0.3516 0.1284 0.1510 13 ALA E O 8255 C CB . ALA F 13 ? 0.9276 1.2746 1.2331 0.3168 0.1605 0.1624 13 ALA E CB 8256 N N . SER F 14 ? 0.9423 1.3141 1.3671 0.3950 0.2034 0.2185 14 SER E N 8257 C CA . SER F 14 ? 1.0118 1.3171 1.4293 0.4425 0.2244 0.2116 14 SER E CA 8258 C C . SER F 14 ? 1.1125 1.3000 1.4297 0.4820 0.2629 0.1787 14 SER E C 8259 O O . SER F 14 ? 1.1351 1.3035 1.3982 0.4728 0.2744 0.1679 14 SER E O 8260 C CB . SER F 14 ? 1.0340 1.4211 1.5646 0.4653 0.2534 0.2719 14 SER E CB 8261 O OG . SER F 14 ? 1.0973 1.4225 1.6279 0.5055 0.2665 0.2645 14 SER E OG 8262 N N . VAL F 15 ? 1.1790 1.2800 1.4633 0.5238 0.2825 0.1627 15 VAL E N 8263 C CA . VAL F 15 ? 1.3118 1.2843 1.4837 0.5609 0.3208 0.1309 15 VAL E CA 8264 C C . VAL F 15 ? 1.3752 1.3770 1.5693 0.5862 0.3910 0.1673 15 VAL E C 8265 O O . VAL F 15 ? 1.3300 1.4262 1.6412 0.5998 0.4232 0.2198 15 VAL E O 8266 C CB . VAL F 15 ? 1.3798 1.2518 1.5151 0.6001 0.3318 0.1099 15 VAL E CB 8267 C CG1 . VAL F 15 ? 1.5272 1.2503 1.5244 0.6342 0.3710 0.0748 15 VAL E CG1 8268 C CG2 . VAL F 15 ? 1.2493 1.0962 1.3758 0.5740 0.2636 0.0774 15 VAL E CG2 8269 N N . GLY F 16 ? 1.4691 1.3909 1.5558 0.5910 0.4139 0.1427 16 GLY E N 8270 C CA . GLY F 16 ? 1.5431 1.4764 1.6385 0.6162 0.4882 0.1736 16 GLY E CA 8271 C C . GLY F 16 ? 1.4870 1.5405 1.6551 0.5781 0.4812 0.2080 16 GLY E C 8272 O O . GLY F 16 ? 1.5330 1.6120 1.7244 0.5922 0.5400 0.2386 16 GLY E O 8273 N N . ASP F 17 ? 1.4292 1.5528 1.6332 0.5287 0.4118 0.2030 17 ASP E N 8274 C CA . ASP F 17 ? 1.3914 1.6191 1.6526 0.4854 0.3965 0.2301 17 ASP E CA 8275 C C . ASP F 17 ? 1.4311 1.5896 1.5855 0.4761 0.4078 0.2038 17 ASP E C 8276 O O . ASP F 17 ? 1.5120 1.5440 1.5392 0.4881 0.3989 0.1563 17 ASP E O 8277 C CB . ASP F 17 ? 1.3788 1.6749 1.6822 0.4342 0.3231 0.2237 17 ASP E CB 8278 C CG . ASP F 17 ? 1.3355 1.7685 1.7790 0.4161 0.3138 0.2803 17 ASP E CG 8279 O OD1 . ASP F 17 ? 1.3556 1.8043 1.8582 0.4433 0.3237 0.3014 17 ASP E OD1 8280 O OD2 . ASP F 17 ? 1.2673 1.7882 1.7589 0.3722 0.2929 0.3045 17 ASP E OD2 8281 N N . ARG F 18 ? 1.3918 1.6323 1.5996 0.4526 0.4239 0.2379 18 ARG E N 8282 C CA . ARG F 18 ? 1.3793 1.5703 1.4998 0.4368 0.4315 0.2201 18 ARG E CA 8283 C C . ARG F 18 ? 1.2902 1.5238 1.4135 0.3794 0.3633 0.2032 18 ARG E C 8284 O O . ARG F 18 ? 1.1851 1.5348 1.4092 0.3438 0.3429 0.2359 18 ARG E O 8285 C CB . ARG F 18 ? 1.3459 1.5949 1.5257 0.4466 0.4977 0.2688 18 ARG E CB 8286 C CG . ARG F 18 ? 1.3230 1.5583 1.4465 0.4170 0.4985 0.2632 18 ARG E CG 8287 C CD . ARG F 18 ? 1.3141 1.6469 1.5420 0.4141 0.5520 0.3221 18 ARG E CD 8288 N NE . ARG F 18 ? 1.4134 1.7208 1.6632 0.4695 0.6371 0.3486 18 ARG E NE 8289 C CZ . ARG F 18 ? 1.3730 1.7764 1.7677 0.4891 0.6675 0.3997 18 ARG E CZ 8290 N NH1 . ARG F 18 ? 1.2869 1.8179 1.8093 0.4542 0.6134 0.4314 18 ARG E NH1 8291 N NH2 . ARG F 18 ? 1.4149 1.7815 1.8248 0.5430 0.7532 0.4206 18 ARG E NH2 8292 N N . VAL F 19 ? 0.9212 1.3545 1.6094 -0.0509 -0.3044 0.2626 19 VAL E N 8293 C CA . VAL F 19 ? 0.9573 1.3318 1.5307 -0.0848 -0.3131 0.2484 19 VAL E CA 8294 C C . VAL F 19 ? 0.9709 1.3405 1.5208 -0.0850 -0.2724 0.2397 19 VAL E C 8295 O O . VAL F 19 ? 0.9329 1.3265 1.4956 -0.0491 -0.2216 0.2291 19 VAL E O 8296 C CB . VAL F 19 ? 0.9199 1.2546 1.3953 -0.0729 -0.3051 0.2231 19 VAL E CB 8297 C CG1 . VAL F 19 ? 0.9434 1.2189 1.3051 -0.1075 -0.3141 0.2099 19 VAL E CG1 8298 C CG2 . VAL F 19 ? 0.9239 1.2664 1.4300 -0.0697 -0.3447 0.2343 19 VAL E CG2 8299 N N . THR F 20 ? 1.0230 1.3573 1.5353 -0.1269 -0.2981 0.2443 20 THR E N 8300 C CA . THR F 20 ? 1.0584 1.3789 1.5468 -0.1326 -0.2681 0.2370 20 THR E CA 8301 C C . THR F 20 ? 1.1181 1.3641 1.4858 -0.1610 -0.2791 0.2131 20 THR E C 8302 O O . THR F 20 ? 1.1635 1.3719 1.4995 -0.2016 -0.3266 0.2186 20 THR E O 8303 C CB . THR F 20 ? 1.1189 1.4727 1.7034 -0.1546 -0.2863 0.2697 20 THR E CB 8304 O OG1 . THR F 20 ? 1.2087 1.5355 1.7939 -0.1997 -0.3523 0.2866 20 THR E OG1 8305 C CG2 . THR F 20 ? 1.0973 1.5308 1.8065 -0.1211 -0.2623 0.2934 20 THR E CG2 8306 N N . ILE F 21 ? 1.0853 1.3082 1.3853 -0.1393 -0.2353 0.1867 21 ILE E N 8307 C CA . ILE F 21 ? 1.0803 1.2351 1.2720 -0.1589 -0.2348 0.1617 21 ILE E CA 8308 C C . ILE F 21 ? 1.0349 1.1731 1.2264 -0.1650 -0.2123 0.1565 21 ILE E C 8309 O O . ILE F 21 ? 0.9804 1.1426 1.1953 -0.1370 -0.1684 0.1543 21 ILE E O 8310 C CB . ILE F 21 ? 1.0347 1.1705 1.1548 -0.1333 -0.2046 0.1388 21 ILE E CB 8311 C CG1 . ILE F 21 ? 1.0111 1.1670 1.1425 -0.1256 -0.2283 0.1478 21 ILE E CG1 8312 C CG2 . ILE F 21 ? 1.0453 1.1137 1.0589 -0.1524 -0.2013 0.1143 21 ILE E CG2 8313 C CD1 . ILE F 21 ? 1.0643 1.2022 1.1823 -0.1647 -0.2855 0.1613 21 ILE E CD1 8314 N N . THR F 22 ? 1.0873 1.1799 1.2493 -0.2033 -0.2461 0.1552 22 THR E N 8315 C CA . THR F 22 ? 1.1406 1.2144 1.3145 -0.2144 -0.2359 0.1544 22 THR E CA 8316 C C . THR F 22 ? 1.2173 1.2247 1.2927 -0.2125 -0.2110 0.1191 22 THR E C 8317 O O . THR F 22 ? 1.2723 1.2259 1.2555 -0.2248 -0.2237 0.0960 22 THR E O 8318 C CB . THR F 22 ? 1.2059 1.2611 1.4110 -0.2584 -0.2917 0.1737 22 THR E CB 8319 O OG1 . THR F 22 ? 1.1901 1.3045 1.4881 -0.2620 -0.3198 0.2082 22 THR E OG1 8320 C CG2 . THR F 22 ? 1.2162 1.2700 1.4677 -0.2672 -0.2831 0.1840 22 THR E CG2 8321 N N . CYS F 23 ? 1.2164 1.2298 1.3145 -0.1965 -0.1742 0.1171 23 CYS E N 8322 C CA . CYS F 23 ? 1.2180 1.1712 1.2430 -0.1930 -0.1494 0.0870 23 CYS E CA 8323 C C . CYS F 23 ? 1.1877 1.1238 1.2503 -0.2082 -0.1521 0.0938 23 CYS E C 8324 O O . CYS F 23 ? 1.1224 1.1054 1.2548 -0.1930 -0.1269 0.1148 23 CYS E O 8325 C CB . CYS F 23 ? 1.1613 1.1345 1.1729 -0.1538 -0.0992 0.0777 23 CYS E CB 8326 S SG . CYS F 23 ? 1.0777 0.9805 1.0045 -0.1452 -0.0668 0.0422 23 CYS E SG 8327 N N . ARG F 24 ? 1.2657 1.1317 1.2784 -0.2393 -0.1843 0.0766 24 ARG E N 8328 C CA . ARG F 24 ? 1.3209 1.1611 1.3703 -0.2588 -0.1977 0.0836 24 ARG E CA 8329 C C . ARG F 24 ? 1.4101 1.1675 1.3805 -0.2576 -0.1823 0.0442 24 ARG E C 8330 O O . ARG F 24 ? 1.4882 1.1776 1.3636 -0.2695 -0.1970 0.0113 24 ARG E O 8331 C CB . ARG F 24 ? 1.3824 1.2088 1.4603 -0.3005 -0.2603 0.1025 24 ARG E CB 8332 C CG . ARG F 24 ? 1.3206 1.2296 1.4873 -0.3009 -0.2763 0.1430 24 ARG E CG 8333 C CD . ARG F 24 ? 1.4027 1.2911 1.5866 -0.3444 -0.3449 0.1610 24 ARG E CD 8334 N NE . ARG F 24 ? 1.4488 1.3364 1.7094 -0.3709 -0.3734 0.1887 24 ARG E NE 8335 C CZ . ARG F 24 ? 1.4937 1.3764 1.8026 -0.4101 -0.4357 0.2171 24 ARG E CZ 8336 N NH1 . ARG F 24 ? 1.5273 1.4046 1.8128 -0.4275 -0.4761 0.2209 24 ARG E NH1 8337 N NH2 . ARG F 24 ? 1.5018 1.3855 1.8872 -0.4340 -0.4611 0.2459 24 ARG E NH2 8338 N N . ALA F 25 ? 1.3920 1.1554 1.4021 -0.2427 -0.1514 0.0485 25 ALA E N 8339 C CA . ALA F 25 ? 1.4255 1.1162 1.3786 -0.2358 -0.1313 0.0134 25 ALA E CA 8340 C C . ALA F 25 ? 1.5035 1.1292 1.4624 -0.2671 -0.1694 0.0070 25 ALA E C 8341 O O . ALA F 25 ? 1.4782 1.1301 1.5089 -0.2918 -0.2054 0.0401 25 ALA E O 8342 C CB . ALA F 25 ? 1.3290 1.0552 1.3222 -0.2035 -0.0812 0.0225 25 ALA E CB 8343 N N . SER F 26 ? 1.5842 1.1242 1.4709 -0.2649 -0.1613 -0.0349 26 SER E N 8344 C CA . SER F 26 ? 1.6610 1.1231 1.5423 -0.2921 -0.1985 -0.0490 26 SER E CA 8345 C C . SER F 26 ? 1.6205 1.1125 1.6076 -0.2928 -0.1949 -0.0159 26 SER E C 8346 O O . SER F 26 ? 1.5864 1.1016 1.6464 -0.3204 -0.2346 0.0195 26 SER E O 8347 C CB . SER F 26 ? 1.7090 1.0711 1.4849 -0.2822 -0.1816 -0.1066 26 SER E CB 8348 O OG . SER F 26 ? 1.6306 1.0064 1.4168 -0.2445 -0.1227 -0.1159 26 SER E OG 8349 N N . GLN F 27 ? 1.6248 1.1182 1.6244 -0.2639 -0.1486 -0.0234 27 GLN E N 8350 C CA . GLN F 27 ? 1.5865 1.1104 1.6824 -0.2638 -0.1423 0.0109 27 GLN E CA 8351 C C . GLN F 27 ? 1.4805 1.1158 1.6494 -0.2499 -0.1173 0.0592 27 GLN E C 8352 O O . GLN F 27 ? 1.4335 1.1125 1.5732 -0.2293 -0.0924 0.0567 27 GLN E O 8353 C CB . GLN F 27 ? 1.6469 1.1201 1.7287 -0.2407 -0.1078 -0.0155 27 GLN E CB 8354 C CG . GLN F 27 ? 1.7910 1.1484 1.8069 -0.2505 -0.1281 -0.0659 27 GLN E CG 8355 C CD . GLN F 27 ? 1.8085 1.1201 1.8272 -0.2244 -0.0913 -0.0894 27 GLN E CD 8356 O OE1 . GLN F 27 ? 1.7213 1.0847 1.7735 -0.1973 -0.0483 -0.0726 27 GLN E OE1 8357 N NE2 . GLN F 27 ? 1.9145 1.1251 1.8999 -0.2325 -0.1104 -0.1284 27 GLN E NE2 8358 N N . GLY F 28 ? 1.4660 1.1449 1.7278 -0.2614 -0.1244 0.1032 28 GLY E N 8359 C CA . GLY F 28 ? 1.3730 1.1543 1.6996 -0.2483 -0.0982 0.1487 28 GLY E CA 8360 C C . GLY F 28 ? 1.2938 1.0985 1.6041 -0.2130 -0.0470 0.1447 28 GLY E C 8361 O O . GLY F 28 ? 1.2925 1.0610 1.6088 -0.2068 -0.0341 0.1387 28 GLY E O 8362 N N . ILE F 29 ? 1.2511 1.1138 1.5449 -0.1907 -0.0217 0.1494 29 ILE E N 8363 C CA . ILE F 29 ? 1.2495 1.1342 1.5254 -0.1588 0.0208 0.1478 29 ILE E CA 8364 C C . ILE F 29 ? 1.2348 1.2066 1.5618 -0.1481 0.0415 0.1902 29 ILE E C 8365 O O . ILE F 29 ? 1.2073 1.2040 1.5144 -0.1222 0.0719 0.1914 29 ILE E O 8366 C CB . ILE F 29 ? 1.2354 1.1035 1.4356 -0.1375 0.0349 0.1127 29 ILE E CB 8367 C CG1 . ILE F 29 ? 1.1794 1.0949 1.3772 -0.1395 0.0216 0.1199 29 ILE E CG1 8368 C CG2 . ILE F 29 ? 1.3170 1.0986 1.4556 -0.1438 0.0245 0.0693 29 ILE E CG2 8369 C CD1 . ILE F 29 ? 1.1496 1.0529 1.2788 -0.1219 0.0306 0.0914 29 ILE E CD1 8370 N N . ARG F 30 ? 1.2556 1.2713 1.6473 -0.1685 0.0244 0.2253 30 ARG E N 8371 C CA . ARG F 30 ? 1.2091 1.3110 1.6514 -0.1591 0.0474 0.2672 30 ARG E CA 8372 C C . ARG F 30 ? 1.1849 1.3287 1.5936 -0.1308 0.0691 0.2566 30 ARG E C 8373 O O . ARG F 30 ? 1.2161 1.3640 1.6164 -0.1335 0.0515 0.2440 30 ARG E O 8374 C CB . ARG F 30 ? 1.2113 1.3236 1.6711 -0.1527 0.0719 0.2907 30 ARG E CB 8375 C CG . ARG F 30 ? 1.2713 1.3481 1.7789 -0.1811 0.0486 0.3082 30 ARG E CG 8376 C CD . ARG F 30 ? 1.2640 1.3625 1.7983 -0.1779 0.0701 0.3415 30 ARG E CD 8377 N NE . ARG F 30 ? 1.2501 1.3149 1.7293 -0.1537 0.0917 0.3171 30 ARG E NE 8378 C CZ . ARG F 30 ? 1.2261 1.2937 1.7168 -0.1504 0.1057 0.3403 30 ARG E CZ 8379 N NH1 . ARG F 30 ? 1.2527 1.3561 1.8026 -0.1701 0.1024 0.3882 30 ARG E NH1 8380 N NH2 . ARG F 30 ? 1.1916 1.2277 1.6384 -0.1295 0.1209 0.3199 30 ARG E NH2 8381 N N . ASN F 31 ? 1.1448 1.3153 1.5341 -0.1052 0.1031 0.2626 31 ASN E N 8382 C CA . ASN F 31 ? 1.0977 1.3052 1.4576 -0.0767 0.1225 0.2537 31 ASN E CA 8383 C C . ASN F 31 ? 1.0975 1.2603 1.3869 -0.0559 0.1311 0.2202 31 ASN E C 8384 O O . ASN F 31 ? 1.1155 1.2992 1.3789 -0.0310 0.1526 0.2204 31 ASN E O 8385 C CB . ASN F 31 ? 1.0832 1.3582 1.4703 -0.0619 0.1538 0.2873 31 ASN E CB 8386 C CG . ASN F 31 ? 1.0905 1.4117 1.4683 -0.0356 0.1691 0.2816 31 ASN E CG 8387 O OD1 . ASN F 31 ? 1.1064 1.4326 1.4958 -0.0377 0.1507 0.2697 31 ASN E OD1 8388 N ND2 . ASN F 31 ? 1.0929 1.4439 1.4477 -0.0111 0.2004 0.2900 31 ASN E ND2 8389 N N . ASP F 32 ? 1.0912 1.1910 1.3491 -0.0659 0.1143 0.1919 32 ASP E N 8390 C CA . ASP F 32 ? 1.0946 1.1535 1.2959 -0.0476 0.1249 0.1651 32 ASP E CA 8391 C C . ASP F 32 ? 1.0712 1.1029 1.2272 -0.0467 0.1104 0.1342 32 ASP E C 8392 O O . ASP F 32 ? 1.0778 1.0536 1.2019 -0.0552 0.1031 0.1100 32 ASP E O 8393 C CB . ASP F 32 ? 1.1559 1.1621 1.3575 -0.0547 0.1283 0.1600 32 ASP E CB 8394 C CG . ASP F 32 ? 1.1782 1.2084 1.4209 -0.0567 0.1404 0.1941 32 ASP E CG 8395 O OD1 . ASP F 32 ? 1.2287 1.2310 1.5037 -0.0747 0.1316 0.2024 32 ASP E OD1 8396 O OD2 . ASP F 32 ? 1.1523 1.2263 1.3921 -0.0410 0.1572 0.2125 32 ASP E OD2 8397 N N . LEU F 33 ? 1.0297 1.1000 1.1817 -0.0359 0.1070 0.1354 33 LEU E N 8398 C CA . LEU F 33 ? 0.9434 0.9937 1.0532 -0.0356 0.0915 0.1119 33 LEU E CA 8399 C C . LEU F 33 ? 0.8659 0.9411 0.9554 -0.0085 0.1019 0.1098 33 LEU E C 8400 O O . LEU F 33 ? 0.8176 0.9374 0.9325 0.0073 0.1132 0.1260 33 LEU E O 8401 C CB . LEU F 33 ? 0.9092 0.9737 1.0419 -0.0574 0.0614 0.1163 33 LEU E CB 8402 C CG . LEU F 33 ? 0.9099 0.9425 0.9915 -0.0658 0.0387 0.0933 33 LEU E CG 8403 C CD1 . LEU F 33 ? 0.9017 0.8681 0.9442 -0.0901 0.0234 0.0725 33 LEU E CD1 8404 C CD2 . LEU F 33 ? 0.8576 0.9301 0.9706 -0.0733 0.0128 0.1061 33 LEU E CD2 8405 N N . GLY F 34 ? 0.8743 0.9188 0.9164 -0.0032 0.0981 0.0900 34 GLY E N 8406 C CA . GLY F 34 ? 0.8445 0.9062 0.8691 0.0194 0.1006 0.0888 34 GLY E CA 8407 C C . GLY F 34 ? 0.8128 0.8754 0.8185 0.0127 0.0762 0.0796 34 GLY E C 8408 O O . GLY F 34 ? 0.8180 0.8502 0.7979 -0.0084 0.0617 0.0678 34 GLY E O 8409 N N . TRP F 35 ? 0.7805 0.8744 0.7962 0.0300 0.0695 0.0850 35 TRP E N 8410 C CA . TRP F 35 ? 0.8176 0.9150 0.8218 0.0243 0.0429 0.0809 35 TRP E CA 8411 C C . TRP F 35 ? 0.7623 0.8520 0.7386 0.0430 0.0426 0.0777 35 TRP E C 8412 O O . TRP F 35 ? 0.7364 0.8385 0.7221 0.0665 0.0537 0.0824 35 TRP E O 8413 C CB . TRP F 35 ? 0.8108 0.9538 0.8678 0.0261 0.0273 0.0929 35 TRP E CB 8414 C CG . TRP F 35 ? 0.8434 0.9946 0.9340 0.0006 0.0152 0.1012 35 TRP E CG 8415 C CD1 . TRP F 35 ? 0.8616 1.0417 1.0016 -0.0001 0.0291 0.1161 35 TRP E CD1 8416 C CD2 . TRP F 35 ? 0.9236 1.0523 1.0004 -0.0303 -0.0168 0.0983 35 TRP E CD2 8417 N NE1 . TRP F 35 ? 0.9060 1.0842 1.0727 -0.0296 0.0056 0.1244 35 TRP E NE1 8418 C CE2 . TRP F 35 ? 0.9526 1.0958 1.0775 -0.0490 -0.0247 0.1120 35 TRP E CE2 8419 C CE3 . TRP F 35 ? 0.9553 1.0521 0.9807 -0.0457 -0.0412 0.0875 35 TRP E CE3 8420 C CZ2 . TRP F 35 ? 0.9996 1.1210 1.1223 -0.0831 -0.0607 0.1138 35 TRP E CZ2 8421 C CZ3 . TRP F 35 ? 1.0098 1.0846 1.0238 -0.0793 -0.0739 0.0876 35 TRP E CZ3 8422 C CH2 . TRP F 35 ? 1.0339 1.1183 1.0961 -0.0979 -0.0857 0.0999 35 TRP E CH2 8423 N N . TYR F 36 ? 0.7585 0.8262 0.6980 0.0310 0.0280 0.0716 36 TYR E N 8424 C CA . TYR F 36 ? 0.8316 0.8925 0.7489 0.0447 0.0259 0.0738 36 TYR E CA 8425 C C . TYR F 36 ? 0.9374 1.0085 0.8499 0.0363 -0.0068 0.0786 36 TYR E C 8426 O O . TYR F 36 ? 0.9359 1.0084 0.8466 0.0143 -0.0274 0.0780 36 TYR E O 8427 C CB . TYR F 36 ? 0.8688 0.8937 0.7457 0.0408 0.0474 0.0673 36 TYR E CB 8428 C CG . TYR F 36 ? 0.8696 0.8819 0.7581 0.0498 0.0765 0.0660 36 TYR E CG 8429 C CD1 . TYR F 36 ? 0.8886 0.8847 0.7788 0.0354 0.0869 0.0573 36 TYR E CD1 8430 C CD2 . TYR F 36 ? 0.8023 0.8158 0.7025 0.0706 0.0884 0.0758 36 TYR E CD2 8431 C CE1 . TYR F 36 ? 0.8726 0.8570 0.7794 0.0420 0.1099 0.0595 36 TYR E CE1 8432 C CE2 . TYR F 36 ? 0.8008 0.8023 0.7145 0.0762 0.1106 0.0788 36 TYR E CE2 8433 C CZ . TYR F 36 ? 0.8499 0.8383 0.7686 0.0622 0.1221 0.0710 36 TYR E CZ 8434 O OH . TYR F 36 ? 0.9062 0.8824 0.8440 0.0662 0.1409 0.0771 36 TYR E OH 8435 N N . GLN F 37 ? 1.0100 1.0859 0.9227 0.0519 -0.0157 0.0864 37 GLN E N 8436 C CA . GLN F 37 ? 1.0159 1.0999 0.9263 0.0440 -0.0489 0.0953 37 GLN E CA 8437 C C . GLN F 37 ? 1.0120 1.0784 0.8866 0.0431 -0.0451 0.1029 37 GLN E C 8438 O O . GLN F 37 ? 1.0119 1.0720 0.8906 0.0614 -0.0288 0.1070 37 GLN E O 8439 C CB . GLN F 37 ? 1.0451 1.1556 1.0038 0.0647 -0.0702 0.1012 37 GLN E CB 8440 C CG . GLN F 37 ? 1.1058 1.2245 1.0740 0.0574 -0.1097 0.1134 37 GLN E CG 8441 C CD . GLN F 37 ? 1.0785 1.2144 1.0944 0.0839 -0.1289 0.1157 37 GLN E CD 8442 O OE1 . GLN F 37 ? 1.0717 1.1998 1.0886 0.1086 -0.1171 0.1115 37 GLN E OE1 8443 N NE2 . GLN F 37 ? 1.0788 1.2343 1.1345 0.0789 -0.1605 0.1219 37 GLN E NE2 8444 N N . GLN F 38 ? 0.9970 1.0562 0.8371 0.0206 -0.0607 0.1080 38 GLN E N 8445 C CA . GLN F 38 ? 0.9584 1.0077 0.7666 0.0187 -0.0541 0.1201 38 GLN E CA 8446 C C . GLN F 38 ? 0.9441 1.0052 0.7452 0.0026 -0.0922 0.1382 38 GLN E C 8447 O O . GLN F 38 ? 0.9707 1.0282 0.7457 -0.0225 -0.1115 0.1366 38 GLN E O 8448 C CB . GLN F 38 ? 0.9563 0.9774 0.7097 0.0070 -0.0187 0.1077 38 GLN E CB 8449 C CG . GLN F 38 ? 0.8977 0.9141 0.6268 0.0105 0.0006 0.1220 38 GLN E CG 8450 C CD . GLN F 38 ? 0.9234 0.9102 0.6001 0.0043 0.0423 0.1058 38 GLN E CD 8451 O OE1 . GLN F 38 ? 0.9696 0.9331 0.6052 -0.0128 0.0445 0.0845 38 GLN E OE1 8452 N NE2 . GLN F 38 ? 0.8925 0.8778 0.5737 0.0188 0.0745 0.1162 38 GLN E NE2 8453 N N . LYS F 39 ? 1.0574 0.6186 0.8644 0.1191 0.0929 0.0582 39 LYS E N 8454 C CA . LYS F 39 ? 1.0626 0.6014 0.8899 0.1203 0.0805 0.0838 39 LYS E CA 8455 C C . LYS F 39 ? 1.0920 0.6543 0.9107 0.0920 0.0619 0.1052 39 LYS E C 8456 O O . LYS F 39 ? 1.0798 0.6512 0.8718 0.0734 0.0608 0.0959 39 LYS E O 8457 C CB . LYS F 39 ? 1.0960 0.5495 0.9135 0.1312 0.0852 0.0698 39 LYS E CB 8458 C CG . LYS F 39 ? 1.1184 0.5519 0.9418 0.1703 0.1106 0.0510 39 LYS E CG 8459 C CD . LYS F 39 ? 1.2753 0.6073 1.0805 0.1875 0.1181 0.0327 39 LYS E CD 8460 C CE . LYS F 39 ? 1.3271 0.6463 1.1375 0.2381 0.1509 0.0173 39 LYS E CE 8461 N NZ . LYS F 39 ? 1.4149 0.6186 1.2007 0.2631 0.1629 -0.0058 39 LYS E NZ 8462 N N . PRO F 40 ? 1.1455 0.7296 0.9900 0.0911 0.0491 0.1406 40 PRO E N 8463 C CA . PRO F 40 ? 1.1483 0.7706 0.9870 0.0689 0.0342 0.1690 40 PRO E CA 8464 C C . PRO F 40 ? 1.2106 0.7957 1.0342 0.0440 0.0246 0.1729 40 PRO E C 8465 O O . PRO F 40 ? 1.3318 0.8578 1.1690 0.0365 0.0137 0.1842 40 PRO E O 8466 C CB . PRO F 40 ? 1.1658 0.8085 1.0420 0.0750 0.0225 0.2110 40 PRO E CB 8467 C CG . PRO F 40 ? 1.1578 0.8077 1.0569 0.1002 0.0322 0.2044 40 PRO E CG 8468 C CD . PRO F 40 ? 1.1693 0.7612 1.0544 0.1136 0.0499 0.1635 40 PRO E CD 8469 N N . GLY F 41 ? 1.1390 0.7575 0.9372 0.0302 0.0277 0.1667 41 GLY E N 8470 C CA . GLY F 41 ? 1.1289 0.7367 0.9175 0.0004 0.0147 0.1816 41 GLY E CA 8471 C C . GLY F 41 ? 1.1432 0.7190 0.9032 -0.0099 0.0198 0.1482 41 GLY E C 8472 O O . GLY F 41 ? 1.1986 0.7609 0.9478 -0.0416 0.0040 0.1588 41 GLY E O 8473 N N . LYS F 42 ? 1.0874 0.6590 0.8365 0.0129 0.0393 0.1129 42 LYS E N 8474 C CA . LYS F 42 ? 1.0865 0.6411 0.8080 0.0057 0.0461 0.0845 42 LYS E CA 8475 C C . LYS F 42 ? 1.0572 0.6612 0.7775 0.0233 0.0668 0.0728 42 LYS E C 8476 O O . LYS F 42 ? 1.0140 0.6474 0.7494 0.0415 0.0754 0.0765 42 LYS E O 8477 C CB . LYS F 42 ? 1.1272 0.6053 0.8334 0.0160 0.0495 0.0506 42 LYS E CB 8478 C CG . LYS F 42 ? 1.2498 0.6518 0.9413 -0.0096 0.0276 0.0509 42 LYS E CG 8479 C CD . LYS F 42 ? 1.3421 0.6590 0.9999 0.0059 0.0375 0.0057 42 LYS E CD 8480 C CE . LYS F 42 ? 1.4428 0.6633 1.0718 -0.0265 0.0126 -0.0034 42 LYS E CE 8481 N NZ . LYS F 42 ? 1.5227 0.6492 1.1023 -0.0070 0.0263 -0.0572 42 LYS E NZ 8482 N N . ALA F 43 ? 1.0747 0.6859 0.7756 0.0141 0.0723 0.0604 43 ALA E N 8483 C CA . ALA F 43 ? 1.0290 0.6803 0.7345 0.0294 0.0918 0.0539 43 ALA E CA 8484 C C . ALA F 43 ? 1.0951 0.7268 0.8059 0.0524 0.1050 0.0280 43 ALA E C 8485 O O . ALA F 43 ? 1.1450 0.7323 0.8435 0.0574 0.1038 0.0098 43 ALA E O 8486 C CB . ALA F 43 ? 0.9702 0.6515 0.6603 0.0104 0.0920 0.0617 43 ALA E CB 8487 N N . PRO F 44 ? 1.0983 0.7614 0.8284 0.0674 0.1184 0.0287 44 PRO E N 8488 C CA . PRO F 44 ? 1.0741 0.7384 0.8194 0.0864 0.1301 0.0160 44 PRO E CA 8489 C C . PRO F 44 ? 1.0611 0.7208 0.7859 0.0901 0.1403 0.0001 44 PRO E C 8490 O O . PRO F 44 ? 1.0628 0.7408 0.7683 0.0751 0.1408 0.0022 44 PRO E O 8491 C CB . PRO F 44 ? 1.0326 0.7304 0.7992 0.0889 0.1374 0.0251 44 PRO E CB 8492 C CG . PRO F 44 ? 1.0429 0.7421 0.8024 0.0817 0.1305 0.0353 44 PRO E CG 8493 C CD . PRO F 44 ? 1.0734 0.7685 0.8128 0.0681 0.1229 0.0437 44 PRO E CD 8494 N N . LYS F 45 ? 1.0671 0.7093 0.7945 0.1120 0.1499 -0.0129 45 LYS E N 8495 C CA . LYS F 45 ? 1.0368 0.6767 0.7357 0.1236 0.1650 -0.0323 45 LYS E CA 8496 C C . LYS F 45 ? 0.9989 0.6949 0.7299 0.1449 0.1841 -0.0209 45 LYS E C 8497 O O . LYS F 45 ? 0.9818 0.6927 0.7527 0.1614 0.1874 -0.0071 45 LYS E O 8498 C CB . LYS F 45 ? 1.0609 0.6335 0.7320 0.1406 0.1680 -0.0565 45 LYS E CB 8499 C CG . LYS F 45 ? 1.1571 0.7211 0.7866 0.1618 0.1892 -0.0842 45 LYS E CG 8500 C CD . LYS F 45 ? 1.3043 0.7908 0.9108 0.1925 0.2002 -0.1094 45 LYS E CD 8501 C CE . LYS F 45 ? 1.3958 0.7918 0.9616 0.1639 0.1761 -0.1289 45 LYS E CE 8502 N NZ . LYS F 45 ? 1.4628 0.7647 1.0058 0.1967 0.1886 -0.1549 45 LYS E NZ 8503 N N . LEU F 46 ? 0.9983 0.7346 0.7155 0.1412 0.1945 -0.0197 46 LEU E N 8504 C CA . LEU F 46 ? 0.9811 0.7808 0.7333 0.1579 0.2119 -0.0002 46 LEU E CA 8505 C C . LEU F 46 ? 1.0413 0.8447 0.7904 0.1953 0.2331 -0.0094 46 LEU E C 8506 O O . LEU F 46 ? 1.1218 0.8869 0.8162 0.2097 0.2433 -0.0406 46 LEU E O 8507 C CB . LEU F 46 ? 0.9479 0.7983 0.6868 0.1453 0.2184 0.0099 46 LEU E CB 8508 C CG . LEU F 46 ? 0.9038 0.8301 0.6835 0.1594 0.2359 0.0391 46 LEU E CG 8509 C CD1 . LEU F 46 ? 0.7824 0.7217 0.6296 0.1525 0.2271 0.0690 46 LEU E CD1 8510 C CD2 . LEU F 46 ? 0.9315 0.9132 0.6981 0.1458 0.2412 0.0550 46 LEU E CD2 8511 N N . LEU F 47 ? 1.0292 0.8779 0.8357 0.2110 0.2397 0.0190 47 LEU E N 8512 C CA . LEU F 47 ? 1.0606 0.9331 0.8786 0.2533 0.2643 0.0237 47 LEU E CA 8513 C C . LEU F 47 ? 1.0749 1.0416 0.9266 0.2656 0.2832 0.0559 47 LEU E C 8514 O O . LEU F 47 ? 1.1565 1.1505 0.9768 0.2970 0.3110 0.0467 47 LEU E O 8515 C CB . LEU F 47 ? 1.0354 0.9025 0.9024 0.2634 0.2561 0.0437 47 LEU E CB 8516 C CG . LEU F 47 ? 1.0709 0.8582 0.9172 0.2553 0.2385 0.0239 47 LEU E CG 8517 C CD1 . LEU F 47 ? 1.0749 0.8802 0.9748 0.2712 0.2345 0.0535 47 LEU E CD1 8518 C CD2 . LEU F 47 ? 1.1387 0.8505 0.9190 0.2729 0.2508 -0.0172 47 LEU E CD2 8519 N N . ILE F 48 ? 1.0542 1.0684 0.9672 0.2401 0.2677 0.0941 48 ILE E N 8520 C CA . ILE F 48 ? 1.0636 1.1719 1.0249 0.2444 0.2800 0.1370 48 ILE E CA 8521 C C . ILE F 48 ? 1.0338 1.1581 1.0159 0.2060 0.2643 0.1562 48 ILE E C 8522 O O . ILE F 48 ? 0.9985 1.0841 1.0024 0.1753 0.2393 0.1593 48 ILE E O 8523 C CB . ILE F 48 ? 1.0254 1.1871 1.0610 0.2502 0.2756 0.1808 48 ILE E CB 8524 C CG1 . ILE F 48 ? 1.0648 1.2245 1.0922 0.2983 0.2981 0.1739 48 ILE E CG1 8525 C CG2 . ILE F 48 ? 1.0327 1.2970 1.1279 0.2460 0.2831 0.2350 48 ILE E CG2 8526 C CD1 . ILE F 48 ? 1.1373 1.3362 1.1296 0.3479 0.3400 0.1663 48 ILE E CD1 8527 N N . TYR F 49 ? 1.0532 1.2344 1.0258 0.2109 0.2810 0.1699 49 TYR E N 8528 C CA . TYR F 49 ? 1.0126 1.2230 1.0208 0.1809 0.2710 0.2024 49 TYR E CA 8529 C C . TYR F 49 ? 1.0251 1.3374 1.0993 0.1859 0.2821 0.2602 49 TYR E C 8530 O O . TYR F 49 ? 1.0811 1.4520 1.1614 0.2177 0.3028 0.2721 49 TYR E O 8531 C CB . TYR F 49 ? 0.9574 1.1640 0.9105 0.1744 0.2764 0.1847 49 TYR E CB 8532 C CG . TYR F 49 ? 0.9686 1.2437 0.8797 0.1990 0.3024 0.1831 49 TYR E CG 8533 C CD1 . TYR F 49 ? 1.0309 1.2703 0.8665 0.2249 0.3159 0.1340 49 TYR E CD1 8534 C CD2 . TYR F 49 ? 0.9508 1.3227 0.8935 0.1966 0.3138 0.2304 49 TYR E CD2 8535 C CE1 . TYR F 49 ? 1.0899 1.3833 0.8711 0.2491 0.3412 0.1238 49 TYR E CE1 8536 C CE2 . TYR F 49 ? 0.9985 1.4420 0.8931 0.2199 0.3388 0.2279 49 TYR E CE2 8537 C CZ . TYR F 49 ? 1.0750 1.4763 0.8829 0.2468 0.3529 0.1703 49 TYR E CZ 8538 O OH . TYR F 49 ? 1.1589 1.6230 0.9034 0.2719 0.3792 0.1593 49 TYR E OH 8539 N N . ALA F 50 ? 0.9803 1.3136 1.1074 0.1566 0.2698 0.3004 50 ALA E N 8540 C CA . ALA F 50 ? 0.9388 1.3672 1.1428 0.1511 0.2735 0.3665 50 ALA E CA 8541 C C . ALA F 50 ? 0.9629 1.4166 1.2199 0.1510 0.2641 0.3907 50 ALA E C 8542 O O . ALA F 50 ? 0.9914 1.5471 1.3060 0.1584 0.2740 0.4467 50 ALA E O 8543 C CB . ALA F 50 ? 0.9304 1.4623 1.1149 0.1804 0.3054 0.3870 50 ALA E CB 8544 N N . ALA F 51 ? 0.9388 1.3110 1.1780 0.1422 0.2446 0.3544 51 ALA E N 8545 C CA . ALA F 51 ? 0.8922 1.2850 1.1789 0.1354 0.2290 0.3771 51 ALA E CA 8546 C C . ALA F 51 ? 0.8989 1.3818 1.1965 0.1825 0.2589 0.3988 51 ALA E C 8547 O O . ALA F 51 ? 0.9316 1.4551 1.2786 0.1815 0.2491 0.4305 51 ALA E O 8548 C CB . ALA F 51 ? 0.8688 1.2879 1.2363 0.0882 0.1996 0.4320 51 ALA E CB 8549 N N . SER F 52 ? 0.9118 1.4275 1.1605 0.2249 0.2957 0.3825 52 SER E N 8550 C CA . SER F 52 ? 0.9338 1.5294 1.1826 0.2803 0.3326 0.3985 52 SER E CA 8551 C C . SER F 52 ? 0.9666 1.5330 1.1179 0.3260 0.3683 0.3422 52 SER E C 8552 O O . SER F 52 ? 1.0044 1.5795 1.1267 0.3787 0.3993 0.3265 52 SER E O 8553 C CB . SER F 52 ? 0.8815 1.6193 1.2095 0.2828 0.3443 0.4792 52 SER E CB 8554 O OG . SER F 52 ? 0.8238 1.5910 1.2432 0.2387 0.3087 0.5345 52 SER E OG 8555 N N . SER F 53 ? 0.9538 1.4838 1.0537 0.3053 0.3634 0.3132 53 SER E N 8556 C CA . SER F 53 ? 1.0340 1.5422 1.0354 0.3360 0.3901 0.2615 53 SER E CA 8557 C C . SER F 53 ? 1.1077 1.4932 1.0379 0.3490 0.3872 0.1923 53 SER E C 8558 O O . SER F 53 ? 1.1204 1.4215 1.0507 0.3146 0.3562 0.1713 53 SER E O 8559 C CB . SER F 53 ? 1.0151 1.5309 0.9897 0.3023 0.3796 0.2601 53 SER E CB 8560 O OG . SER F 53 ? 0.9876 1.6191 1.0300 0.2928 0.3845 0.3293 53 SER E OG 8561 N N . LEU F 54 ? 1.1930 1.5679 1.0615 0.4010 0.4213 0.1586 54 LEU E N 8562 C CA . LEU F 54 ? 1.2578 1.5093 1.0573 0.4163 0.4210 0.0946 54 LEU E CA 8563 C C . LEU F 54 ? 1.3130 1.4925 1.0220 0.3852 0.4059 0.0406 54 LEU E C 8564 O O . LEU F 54 ? 1.4016 1.6237 1.0539 0.3905 0.4217 0.0288 54 LEU E O 8565 C CB . LEU F 54 ? 1.3551 1.6074 1.1224 0.4840 0.4620 0.0779 54 LEU E CB 8566 C CG . LEU F 54 ? 1.4257 1.5584 1.1599 0.5100 0.4646 0.0337 54 LEU E CG 8567 C CD1 . LEU F 54 ? 1.5372 1.5534 1.1574 0.5006 0.4593 -0.0440 54 LEU E CD1 8568 C CD2 . LEU F 54 ? 1.3287 1.4229 1.1272 0.4765 0.4307 0.0542 54 LEU E CD2 8569 N N . GLN F 55 ? 1.2909 1.3729 0.9879 0.3507 0.3741 0.0134 55 GLN E N 8570 C CA . GLN F 55 ? 1.3439 1.3690 0.9699 0.3126 0.3532 -0.0251 55 GLN E CA 8571 C C . GLN F 55 ? 1.4822 1.4324 1.0013 0.3356 0.3688 -0.0886 55 GLN E C 8572 O O . GLN F 55 ? 1.5623 1.4563 1.0659 0.3785 0.3889 -0.1120 55 GLN E O 8573 C CB . GLN F 55 ? 1.3211 1.2760 0.9722 0.2719 0.3168 -0.0270 55 GLN E CB 8574 C CG . GLN F 55 ? 1.3243 1.2871 0.9616 0.2236 0.2923 -0.0218 55 GLN E CG 8575 C CD . GLN F 55 ? 1.4352 1.3396 0.9794 0.2050 0.2824 -0.0684 55 GLN E CD 8576 O OE1 . GLN F 55 ? 1.5976 1.4155 1.0912 0.2182 0.2835 -0.1114 55 GLN E OE1 8577 N NE2 . GLN F 55 ? 1.3737 1.3245 0.8975 0.1716 0.2706 -0.0565 55 GLN E NE2 8578 N N . SER F 56 ? 1.5189 1.4663 0.9637 0.3059 0.3585 -0.1150 56 SER E N 8579 C CA . SER F 56 ? 1.6503 1.5218 0.9778 0.3182 0.3683 -0.1814 56 SER E CA 8580 C C . SER F 56 ? 1.6691 1.3957 0.9646 0.3070 0.3477 -0.2251 56 SER E C 8581 O O . SER F 56 ? 1.6033 1.2894 0.8988 0.2538 0.3096 -0.2256 56 SER E O 8582 C CB . SER F 56 ? 1.7107 1.6235 0.9688 0.2750 0.3523 -0.1926 56 SER E CB 8583 O OG . SER F 56 ? 1.6824 1.7353 0.9751 0.2850 0.3712 -0.1447 56 SER E OG 8584 N N . GLY F 57 ? 1.7428 1.3971 1.0171 0.3601 0.3750 -0.2549 57 GLY E N 8585 C CA . GLY F 57 ? 1.8032 1.3141 1.0490 0.3546 0.3587 -0.2932 57 GLY E CA 8586 C C . GLY F 57 ? 1.7449 1.2350 1.0767 0.3930 0.3696 -0.2639 57 GLY E C 8587 O O . GLY F 57 ? 1.8537 1.2587 1.1787 0.4151 0.3725 -0.2888 57 GLY E O 8588 N N . VAL F 58 ? 1.5949 1.1780 1.0261 0.3882 0.3647 -0.2033 58 VAL E N 8589 C CA . VAL F 58 ? 1.5278 1.1077 1.0418 0.4154 0.3689 -0.1681 58 VAL E CA 8590 C C . VAL F 58 ? 1.6031 1.2170 1.1378 0.4844 0.4114 -0.1577 58 VAL E C 8591 O O . VAL F 58 ? 1.6371 1.3293 1.1583 0.5033 0.4333 -0.1543 58 VAL E O 8592 C CB . VAL F 58 ? 1.4107 1.0856 1.0199 0.3822 0.3458 -0.1086 58 VAL E CB 8593 C CG1 . VAL F 58 ? 1.3824 1.0279 0.9817 0.3180 0.3041 -0.1134 58 VAL E CG1 8594 C CG2 . VAL F 58 ? 1.3885 1.1877 1.0298 0.3914 0.3639 -0.0739 58 VAL E CG2 8595 N N . PRO F 59 ? 1.6139 1.1838 1.1938 0.5125 0.4148 -0.1439 59 PRO E N 8596 C CA . PRO F 59 ? 1.5326 1.1433 1.1500 0.5704 0.4470 -0.1221 59 PRO E CA 8597 C C . PRO F 59 ? 1.5722 1.3352 1.2568 0.5912 0.4672 -0.0623 59 PRO E C 8598 O O . PRO F 59 ? 1.4436 1.2774 1.1764 0.5628 0.4532 -0.0253 59 PRO E O 8599 C CB . PRO F 59 ? 1.5474 1.1074 1.2231 0.5825 0.4382 -0.0969 59 PRO E CB 8600 C CG . PRO F 59 ? 1.5796 1.0236 1.2093 0.5357 0.4040 -0.1353 59 PRO E CG 8601 C CD . PRO F 59 ? 1.5529 1.0288 1.1465 0.4896 0.3874 -0.1466 59 PRO E CD 8602 N N . SER F 60 ? 1.6811 1.4928 1.3706 0.6397 0.4994 -0.0507 60 SER E N 8603 C CA . SER F 60 ? 1.6295 1.5910 1.3818 0.6574 0.5168 0.0115 60 SER E CA 8604 C C . SER F 60 ? 1.5475 1.5832 1.4089 0.6717 0.5158 0.0861 60 SER E C 8605 O O . SER F 60 ? 1.4826 1.6485 1.4119 0.6759 0.5218 0.1495 60 SER E O 8606 C CB . SER F 60 ? 1.7478 1.7391 1.4577 0.7043 0.5524 -0.0019 60 SER E CB 8607 O OG . SER F 60 ? 1.8346 1.7673 1.4420 0.6874 0.5518 -0.0707 60 SER E OG 8608 N N . ARG F 61 ? 1.5365 1.4960 1.4182 0.6746 0.5047 0.0839 61 ARG E N 8609 C CA . ARG F 61 ? 1.4334 1.4676 1.4182 0.6824 0.4990 0.1566 61 ARG E CA 8610 C C . ARG F 61 ? 1.2945 1.4025 1.3403 0.6334 0.4692 0.1940 61 ARG E C 8611 O O . ARG F 61 ? 1.2154 1.4355 1.3543 0.6294 0.4619 0.2649 61 ARG E O 8612 C CB . ARG F 61 ? 1.4421 1.3792 1.4337 0.6951 0.4926 0.1476 61 ARG E CB 8613 C CG . ARG F 61 ? 1.3784 1.1885 1.3163 0.6550 0.4632 0.0924 61 ARG E CG 8614 C CD . ARG F 61 ? 1.4270 1.1564 1.3859 0.6668 0.4554 0.0973 61 ARG E CD 8615 N NE . ARG F 61 ? 1.4888 1.1001 1.3991 0.6252 0.4246 0.0519 61 ARG E NE 8616 C CZ . ARG F 61 ? 1.5944 1.0823 1.4257 0.6204 0.4229 -0.0115 61 ARG E CZ 8617 N NH1 . ARG F 61 ? 1.7042 1.1632 1.4910 0.6586 0.4523 -0.0440 61 ARG E NH1 8618 N NH2 . ARG F 61 ? 1.5342 0.9298 1.3317 0.5756 0.3904 -0.0402 61 ARG E NH2 8619 N N . PHE F 62 ? 1.2448 1.2904 1.2375 0.5900 0.4479 0.1477 62 PHE E N 8620 C CA . PHE F 62 ? 1.1437 1.2381 1.1748 0.5161 0.4017 0.1715 62 PHE E CA 8621 C C . PHE F 62 ? 1.1249 1.3308 1.1810 0.5088 0.4113 0.2036 62 PHE E C 8622 O O . PHE F 62 ? 1.1970 1.4070 1.1969 0.5340 0.4407 0.1764 62 PHE E O 8623 C CB . PHE F 62 ? 1.1467 1.1375 1.1117 0.4634 0.3690 0.1161 62 PHE E CB 8624 C CG . PHE F 62 ? 1.1790 1.0776 1.1358 0.4541 0.3485 0.0993 62 PHE E CG 8625 C CD1 . PHE F 62 ? 1.0838 0.9993 1.0879 0.4099 0.3098 0.1274 62 PHE E CD1 8626 C CD2 . PHE F 62 ? 1.2972 1.0900 1.1958 0.4878 0.3669 0.0556 62 PHE E CD2 8627 C CE1 . PHE F 62 ? 1.0960 0.9416 1.0949 0.4018 0.2916 0.1192 62 PHE E CE1 8628 C CE2 . PHE F 62 ? 1.3165 1.0290 1.2163 0.4768 0.3465 0.0492 62 PHE E CE2 8629 C CZ . PHE F 62 ? 1.2125 0.9600 1.1653 0.4348 0.3096 0.0845 62 PHE E CZ 8630 N N . SER F 63 ? 1.0499 1.3462 1.1883 0.4706 0.3842 0.2627 63 SER E N 8631 C CA . SER F 63 ? 1.0252 1.4278 1.2020 0.4544 0.3867 0.3040 63 SER E CA 8632 C C . SER F 63 ? 0.9480 1.3947 1.1967 0.3865 0.3384 0.3493 63 SER E C 8633 O O . SER F 63 ? 0.8960 1.3847 1.2077 0.3769 0.3200 0.3925 63 SER E O 8634 C CB . SER F 63 ? 1.0716 1.5881 1.2891 0.5194 0.4333 0.3535 63 SER E CB 8635 O OG . SER F 63 ? 1.0623 1.6892 1.3185 0.5030 0.4362 0.3992 63 SER E OG 8636 N N . GLY F 64 ? 0.9541 1.3886 1.1908 0.3391 0.3174 0.3395 64 GLY E N 8637 C CA . GLY F 64 ? 0.9471 1.4038 1.2411 0.2747 0.2734 0.3746 64 GLY E CA 8638 C C . GLY F 64 ? 0.9603 1.5441 1.3325 0.2679 0.2774 0.4474 64 GLY E C 8639 O O . GLY F 64 ? 0.9713 1.6119 1.3356 0.2974 0.3099 0.4586 64 GLY E O 8640 N N . SER F 65 ? 0.9776 1.6117 1.4245 0.2253 0.2418 0.5002 65 SER E N 8641 C CA . SER F 65 ? 1.0049 1.7676 1.5397 0.2098 0.2384 0.5816 65 SER E CA 8642 C C . SER F 65 ? 1.0263 1.7676 1.6038 0.1267 0.1831 0.6042 65 SER E C 8643 O O . SER F 65 ? 1.0390 1.6739 1.5786 0.0865 0.1488 0.5583 65 SER E O 8644 C CB . SER F 65 ? 0.9899 1.8672 1.5919 0.2440 0.2521 0.6453 65 SER E CB 8645 O OG . SER F 65 ? 0.9498 1.9669 1.6448 0.2266 0.2473 0.7344 65 SER E OG 8646 N N . GLY F 66 ? 1.0577 1.8982 1.7121 0.1020 0.1755 0.6758 66 GLY E N 8647 C CA . GLY F 66 ? 1.0796 1.8945 1.7799 0.0208 0.1220 0.7025 66 GLY E CA 8648 C C . GLY F 66 ? 1.1077 1.8434 1.7782 -0.0005 0.1204 0.6731 66 GLY E C 8649 O O . GLY F 66 ? 1.1288 1.7972 1.7246 0.0352 0.1489 0.6128 66 GLY E O 8650 N N . SER F 67 ? 1.1195 1.8646 1.8533 -0.0608 0.0854 0.7209 67 SER E N 8651 C CA . SER F 67 ? 1.0637 1.7340 1.7850 -0.0827 0.0822 0.7055 67 SER E CA 8652 C C . SER F 67 ? 1.1140 1.7087 1.8741 -0.1635 0.0255 0.7210 67 SER E C 8653 O O . SER F 67 ? 1.1519 1.7619 1.9450 -0.2077 -0.0145 0.7441 67 SER E O 8654 C CB . SER F 67 ? 0.9688 1.7570 1.7364 -0.0536 0.1175 0.7657 67 SER E CB 8655 O OG . SER F 67 ? 0.9322 1.6559 1.6931 -0.0712 0.1164 0.7578 67 SER E OG 8656 N N . GLY F 68 ? 1.1245 1.6354 1.8789 -0.1833 0.0214 0.7090 68 GLY E N 8657 C CA . GLY F 68 ? 1.1807 1.5927 1.9622 -0.2559 -0.0288 0.7153 68 GLY E CA 8658 C C . GLY F 68 ? 1.2161 1.4648 1.9079 -0.2720 -0.0496 0.6254 68 GLY E C 8659 O O . GLY F 68 ? 1.2206 1.3619 1.8605 -0.2558 -0.0341 0.5759 68 GLY E O 8660 N N . THR F 69 ? 1.2448 1.4859 1.9194 -0.3020 -0.0835 0.6095 69 THR E N 8661 C CA . THR F 69 ? 1.2827 1.3840 1.8679 -0.3191 -0.1051 0.5274 69 THR E CA 8662 C C . THR F 69 ? 1.2197 1.3686 1.7700 -0.3044 -0.1095 0.5068 69 THR E C 8663 O O . THR F 69 ? 1.2060 1.2635 1.6771 -0.3077 -0.1206 0.4410 69 THR E O 8664 C CB . THR F 69 ? 1.3835 1.3782 1.9747 -0.4000 -0.1621 0.5234 69 THR E CB 8665 O OG1 . THR F 69 ? 1.4711 1.3334 1.9615 -0.4095 -0.1777 0.4380 69 THR E OG1 8666 C CG2 . THR F 69 ? 1.3649 1.4597 2.0327 -0.4615 -0.2097 0.5940 69 THR E CG2 8667 N N . ASP F 70 ? 1.1712 1.4682 1.7831 -0.2841 -0.0979 0.5682 70 ASP E N 8668 C CA . ASP F 70 ? 1.1621 1.5170 1.7564 -0.2623 -0.0969 0.5626 70 ASP E CA 8669 C C . ASP F 70 ? 1.0725 1.4979 1.6577 -0.1780 -0.0372 0.5614 70 ASP E C 8670 O O . ASP F 70 ? 1.0292 1.5581 1.6707 -0.1480 -0.0079 0.6153 70 ASP E O 8671 C CB . ASP F 70 ? 1.2282 1.6972 1.9038 -0.3111 -0.1375 0.6397 70 ASP E CB 8672 C CG . ASP F 70 ? 1.3428 1.7349 2.0196 -0.4051 -0.2045 0.6378 70 ASP E CG 8673 O OD1 . ASP F 70 ? 1.3660 1.6831 1.9766 -0.4361 -0.2369 0.5868 70 ASP E OD1 8674 O OD2 . ASP F 70 ? 1.3996 1.8048 2.1410 -0.4498 -0.2258 0.6879 70 ASP E OD2 8675 N N . PHE F 71 ? 1.0711 1.4385 1.5820 -0.1411 -0.0198 0.5001 71 PHE E N 8676 C CA . PHE F 71 ? 1.0232 1.4261 1.5102 -0.0658 0.0330 0.4861 71 PHE E CA 8677 C C . PHE F 71 ? 1.0358 1.4547 1.5024 -0.0389 0.0360 0.4743 71 PHE E C 8678 O O . PHE F 71 ? 1.0510 1.4316 1.4982 -0.0765 -0.0009 0.4585 71 PHE E O 8679 C CB . PHE F 71 ? 0.9752 1.2794 1.3902 -0.0412 0.0584 0.4231 71 PHE E CB 8680 C CG . PHE F 71 ? 0.9575 1.2322 1.3912 -0.0680 0.0540 0.4342 71 PHE E CG 8681 C CD1 . PHE F 71 ? 0.9824 1.1498 1.3919 -0.1142 0.0226 0.4044 71 PHE E CD1 8682 C CD2 . PHE F 71 ? 0.9291 1.2830 1.4031 -0.0437 0.0833 0.4760 71 PHE E CD2 8683 C CE1 . PHE F 71 ? 0.9952 1.1273 1.4284 -0.1344 0.0209 0.4190 71 PHE E CE1 8684 C CE2 . PHE F 71 ? 0.9508 1.2838 1.4509 -0.0679 0.0792 0.4955 71 PHE E CE2 8685 C CZ . PHE F 71 ? 0.9830 1.2011 1.4668 -0.1126 0.0481 0.4685 71 PHE E CZ 8686 N N . THR F 72 ? 1.0335 1.5065 1.5015 0.0273 0.0808 0.4819 72 THR E N 8687 C CA . THR F 72 ? 1.0506 1.5392 1.5099 0.0617 0.0897 0.4793 72 THR E CA 8688 C C . THR F 72 ? 1.0527 1.5151 1.4652 0.1349 0.1419 0.4435 72 THR E C 8689 O O . THR F 72 ? 1.0554 1.5733 1.4820 0.1767 0.1799 0.4619 72 THR E O 8690 C CB . THR F 72 ? 1.0686 1.6925 1.6170 0.0619 0.0818 0.5618 72 THR E CB 8691 O OG1 . THR F 72 ? 1.1197 1.7631 1.7064 -0.0174 0.0246 0.5938 72 THR E OG1 8692 C CG2 . THR F 72 ? 1.0613 1.7018 1.6078 0.1029 0.0941 0.5658 72 THR E CG2 8693 N N . LEU F 73 ? 1.0623 1.4393 1.4155 0.1476 0.1422 0.3927 73 LEU E N 8694 C CA . LEU F 73 ? 1.0632 1.3985 1.3686 0.2092 0.1842 0.3565 73 LEU E CA 8695 C C . LEU F 73 ? 1.0730 1.4616 1.4158 0.2571 0.2039 0.3915 73 LEU E C 8696 O O . LEU F 73 ? 1.0788 1.4641 1.4360 0.2433 0.1804 0.4035 73 LEU E O 8697 C CB . LEU F 73 ? 1.0297 1.2471 1.2588 0.1971 0.1741 0.2915 73 LEU E CB 8698 C CG . LEU F 73 ? 1.0049 1.1617 1.1806 0.2478 0.2075 0.2517 73 LEU E CG 8699 C CD1 . LEU F 73 ? 0.9887 1.1594 1.1409 0.2811 0.2443 0.2394 73 LEU E CD1 8700 C CD2 . LEU F 73 ? 1.0070 1.0638 1.1204 0.2253 0.1901 0.2013 73 LEU E CD2 8701 N N . THR F 74 ? 1.0808 1.5216 1.4378 0.3169 0.2495 0.4100 74 THR E N 8702 C CA . THR F 74 ? 1.1209 1.6165 1.5195 0.3755 0.2780 0.4494 74 THR E CA 8703 C C . THR F 74 ? 1.1896 1.5984 1.5224 0.4426 0.3233 0.3973 74 THR E C 8704 O O . THR F 74 ? 1.2100 1.5832 1.4856 0.4638 0.3506 0.3561 74 THR E O 8705 C CB . THR F 74 ? 1.1331 1.7759 1.6119 0.4001 0.2993 0.5260 74 THR E CB 8706 O OG1 . THR F 74 ? 1.1173 1.8396 1.6660 0.3316 0.2498 0.5829 74 THR E OG1 8707 C CG2 . THR F 74 ? 1.1515 1.8505 1.6692 0.4791 0.3428 0.5662 74 THR E CG2 8708 N N . ILE F 75 ? 1.2508 1.6229 1.5902 0.4721 0.3284 0.4003 75 ILE E N 8709 C CA . ILE F 75 ? 1.3479 1.6301 1.6336 0.5389 0.3714 0.3576 75 ILE E CA 8710 C C . ILE F 75 ? 1.3582 1.7054 1.7086 0.6105 0.4083 0.4154 75 ILE E C 8711 O O . ILE F 75 ? 1.3057 1.7160 1.7283 0.5977 0.3859 0.4740 75 ILE E O 8712 C CB . ILE F 75 ? 1.3814 1.5303 1.6087 0.5127 0.3468 0.3030 75 ILE E CB 8713 C CG1 . ILE F 75 ? 1.4923 1.5460 1.6828 0.5795 0.3855 0.2733 75 ILE E CG1 8714 C CG2 . ILE F 75 ? 1.3145 1.4939 1.5909 0.4643 0.3005 0.3404 75 ILE E CG2 8715 C CD1 . ILE F 75 ? 1.5137 1.4377 1.6501 0.5515 0.3609 0.2250 75 ILE E CD1 8716 N N . SER F 76 ? 1.5464 1.6737 1.8666 0.6172 0.5512 0.3631 76 SER E N 8717 C CA . SER F 76 ? 1.6061 1.7734 1.9419 0.6867 0.5842 0.3854 76 SER E CA 8718 C C . SER F 76 ? 1.6451 1.7859 1.9519 0.7218 0.5545 0.3824 76 SER E C 8719 O O . SER F 76 ? 1.6474 1.8998 2.0444 0.7361 0.5337 0.3932 76 SER E O 8720 C CB . SER F 76 ? 1.7541 1.8137 1.9611 0.7289 0.6307 0.3835 76 SER E CB 8721 O OG . SER F 76 ? 1.8692 1.9576 2.0714 0.7837 0.6514 0.4020 76 SER E OG 8722 N N . SER F 77 ? 1.6717 1.6562 1.8482 0.7351 0.5518 0.3641 77 SER E N 8723 C CA . SER F 77 ? 1.6480 1.5756 1.7732 0.7647 0.5309 0.3644 77 SER E CA 8724 C C . SER F 77 ? 1.6289 1.4064 1.6641 0.7327 0.5158 0.3425 77 SER E C 8725 O O . SER F 77 ? 1.6775 1.3470 1.6340 0.7053 0.5244 0.3159 77 SER E O 8726 C CB . SER F 77 ? 1.7381 1.6136 1.7812 0.8280 0.5586 0.3710 77 SER E CB 8727 O OG . SER F 77 ? 1.6990 1.7235 1.8395 0.8575 0.5619 0.3911 77 SER E OG 8728 N N . LEU F 78 ? 1.5737 1.3474 1.6162 0.7252 0.4856 0.3488 78 LEU E N 8729 C CA . LEU F 78 ? 1.5539 1.2111 1.5337 0.6684 0.4662 0.3297 78 LEU E CA 8730 C C . LEU F 78 ? 1.6688 1.1373 1.5247 0.6890 0.4951 0.3166 78 LEU E C 8731 O O . LEU F 78 ? 1.7711 1.1965 1.5704 0.7470 0.5158 0.3284 78 LEU E O 8732 C CB . LEU F 78 ? 1.4446 1.1508 1.4607 0.6659 0.4335 0.3469 78 LEU E CB 8733 C CG . LEU F 78 ? 1.3368 1.1768 1.4552 0.6075 0.3880 0.3418 78 LEU E CG 8734 C CD1 . LEU F 78 ? 1.3322 1.2184 1.4712 0.6304 0.3541 0.3583 78 LEU E CD1 8735 C CD2 . LEU F 78 ? 1.2603 1.0412 1.3552 0.5234 0.3765 0.3133 78 LEU E CD2 8736 N N . GLN F 79 ? 1.6997 1.0704 1.5175 0.6224 0.4853 0.2835 79 GLN E N 8737 C CA . GLN F 79 ? 1.8446 1.0336 1.5709 0.6200 0.5038 0.2659 79 GLN E CA 8738 C C . GLN F 79 ? 1.8338 0.9929 1.5811 0.5540 0.4867 0.2641 79 GLN E C 8739 O O . GLN F 79 ? 1.7515 0.9961 1.5607 0.4926 0.4547 0.2517 79 GLN E O 8740 C CB . GLN F 79 ? 1.9419 1.0324 1.6101 0.6050 0.5079 0.2186 79 GLN E CB 8741 C CG . GLN F 79 ? 2.0293 1.1321 1.6533 0.6764 0.5307 0.2221 79 GLN E CG 8742 C CD . GLN F 79 ? 2.1408 1.1189 1.6769 0.6719 0.5278 0.1714 79 GLN E CD 8743 O OE1 . GLN F 79 ? 2.1900 1.0707 1.7103 0.6174 0.5078 0.1280 79 GLN E OE1 8744 N NE2 . GLN F 79 ? 2.1915 1.1782 1.6744 0.7296 0.5437 0.1741 79 GLN E NE2 8745 N N . PRO F 80 ? 1.9408 0.9731 1.6326 0.5698 0.5130 0.2793 80 PRO E N 8746 C CA . PRO F 80 ? 1.9793 0.9747 1.6871 0.5170 0.5118 0.2880 80 PRO E CA 8747 C C . PRO F 80 ? 1.9798 0.9769 1.7340 0.4214 0.4866 0.2436 80 PRO E C 8748 O O . PRO F 80 ? 1.9410 0.9449 1.7275 0.3742 0.4825 0.2511 80 PRO E O 8749 C CB . PRO F 80 ? 2.0850 0.9432 1.7179 0.5266 0.5455 0.2920 80 PRO E CB 8750 C CG . PRO F 80 ? 2.0956 0.9745 1.6777 0.6068 0.5547 0.3072 80 PRO E CG 8751 C CD . PRO F 80 ? 2.0284 0.9825 1.6402 0.6212 0.5381 0.2863 80 PRO E CD 8752 N N . GLU F 81 ? 2.0463 1.0392 1.7980 0.4022 0.4703 0.1977 81 GLU E N 8753 C CA . GLU F 81 ? 2.0096 1.0153 1.7997 0.3244 0.4384 0.1479 81 GLU E CA 8754 C C . GLU F 81 ? 1.8351 1.0066 1.6878 0.3014 0.4016 0.1553 81 GLU E C 8755 O O . GLU F 81 ? 1.7906 0.9949 1.6741 0.2437 0.3708 0.1189 81 GLU E O 8756 C CB . GLU F 81 ? 2.1543 1.0800 1.8969 0.3301 0.4315 0.0925 81 GLU E CB 8757 C CG . GLU F 81 ? 2.1921 1.0883 1.9601 0.2586 0.3977 0.0271 81 GLU E CG 8758 C CD . GLU F 81 ? 2.3111 1.1301 2.0165 0.2833 0.3829 -0.0316 81 GLU E CD 8759 O OE1 . GLU F 81 ? 2.3815 1.1361 2.0966 0.2369 0.3550 -0.0968 81 GLU E OE1 8760 O OE2 . GLU F 81 ? 2.3356 1.1615 1.9832 0.3540 0.3984 -0.0146 81 GLU E OE2 8761 N N . ASP F 82 ? 1.7298 1.0042 1.6042 0.3486 0.4024 0.1995 82 ASP E N 8762 C CA . ASP F 82 ? 1.5433 0.9695 1.4831 0.3308 0.3685 0.2063 82 ASP E CA 8763 C C . ASP F 82 ? 1.4039 0.9078 1.3888 0.3234 0.3492 0.2381 82 ASP E C 8764 O O . ASP F 82 ? 1.2667 0.8843 1.3076 0.2993 0.3145 0.2385 82 ASP E O 8765 C CB . ASP F 82 ? 1.5283 1.0334 1.4830 0.3860 0.3786 0.2240 82 ASP E CB 8766 C CG . ASP F 82 ? 1.6176 1.0425 1.5098 0.4115 0.4021 0.1977 82 ASP E CG 8767 O OD1 . ASP F 82 ? 1.6736 1.0184 1.5277 0.3730 0.3912 0.1530 82 ASP E OD1 8768 O OD2 . ASP F 82 ? 1.6462 1.0913 1.5272 0.4755 0.4292 0.2189 82 ASP E OD2 8769 N N . PHE F 83 ? 1.4257 0.8596 1.3772 0.3500 0.3724 0.2651 83 PHE E N 8770 C CA . PHE F 83 ? 1.3713 0.8654 1.3436 0.3599 0.3556 0.2963 83 PHE E CA 8771 C C . PHE F 83 ? 1.3156 0.8160 1.3109 0.2893 0.3366 0.2795 83 PHE E C 8772 O O . PHE F 83 ? 1.4099 0.8093 1.3801 0.2615 0.3652 0.2777 83 PHE E O 8773 C CB . PHE F 83 ? 1.4356 0.8379 1.3448 0.4219 0.3937 0.3346 83 PHE E CB 8774 C CG . PHE F 83 ? 1.5038 0.9350 1.3965 0.5074 0.4016 0.3563 83 PHE E CG 8775 C CD1 . PHE F 83 ? 1.4279 1.0007 1.3723 0.5510 0.3644 0.3713 83 PHE E CD1 8776 C CD2 . PHE F 83 ? 1.6011 0.9205 1.4319 0.5463 0.4431 0.3573 83 PHE E CD2 8777 C CE1 . PHE F 83 ? 1.4477 1.0631 1.3933 0.6312 0.3697 0.3868 83 PHE E CE1 8778 C CE2 . PHE F 83 ? 1.6741 1.0276 1.4900 0.6311 0.4513 0.3769 83 PHE E CE2 8779 C CZ . PHE F 83 ? 1.5646 1.0745 1.4434 0.6714 0.4145 0.3907 83 PHE E CZ 8780 N N . ALA F 84 ? 1.1742 0.7934 1.2226 0.2609 0.2909 0.2677 84 ALA E N 8781 C CA . ALA F 84 ? 1.1380 0.7797 1.2074 0.2007 0.2672 0.2501 84 ALA E CA 8782 C C . ALA F 84 ? 1.0113 0.7857 1.1275 0.1967 0.2149 0.2522 84 ALA E C 8783 O O . ALA F 84 ? 0.9739 0.8228 1.1166 0.2403 0.1976 0.2698 84 ALA E O 8784 C CB . ALA F 84 ? 1.1624 0.7573 1.2337 0.1421 0.2672 0.2015 84 ALA E CB 8785 N N . THR F 85 ? 0.9535 0.7577 1.0855 0.1448 0.1878 0.2307 85 THR E N 8786 C CA . THR F 85 ? 0.8869 0.8010 1.0566 0.1362 0.1357 0.2275 85 THR E CA 8787 C C . THR F 85 ? 0.8542 0.8034 1.0470 0.1004 0.1179 0.1954 85 THR E C 8788 O O . THR F 85 ? 0.8526 0.7482 1.0232 0.0660 0.1292 0.1640 85 THR E O 8789 C CB . THR F 85 ? 0.8866 0.8133 1.0472 0.1127 0.1160 0.2274 85 THR E CB 8790 O OG1 . THR F 85 ? 0.9184 0.8059 1.0446 0.1574 0.1403 0.2647 85 THR E OG1 8791 C CG2 . THR F 85 ? 0.8398 0.8685 1.0309 0.1063 0.0571 0.2196 85 THR E CG2 8792 N N . TYR F 86 ? 0.8542 0.8902 1.0925 0.1120 0.0908 0.2020 86 TYR E N 8793 C CA . TYR F 86 ? 0.8841 0.9452 1.1389 0.0868 0.0860 0.1819 86 TYR E CA 8794 C C . TYR F 86 ? 0.8373 0.9716 1.1239 0.0582 0.0383 0.1730 86 TYR E C 8795 O O . TYR F 86 ? 0.7918 0.9909 1.1194 0.0726 0.0048 0.1873 86 TYR E O 8796 C CB . TYR F 86 ? 0.8812 0.9687 1.1710 0.1229 0.1132 0.2000 86 TYR E CB 8797 C CG . TYR F 86 ? 0.9676 0.9698 1.2103 0.1541 0.1606 0.2035 86 TYR E CG 8798 C CD1 . TYR F 86 ? 1.0153 0.9918 1.2475 0.1970 0.1766 0.2274 86 TYR E CD1 8799 C CD2 . TYR F 86 ? 0.9932 0.9306 1.1900 0.1481 0.1876 0.1812 86 TYR E CD2 8800 C CE1 . TYR F 86 ? 1.0910 0.9762 1.2730 0.2271 0.2199 0.2301 86 TYR E CE1 8801 C CE2 . TYR F 86 ? 1.0693 0.9195 1.2175 0.1797 0.2256 0.1795 86 TYR E CE2 8802 C CZ . TYR F 86 ? 1.1150 0.9375 1.2583 0.2161 0.2425 0.2045 86 TYR E CZ 8803 O OH . TYR F 86 ? 1.2099 0.9330 1.2981 0.2491 0.2805 0.2025 86 TYR E OH 8804 N N . TYR F 87 ? 0.8139 0.9307 1.0737 0.0235 0.0319 0.1459 87 TYR E N 8805 C CA . TYR F 87 ? 0.7307 0.8982 1.0058 -0.0027 -0.0096 0.1360 87 TYR E CA 8806 C C . TYR F 87 ? 0.7342 0.9068 1.0169 -0.0105 0.0057 0.1331 87 TYR E C 8807 O O . TYR F 87 ? 0.7556 0.8796 1.0052 0.0021 0.0459 0.1289 87 TYR E O 8808 C CB . TYR F 87 ? 0.6543 0.7954 0.8781 -0.0314 -0.0340 0.1070 87 TYR E CB 8809 C CG . TYR F 87 ? 0.6507 0.7893 0.8690 -0.0251 -0.0420 0.1159 87 TYR E CG 8810 C CD1 . TYR F 87 ? 0.6291 0.8214 0.8627 -0.0149 -0.0815 0.1291 87 TYR E CD1 8811 C CD2 . TYR F 87 ? 0.7537 0.8289 0.9487 -0.0265 -0.0074 0.1113 87 TYR E CD2 8812 C CE1 . TYR F 87 ? 0.7049 0.8881 0.9193 0.0016 -0.0806 0.1430 87 TYR E CE1 8813 C CE2 . TYR F 87 ? 0.8077 0.8720 0.9971 -0.0195 -0.0013 0.1271 87 TYR E CE2 8814 C CZ . TYR F 87 ? 0.7938 0.9123 0.9870 -0.0017 -0.0351 0.1457 87 TYR E CZ 8815 O OH . TYR F 87 ? 0.8561 0.9572 1.0301 0.0156 -0.0210 0.1671 87 TYR E OH 8816 N N . CYS F 88 ? 0.7488 0.9721 1.0699 -0.0277 -0.0240 0.1363 88 CYS E N 8817 C CA . CYS F 88 ? 0.7893 1.0057 1.1108 -0.0383 -0.0038 0.1379 88 CYS E CA 8818 C C . CYS F 88 ? 0.8289 1.0271 1.0969 -0.0647 -0.0398 0.1141 88 CYS E C 8819 O O . CYS F 88 ? 0.8390 1.0701 1.1200 -0.0778 -0.0889 0.1071 88 CYS E O 8820 C CB . CYS F 88 ? 0.7781 1.0662 1.2106 -0.0365 0.0040 0.1664 88 CYS E CB 8821 S SG . CYS F 88 ? 0.8788 1.2473 1.3939 -0.0524 -0.0683 0.1637 88 CYS E SG 8822 N N . GLN F 89 ? 0.8724 1.0141 1.0688 -0.0634 -0.0165 0.1006 89 GLN E N 8823 C CA . GLN F 89 ? 0.8711 0.9864 0.9985 -0.0782 -0.0492 0.0748 89 GLN E CA 8824 C C . GLN F 89 ? 0.8966 0.9900 1.0132 -0.0805 -0.0268 0.0903 89 GLN E C 8825 O O . GLN F 89 ? 0.9378 1.0054 1.0526 -0.0619 0.0291 0.1109 89 GLN E O 8826 C CB . GLN F 89 ? 0.9209 0.9786 0.9518 -0.0672 -0.0514 0.0341 89 GLN E CB 8827 C CG . GLN F 89 ? 0.9452 0.9816 0.8990 -0.0730 -0.0889 0.0013 89 GLN E CG 8828 C CD . GLN F 89 ? 1.0364 1.0229 0.9051 -0.0561 -0.0933 -0.0472 89 GLN E CD 8829 O OE1 . GLN F 89 ? 1.0737 1.0460 0.9533 -0.0514 -0.0796 -0.0617 89 GLN E OE1 8830 N NE2 . GLN F 89 ? 1.1084 1.0648 0.8920 -0.0439 -0.1154 -0.0762 89 GLN E NE2 8831 N N . GLN F 90 ? 0.9092 1.0067 1.0142 -0.0999 -0.0660 0.0829 90 GLN E N 8832 C CA . GLN F 90 ? 0.9710 1.0253 1.0458 -0.1028 -0.0437 0.0958 90 GLN E CA 8833 C C . GLN F 90 ? 1.0461 1.0206 0.9745 -0.0752 -0.0381 0.0664 90 GLN E C 8834 O O . GLN F 90 ? 1.0442 1.0164 0.9122 -0.0717 -0.0832 0.0271 90 GLN E O 8835 C CB . GLN F 90 ? 0.9487 1.0298 1.0696 -0.1326 -0.0921 0.0975 90 GLN E CB 8836 C CG . GLN F 90 ? 1.0343 1.0548 1.1200 -0.1395 -0.0687 0.1117 90 GLN E CG 8837 C CD . GLN F 90 ? 1.0824 1.0402 1.0283 -0.1251 -0.1033 0.0797 90 GLN E CD 8838 O OE1 . GLN F 90 ? 1.1799 1.0598 1.0417 -0.1100 -0.0721 0.0870 90 GLN E OE1 8839 N NE2 . GLN F 90 ? 1.0255 1.0165 0.9433 -0.1242 -0.1645 0.0457 90 GLN E NE2 8840 N N . LEU F 91 ? 1.2814 1.2647 1.1651 -0.0683 -0.0232 -0.1887 91 LEU E N 8841 C CA . LEU F 91 ? 1.2665 1.2770 1.1496 -0.0417 -0.0124 -0.1924 91 LEU E CA 8842 C C . LEU F 91 ? 1.3764 1.3407 1.1456 -0.0726 0.0052 -0.1597 91 LEU E C 8843 O O . LEU F 91 ? 1.3915 1.3615 1.1394 -0.0508 0.0130 -0.1558 91 LEU E O 8844 C CB . LEU F 91 ? 1.1681 1.3271 1.1502 -0.0248 -0.0231 -0.2426 91 LEU E CB 8845 C CG . LEU F 91 ? 1.0978 1.3129 1.1973 0.0005 -0.0488 -0.2812 91 LEU E CG 8846 C CD1 . LEU F 91 ? 1.0636 1.4231 1.2453 0.0207 -0.0616 -0.3370 91 LEU E CD1 8847 C CD2 . LEU F 91 ? 1.0788 1.2182 1.2197 0.0404 -0.0580 -0.2698 91 LEU E CD2 8848 N N . ASN F 92 ? 1.4787 1.3924 1.1748 -0.1242 0.0067 -0.1351 92 ASN E N 8849 C CA . ASN F 92 ? 1.5938 1.4637 1.1847 -0.1648 0.0180 -0.1008 92 ASN E CA 8850 C C . ASN F 92 ? 1.6626 1.3822 1.1539 -0.1419 0.0227 -0.0648 92 ASN E C 8851 O O . ASN F 92 ? 1.6758 1.3962 1.1413 -0.1179 0.0305 -0.0571 92 ASN E O 8852 C CB . ASN F 92 ? 1.6999 1.5592 1.2532 -0.2332 0.0116 -0.0850 92 ASN E CB 8853 C CG . ASN F 92 ? 1.8356 1.6717 1.2962 -0.2873 0.0207 -0.0472 92 ASN E CG 8854 O OD1 . ASN F 92 ? 1.8796 1.7462 1.3157 -0.2746 0.0339 -0.0389 92 ASN E OD1 8855 N ND2 . ASN F 92 ? 1.9029 1.6822 1.3107 -0.3500 0.0102 -0.0220 92 ASN E ND2 8856 N N . SER F 93 ? 1.6995 1.2927 1.1324 -0.1444 0.0157 -0.0457 93 SER E N 8857 C CA . SER F 93 ? 1.7747 1.2199 1.1024 -0.1205 0.0183 -0.0144 93 SER E CA 8858 C C . SER F 93 ? 1.7475 1.1319 1.0924 -0.0616 0.0214 -0.0177 93 SER E C 8859 O O . SER F 93 ? 1.7070 1.1502 1.1394 -0.0465 0.0192 -0.0385 93 SER E O 8860 C CB . SER F 93 ? 1.8921 1.2192 1.1057 -0.1741 0.0058 0.0149 93 SER E CB 8861 O OG . SER F 93 ? 1.9063 1.2896 1.1015 -0.2347 0.0059 0.0286 93 SER E OG 8862 N N . TYR F 94 ? 1.7895 1.0581 1.0493 -0.0273 0.0264 0.0051 94 TYR E N 8863 C CA . TYR F 94 ? 1.7457 0.9588 1.0090 0.0302 0.0351 0.0079 94 TYR E CA 8864 C C . TYR F 94 ? 1.7934 0.9008 0.9820 0.0195 0.0261 0.0150 94 TYR E C 8865 O O . TYR F 94 ? 1.9093 0.9303 1.0034 -0.0215 0.0101 0.0257 94 TYR E O 8866 C CB . TYR F 94 ? 1.7994 0.9475 1.0077 0.0806 0.0447 0.0252 94 TYR E CB 8867 C CG . TYR F 94 ? 1.7354 0.9899 1.0417 0.1166 0.0534 0.0140 94 TYR E CG 8868 C CD1 . TYR F 94 ? 1.6138 0.9847 1.0524 0.1243 0.0549 -0.0090 94 TYR E CD1 8869 C CD2 . TYR F 94 ? 1.8100 1.0423 1.0756 0.1437 0.0540 0.0254 94 TYR E CD2 8870 C CE1 . TYR F 94 ? 1.5535 1.0146 1.0835 0.1554 0.0552 -0.0226 94 TYR E CE1 8871 C CE2 . TYR F 94 ? 1.7294 1.0592 1.0850 0.1768 0.0559 0.0122 94 TYR E CE2 8872 C CZ . TYR F 94 ? 1.6071 1.0505 1.0958 0.1811 0.0557 -0.0130 94 TYR E CZ 8873 O OH . TYR F 94 ? 1.5369 1.0705 1.1170 0.2121 0.0504 -0.0294 94 TYR E OH 8874 N N . PRO F 95 ? 1.6966 0.8090 0.9255 0.0548 0.0336 0.0106 95 PRO E N 8875 C CA . PRO F 95 ? 1.5704 0.7817 0.9195 0.0944 0.0483 0.0031 95 PRO E CA 8876 C C . PRO F 95 ? 1.4636 0.7898 0.9274 0.0655 0.0363 -0.0203 95 PRO E C 8877 O O . PRO F 95 ? 1.5002 0.8228 0.9483 0.0248 0.0201 -0.0285 95 PRO E O 8878 C CB . PRO F 95 ? 1.5877 0.7320 0.9028 0.1411 0.0624 0.0189 95 PRO E CB 8879 C CG . PRO F 95 ? 1.6928 0.7037 0.8670 0.1265 0.0501 0.0253 95 PRO E CG 8880 C CD . PRO F 95 ? 1.7388 0.7501 0.8889 0.0599 0.0263 0.0162 95 PRO E CD 8881 N N . LEU F 96 ? 1.3364 0.7622 0.9165 0.0883 0.0398 -0.0332 96 LEU E N 8882 C CA . LEU F 96 ? 1.2485 0.7770 0.9420 0.0722 0.0238 -0.0598 96 LEU E CA 8883 C C . LEU F 96 ? 1.2756 0.7746 0.9826 0.0770 0.0181 -0.0518 96 LEU E C 8884 O O . LEU F 96 ? 1.3268 0.7871 1.0340 0.1127 0.0321 -0.0291 96 LEU E O 8885 C CB . LEU F 96 ? 1.1707 0.7927 0.9811 0.1009 0.0222 -0.0765 96 LEU E CB 8886 C CG . LEU F 96 ? 1.1618 0.8282 0.9653 0.1008 0.0234 -0.0889 96 LEU E CG 8887 C CD1 . LEU F 96 ? 1.0410 0.7971 0.9654 0.1314 0.0135 -0.1115 96 LEU E CD1 8888 C CD2 . LEU F 96 ? 1.2019 0.9139 0.9772 0.0543 0.0148 -0.1074 96 LEU E CD2 8889 N N . THR F 97 ? 1.2412 0.7647 0.9585 0.0416 -0.0023 -0.0685 97 THR E N 8890 C CA . THR F 97 ? 1.2610 0.7542 0.9815 0.0445 -0.0137 -0.0615 97 THR E CA 8891 C C . THR F 97 ? 1.1896 0.7805 1.0257 0.0336 -0.0398 -0.0903 97 THR E C 8892 O O . THR F 97 ? 1.1351 0.8136 1.0248 0.0135 -0.0504 -0.1211 97 THR E O 8893 C CB . THR F 97 ? 1.3459 0.7468 0.9458 0.0164 -0.0221 -0.0526 97 THR E CB 8894 O OG1 . THR F 97 ? 1.3757 0.8150 0.9658 -0.0334 -0.0356 -0.0712 97 THR E OG1 8895 C CG2 . THR F 97 ? 1.4095 0.6945 0.8897 0.0406 -0.0015 -0.0261 97 THR E CG2 8896 N N . PHE F 98 ? 1.1610 0.7369 1.0311 0.0505 -0.0506 -0.0798 98 PHE E N 8897 C CA . PHE F 98 ? 1.0256 0.6779 1.0030 0.0479 -0.0813 -0.1055 98 PHE E CA 8898 C C . PHE F 98 ? 1.0206 0.6430 0.9580 0.0285 -0.1049 -0.1059 98 PHE E C 8899 O O . PHE F 98 ? 1.1227 0.6584 0.9482 0.0189 -0.0979 -0.0853 98 PHE E O 8900 C CB . PHE F 98 ? 0.9645 0.6289 1.0338 0.0827 -0.0839 -0.0911 98 PHE E CB 8901 C CG . PHE F 98 ? 0.9240 0.6363 1.0611 0.1005 -0.0729 -0.0994 98 PHE E CG 8902 C CD1 . PHE F 98 ? 0.8668 0.6692 1.1167 0.1047 -0.0987 -0.1402 98 PHE E CD1 8903 C CD2 . PHE F 98 ? 0.9406 0.6092 1.0286 0.1176 -0.0404 -0.0701 98 PHE E CD2 8904 C CE1 . PHE F 98 ? 0.8083 0.6522 1.1176 0.1225 -0.0947 -0.1516 98 PHE E CE1 8905 C CE2 . PHE F 98 ? 0.8842 0.6002 1.0378 0.1346 -0.0353 -0.0788 98 PHE E CE2 8906 C CZ . PHE F 98 ? 0.8132 0.6149 1.0762 0.1355 -0.0637 -0.1196 98 PHE E CZ 8907 N N . GLY F 99 ? 0.9808 0.6735 1.0095 0.0266 -0.1373 -0.1329 99 GLY E N 8908 C CA . GLY F 99 ? 1.0324 0.7061 1.0395 0.0140 -0.1665 -0.1348 99 GLY E CA 8909 C C . GLY F 99 ? 1.1200 0.7316 1.1265 0.0445 -0.1734 -0.1012 99 GLY E C 8910 O O . GLY F 99 ? 1.1176 0.7158 1.1593 0.0712 -0.1557 -0.0775 99 GLY E O 8911 N N . GLY F 100 ? 1.1926 0.7700 1.1599 0.0388 -0.2001 -0.0965 100 GLY E N 8912 C CA . GLY F 100 ? 1.0598 0.5777 1.0132 0.0661 -0.2080 -0.0597 100 GLY E CA 8913 C C . GLY F 100 ? 1.0886 0.6555 1.1723 0.0886 -0.2281 -0.0607 100 GLY E C 8914 O O . GLY F 100 ? 1.0829 0.6106 1.1784 0.1109 -0.2157 -0.0191 100 GLY E O 8915 N N . GLY F 101 ? 1.0585 0.7132 1.2419 0.0829 -0.2605 -0.1083 101 GLY E N 8916 C CA . GLY F 101 ? 0.9988 0.6949 1.3090 0.1065 -0.2908 -0.1201 101 GLY E CA 8917 C C . GLY F 101 ? 0.9823 0.7066 1.3407 0.1128 -0.3446 -0.1452 101 GLY E C 8918 O O . GLY F 101 ? 1.0154 0.6971 1.3006 0.1055 -0.3584 -0.1301 101 GLY E O 8919 N N . THR F 102 ? 0.9334 0.7290 1.4137 0.1307 -0.3791 -0.1870 102 THR E N 8920 C CA . THR F 102 ? 0.9283 0.7567 1.4687 0.1461 -0.4355 -0.2161 102 THR E CA 8921 C C . THR F 102 ? 0.9058 0.7190 1.5533 0.1800 -0.4755 -0.2155 102 THR E C 8922 O O . THR F 102 ? 0.8740 0.7323 1.6078 0.1938 -0.4798 -0.2470 102 THR E O 8923 C CB . THR F 102 ? 0.8789 0.8299 1.4678 0.1381 -0.4495 -0.2843 102 THR E CB 8924 O OG1 . THR F 102 ? 0.8795 0.8358 1.3723 0.0994 -0.4237 -0.2792 102 THR E OG1 8925 C CG2 . THR F 102 ? 0.9035 0.8995 1.5730 0.1646 -0.5112 -0.3198 102 THR E CG2 8926 N N . LYS F 103 ? 1.1514 1.2069 0.5819 0.0835 -0.2503 0.3043 103 LYS E N 8927 C CA . LYS F 103 ? 1.1059 1.2451 0.6059 0.0923 -0.2145 0.3417 103 LYS E CA 8928 C C . LYS F 103 ? 1.0639 1.2983 0.6245 0.0896 -0.1825 0.3829 103 LYS E C 8929 O O . LYS F 103 ? 1.0924 1.3077 0.6501 0.0822 -0.1871 0.3935 103 LYS E O 8930 C CB . LYS F 103 ? 1.1574 1.2585 0.6711 0.1180 -0.2045 0.3518 103 LYS E CB 8931 C CG . LYS F 103 ? 1.2698 1.2889 0.7326 0.1180 -0.2380 0.3150 103 LYS E CG 8932 C CD . LYS F 103 ? 1.3079 1.2984 0.7843 0.1304 -0.2312 0.3264 103 LYS E CD 8933 C CE . LYS F 103 ? 1.2521 1.3219 0.8046 0.1737 -0.1717 0.3627 103 LYS E CE 8934 N NZ . LYS F 103 ? 1.2799 1.3190 0.8390 0.1876 -0.1618 0.3702 103 LYS E NZ 8935 N N . VAL F 104 ? 1.0102 1.3506 0.6257 0.1022 -0.1482 0.4044 104 VAL E N 8936 C CA . VAL F 104 ? 1.0156 1.4556 0.7015 0.1124 -0.1116 0.4487 104 VAL E CA 8937 C C . VAL F 104 ? 1.0202 1.4676 0.8188 0.1564 -0.0470 0.4401 104 VAL E C 8938 O O . VAL F 104 ? 1.0404 1.4690 0.8742 0.1686 -0.0200 0.3929 104 VAL E O 8939 C CB . VAL F 104 ? 1.0154 1.5297 0.7135 0.0739 -0.1070 0.4240 104 VAL E CB 8940 C CG1 . VAL F 104 ? 1.0756 1.5515 0.6961 0.0257 -0.1571 0.4116 104 VAL E CG1 8941 C CG2 . VAL F 104 ? 0.9484 1.4544 0.6658 0.0672 -0.0889 0.3603 104 VAL E CG2 8942 N N . GLU F 105 ? 1.0365 1.5034 0.8942 0.1781 -0.0237 0.4819 105 GLU E N 8943 C CA . GLU F 105 ? 1.0632 1.5237 1.0261 0.2170 0.0319 0.4772 105 GLU E CA 8944 C C . GLU F 105 ? 1.0714 1.6018 1.1525 0.2236 0.0745 0.4789 105 GLU E C 8945 O O . GLU F 105 ? 1.0387 1.6207 1.1169 0.2026 0.0588 0.4986 105 GLU E O 8946 C CB . GLU F 105 ? 1.1083 1.5146 1.0414 0.2412 0.0206 0.5262 105 GLU E CB 8947 C CG . GLU F 105 ? 1.1692 1.5873 1.0814 0.2301 -0.0055 0.5771 105 GLU E CG 8948 C CD . GLU F 105 ? 1.2312 1.6010 1.1702 0.2444 0.0066 0.5920 105 GLU E CD 8949 O OE1 . GLU F 105 ? 1.2704 1.6148 1.1824 0.2206 -0.0184 0.5915 105 GLU E OE1 8950 O OE2 . GLU F 105 ? 1.2377 1.5926 1.2231 0.2787 0.0417 0.6024 105 GLU E OE2 8951 N N . ILE F 106 ? 1.0879 1.6204 1.2755 0.2528 0.1273 0.4560 106 ILE E N 8952 C CA . ILE F 106 ? 1.0614 1.6544 1.3760 0.2654 0.1677 0.4547 106 ILE E CA 8953 C C . ILE F 106 ? 1.0373 1.6269 1.3658 0.2792 0.1543 0.5202 106 ILE E C 8954 O O . ILE F 106 ? 1.0463 1.5756 1.3301 0.2947 0.1401 0.5594 106 ILE E O 8955 C CB . ILE F 106 ? 1.0785 1.6649 1.5019 0.2949 0.2234 0.4167 106 ILE E CB 8956 C CG1 . ILE F 106 ? 1.0382 1.6128 1.4350 0.2838 0.2332 0.3552 106 ILE E CG1 8957 C CG2 . ILE F 106 ? 1.1141 1.7700 1.6755 0.3052 0.2618 0.4044 106 ILE E CG2 8958 C CD1 . ILE F 106 ? 1.0006 1.5657 1.4968 0.3118 0.2869 0.3157 106 ILE E CD1 8959 N N . LYS F 107 ? 0.9940 1.6503 1.3852 0.2719 0.1583 0.5299 107 LYS E N 8960 C CA . LYS F 107 ? 0.9633 1.6212 1.3657 0.2814 0.1396 0.5918 107 LYS E CA 8961 C C . LYS F 107 ? 0.9395 1.6215 1.4889 0.3120 0.1782 0.5960 107 LYS E C 8962 O O . LYS F 107 ? 0.9361 1.6896 1.5836 0.3095 0.2015 0.5639 107 LYS E O 8963 C CB . LYS F 107 ? 0.9455 1.6589 1.3000 0.2486 0.1054 0.6058 107 LYS E CB 8964 C CG . LYS F 107 ? 0.9237 1.6311 1.2592 0.2535 0.0750 0.6734 107 LYS E CG 8965 C CD . LYS F 107 ? 0.9077 1.6718 1.1892 0.2173 0.0416 0.6815 107 LYS E CD 8966 C CE . LYS F 107 ? 0.9302 1.6862 1.1843 0.2211 0.0082 0.7493 107 LYS E CE 8967 N NZ . LYS F 107 ? 0.9296 1.7442 1.1328 0.1843 -0.0231 0.7558 107 LYS E NZ 8968 N N . ARG F 108 ? 0.9577 1.5799 1.5222 0.3388 0.1827 0.6343 108 ARG E N 8969 C CA . ARG F 108 ? 0.8678 1.4987 1.5646 0.3675 0.2101 0.6479 108 ARG E CA 8970 C C . ARG F 108 ? 0.8989 1.5107 1.5834 0.3735 0.1783 0.7203 108 ARG E C 8971 O O . ARG F 108 ? 0.9172 1.5184 1.4952 0.3550 0.1383 0.7561 108 ARG E O 8972 C CB . ARG F 108 ? 0.8886 1.4649 1.6255 0.3913 0.2436 0.6333 108 ARG E CB 8973 C CG . ARG F 108 ? 0.9270 1.4214 1.5588 0.3928 0.2240 0.6733 108 ARG E CG 8974 C CD . ARG F 108 ? 0.9102 1.3562 1.5935 0.4145 0.2591 0.6632 108 ARG E CD 8975 N NE . ARG F 108 ? 0.9235 1.3670 1.7179 0.4354 0.2723 0.6952 108 ARG E NE 8976 C CZ . ARG F 108 ? 0.9454 1.4239 1.8743 0.4525 0.3061 0.6617 108 ARG E CZ 8977 N NH1 . ARG F 108 ? 0.9262 1.4469 1.8904 0.4485 0.3334 0.5934 108 ARG E NH1 8978 N NH2 . ARG F 108 ? 0.9330 1.3894 1.9323 0.4553 0.3066 0.6824 108 ARG E NH2 8979 N N . THR F 109 ? 0.9102 1.5154 1.7041 0.3987 0.1936 0.7424 109 THR E N 8980 C CA . THR F 109 ? 0.9666 1.5454 1.7546 0.4045 0.1632 0.8121 109 THR E CA 8981 C C . THR F 109 ? 1.0348 1.5194 1.7090 0.3841 0.1535 0.8233 109 THR E C 8982 O O . THR F 109 ? 1.0313 1.4809 1.6847 0.3921 0.1742 0.8040 109 THR E O 8983 C CB . THR F 109 ? 1.0244 1.6177 1.9553 0.4211 0.1790 0.8110 109 THR E CB 8984 O OG1 . THR F 109 ? 1.0805 1.6313 2.0685 0.4354 0.2128 0.7863 109 THR E OG1 8985 C CG2 . THR F 109 ? 0.9675 1.6631 2.0115 0.4275 0.1911 0.7730 109 THR E CG2 8986 N N . VAL F 110 ? 1.1066 1.5601 1.7173 0.3578 0.1229 0.8426 110 VAL E N 8987 C CA . VAL F 110 ? 1.1619 1.5442 1.6750 0.3358 0.1092 0.8357 110 VAL E CA 8988 C C . VAL F 110 ? 1.2106 1.5537 1.7834 0.3515 0.1357 0.8434 110 VAL E C 8989 O O . VAL F 110 ? 1.1009 1.4507 1.7747 0.3655 0.1449 0.8637 110 VAL E O 8990 C CB . VAL F 110 ? 1.1649 1.5270 1.6190 0.3088 0.0715 0.8455 110 VAL E CB 8991 C CG1 . VAL F 110 ? 1.1556 1.4478 1.5180 0.2889 0.0570 0.8319 110 VAL E CG1 8992 C CG2 . VAL F 110 ? 1.1588 1.5520 1.5495 0.2895 0.0451 0.8322 110 VAL E CG2 8993 N N . ALA F 111 ? 1.2397 1.5413 1.7512 0.3478 0.1459 0.8247 111 ALA E N 8994 C CA . ALA F 111 ? 1.2721 1.5350 1.8277 0.3587 0.1715 0.8306 111 ALA E CA 8995 C C . ALA F 111 ? 1.3095 1.5179 1.7632 0.3338 0.1529 0.8272 111 ALA E C 8996 O O . ALA F 111 ? 1.2921 1.4860 1.6464 0.3183 0.1372 0.8024 111 ALA E O 8997 C CB . ALA F 111 ? 1.2512 1.5202 1.8568 0.3852 0.2123 0.8076 111 ALA E CB 8998 N N . ALA F 112 ? 1.3403 1.5176 1.8216 0.3292 0.1523 0.8499 112 ALA E N 8999 C CA . ALA F 112 ? 1.3512 1.4785 1.7433 0.3053 0.1352 0.8492 112 ALA E CA 9000 C C . ALA F 112 ? 1.3363 1.4374 1.7180 0.3125 0.1658 0.8368 112 ALA E C 9001 O O . ALA F 112 ? 1.3104 1.4149 1.7797 0.3348 0.2013 0.8419 112 ALA E O 9002 C CB . ALA F 112 ? 1.3794 1.4832 1.7978 0.2948 0.1183 0.8813 112 ALA E CB 9003 N N . PRO F 113 ? 1.3428 1.4155 1.6208 0.2937 0.1526 0.8175 113 PRO E N 9004 C CA . PRO F 113 ? 1.3145 1.3625 1.5726 0.2988 0.1807 0.8051 113 PRO E CA 9005 C C . PRO F 113 ? 1.3647 1.3762 1.6399 0.2901 0.1923 0.8300 113 PRO E C 9006 O O . PRO F 113 ? 1.4044 1.3928 1.6378 0.2659 0.1638 0.8471 113 PRO E O 9007 C CB . PRO F 113 ? 1.3211 1.3539 1.4633 0.2782 0.1538 0.7770 113 PRO E CB 9008 C CG . PRO F 113 ? 1.3586 1.3844 1.4543 0.2539 0.1113 0.7831 113 PRO E CG 9009 C CD . PRO F 113 ? 1.3578 1.4193 1.5349 0.2673 0.1111 0.8020 113 PRO E CD 9010 N N . SER F 114 ? 0.7051 1.5736 1.1798 0.1557 0.0141 0.5992 114 SER E N 9011 C CA . SER F 114 ? 0.7441 1.5753 1.2246 0.1573 0.0141 0.5915 114 SER E CA 9012 C C . SER F 114 ? 0.7146 1.4912 1.1191 0.1002 -0.0272 0.5393 114 SER E C 9013 O O . SER F 114 ? 0.6941 1.3928 1.0376 0.0988 -0.0264 0.4681 114 SER E O 9014 C CB . SER F 114 ? 0.8080 1.5536 1.2941 0.2183 0.0657 0.5480 114 SER E CB 9015 O OG . SER F 114 ? 0.8776 1.6582 1.4237 0.2773 0.1137 0.5939 114 SER E OG 9016 N N . VAL F 115 ? 0.7271 1.5491 1.1331 0.0551 -0.0615 0.5779 115 VAL E N 9017 C CA . VAL F 115 ? 0.7312 1.5016 1.0573 0.0001 -0.0966 0.5342 115 VAL E CA 9018 C C . VAL F 115 ? 0.7569 1.4639 1.0712 0.0118 -0.0866 0.5036 115 VAL E C 9019 O O . VAL F 115 ? 0.7825 1.5283 1.1372 0.0156 -0.0861 0.5511 115 VAL E O 9020 C CB . VAL F 115 ? 0.7385 1.5837 1.0493 -0.0668 -0.1423 0.5842 115 VAL E CB 9021 C CG1 . VAL F 115 ? 0.7716 1.5421 0.9818 -0.1209 -0.1695 0.5307 115 VAL E CG1 9022 C CG2 . VAL F 115 ? 0.7438 1.6599 1.0805 -0.0852 -0.1496 0.6208 115 VAL E CG2 9023 N N . PHE F 116 ? 0.7788 1.3959 1.0416 0.0178 -0.0781 0.4296 116 PHE E N 9024 C CA . PHE F 116 ? 0.8301 1.3873 1.0820 0.0233 -0.0688 0.3970 116 PHE E CA 9025 C C . PHE F 116 ? 0.8726 1.3897 1.0460 -0.0218 -0.0951 0.3636 116 PHE E C 9026 O O . PHE F 116 ? 0.8943 1.3879 1.0126 -0.0412 -0.1071 0.3337 116 PHE E O 9027 C CB . PHE F 116 ? 0.8700 1.3624 1.1319 0.0653 -0.0356 0.3406 116 PHE E CB 9028 C CG . PHE F 116 ? 0.9096 1.4156 1.2345 0.1139 0.0010 0.3642 116 PHE E CG 9029 C CD1 . PHE F 116 ? 0.9604 1.4621 1.3416 0.1389 0.0279 0.3977 116 PHE E CD1 9030 C CD2 . PHE F 116 ? 0.8983 1.4148 1.2226 0.1385 0.0149 0.3551 116 PHE E CD2 9031 C CE1 . PHE F 116 ? 1.0141 1.5135 1.4480 0.1893 0.0713 0.4200 116 PHE E CE1 9032 C CE2 . PHE F 116 ? 0.9489 1.4687 1.3226 0.1880 0.0564 0.3758 116 PHE E CE2 9033 C CZ . PHE F 116 ? 1.0175 1.5243 1.4450 0.2143 0.0865 0.4074 116 PHE E CZ 9034 N N . ILE F 117 ? 0.8833 1.3881 1.0502 -0.0345 -0.0984 0.3718 117 ILE E N 9035 C CA . ILE F 117 ? 0.8794 1.3388 0.9684 -0.0705 -0.1142 0.3415 117 ILE E CA 9036 C C . ILE F 117 ? 0.8946 1.2948 0.9877 -0.0487 -0.0918 0.2990 117 ILE E C 9037 O O . ILE F 117 ? 0.9006 1.3020 1.0534 -0.0231 -0.0714 0.3113 117 ILE E O 9038 C CB . ILE F 117 ? 0.8737 1.3748 0.9344 -0.1129 -0.1401 0.3892 117 ILE E CB 9039 C CG1 . ILE F 117 ? 0.8932 1.3329 0.8569 -0.1486 -0.1495 0.3534 117 ILE E CG1 9040 C CG2 . ILE F 117 ? 0.8785 1.4179 1.0051 -0.0905 -0.1276 0.4369 117 ILE E CG2 9041 C CD1 . ILE F 117 ? 0.9035 1.2965 0.7970 -0.1704 -0.1564 0.3142 117 ILE E CD1 9042 N N . PHE F 118 ? 0.9236 1.2726 0.9572 -0.0584 -0.0925 0.2522 118 PHE E N 9043 C CA . PHE F 118 ? 0.9074 1.2151 0.9497 -0.0418 -0.0737 0.2151 118 PHE E CA 9044 C C . PHE F 118 ? 0.9518 1.2244 0.9268 -0.0644 -0.0757 0.2043 118 PHE E C 9045 O O . PHE F 118 ? 0.9807 1.2222 0.8924 -0.0736 -0.0786 0.1802 118 PHE E O 9046 C CB . PHE F 118 ? 0.8503 1.1402 0.9012 -0.0171 -0.0640 0.1679 118 PHE E CB 9047 C CG . PHE F 118 ? 0.8112 1.1185 0.9220 0.0104 -0.0520 0.1674 118 PHE E CG 9048 C CD1 . PHE F 118 ? 0.8008 1.0915 0.9647 0.0267 -0.0317 0.1559 118 PHE E CD1 9049 C CD2 . PHE F 118 ? 0.7889 1.1218 0.8991 0.0194 -0.0563 0.1782 118 PHE E CD2 9050 C CE1 . PHE F 118 ? 0.8227 1.1111 1.0285 0.0527 -0.0133 0.1506 118 PHE E CE1 9051 C CE2 . PHE F 118 ? 0.7934 1.1355 0.9503 0.0498 -0.0380 0.1776 118 PHE E CE2 9052 C CZ . PHE F 118 ? 0.8111 1.1253 1.0110 0.0671 -0.0151 0.1614 118 PHE E CZ 9053 N N . PRO F 119 ? 0.9711 1.2439 0.9577 -0.0696 -0.0685 0.2250 119 PRO E N 9054 C CA . PRO F 119 ? 1.0185 1.2562 0.9417 -0.0850 -0.0624 0.2168 119 PRO E CA 9055 C C . PRO F 119 ? 1.0206 1.2249 0.9419 -0.0651 -0.0434 0.1731 119 PRO E C 9056 O O . PRO F 119 ? 0.9775 1.1938 0.9606 -0.0433 -0.0367 0.1519 119 PRO E O 9057 C CB . PRO F 119 ? 1.0083 1.2654 0.9697 -0.0849 -0.0537 0.2539 119 PRO E CB 9058 C CG . PRO F 119 ? 0.9812 1.2875 1.0054 -0.0779 -0.0622 0.2937 119 PRO E CG 9059 C CD . PRO F 119 ? 0.9436 1.2485 1.0022 -0.0578 -0.0608 0.2640 119 PRO E CD 9060 N N . PRO F 120 ? 1.0621 1.2269 0.9100 -0.0725 -0.0333 0.1612 120 PRO E N 9061 C CA . PRO F 120 ? 1.0582 1.2050 0.9091 -0.0492 -0.0121 0.1316 120 PRO E CA 9062 C C . PRO F 120 ? 0.9889 1.1615 0.9205 -0.0358 0.0023 0.1322 120 PRO E C 9063 O O . PRO F 120 ? 0.9602 1.1363 0.9060 -0.0449 0.0091 0.1582 120 PRO E O 9064 C CB . PRO F 120 ? 1.1255 1.2185 0.8770 -0.0591 0.0037 0.1314 120 PRO E CB 9065 C CG . PRO F 120 ? 1.1523 1.2272 0.8337 -0.0946 -0.0175 0.1454 120 PRO E CG 9066 C CD . PRO F 120 ? 1.1115 1.2457 0.8628 -0.1040 -0.0397 0.1756 120 PRO E CD 9067 N N . SER F 121 ? 0.9628 1.1565 0.9456 -0.0177 0.0062 0.1057 121 SER E N 9068 C CA . SER F 121 ? 0.9914 1.2102 1.0523 -0.0144 0.0178 0.1015 121 SER E CA 9069 C C . SER F 121 ? 1.0325 1.2460 1.0786 -0.0113 0.0418 0.1149 121 SER E C 9070 O O . SER F 121 ? 1.0753 1.2633 1.0497 -0.0027 0.0531 0.1161 121 SER E O 9071 C CB . SER F 121 ? 1.0270 1.2780 1.1351 -0.0040 0.0105 0.0674 121 SER E CB 9072 O OG . SER F 121 ? 1.0684 1.3285 1.1385 0.0132 0.0140 0.0567 121 SER E OG 9073 N N . ASP F 122 ? 1.0435 1.2750 1.1562 -0.0173 0.0546 0.1261 122 ASP E N 9074 C CA . ASP F 122 ? 1.1004 1.3347 1.2096 -0.0127 0.0818 0.1453 122 ASP E CA 9075 C C . ASP F 122 ? 1.0783 1.3454 1.2026 0.0058 0.0927 0.1303 122 ASP E C 9076 O O . ASP F 122 ? 1.0640 1.3309 1.1664 0.0200 0.1206 0.1477 122 ASP E O 9077 C CB . ASP F 122 ? 1.1297 1.3776 1.3164 -0.0261 0.0944 0.1661 122 ASP E CB 9078 C CG . ASP F 122 ? 1.1476 1.3712 1.3205 -0.0362 0.0905 0.1956 122 ASP E CG 9079 O OD1 . ASP F 122 ? 1.1729 1.3944 1.3827 -0.0409 0.0760 0.1899 122 ASP E OD1 9080 O OD2 . ASP F 122 ? 1.1278 1.3376 1.2507 -0.0374 0.1037 0.2275 122 ASP E OD2 9081 N N . GLU F 123 ? 1.0793 1.3796 1.2398 0.0084 0.0727 0.1020 123 GLU E N 9082 C CA . GLU F 123 ? 1.0617 1.4114 1.2408 0.0281 0.0780 0.0941 123 GLU E CA 9083 C C . GLU F 123 ? 1.0865 1.4004 1.1752 0.0569 0.0934 0.1004 123 GLU E C 9084 O O . GLU F 123 ? 1.1045 1.4343 1.1858 0.0825 0.1211 0.1165 123 GLU E O 9085 C CB . GLU F 123 ? 0.9961 1.3935 1.2250 0.0207 0.0490 0.0624 123 GLU E CB 9086 C CG . GLU F 123 ? 0.9825 1.4028 1.2950 -0.0116 0.0385 0.0480 123 GLU E CG 9087 C CD . GLU F 123 ? 0.9880 1.4552 1.3349 -0.0225 0.0115 0.0109 123 GLU E CD 9088 O OE1 . GLU F 123 ? 1.0175 1.4803 1.4135 -0.0529 0.0029 -0.0117 123 GLU E OE1 9089 O OE2 . GLU F 123 ? 0.9764 1.4805 1.2956 -0.0007 0.0015 0.0046 123 GLU E OE2 9090 N N . GLN F 124 ? 1.0874 1.3502 1.1089 0.0529 0.0793 0.0902 124 GLN E N 9091 C CA . GLN F 124 ? 1.1305 1.3415 1.0595 0.0728 0.0947 0.0918 124 GLN E CA 9092 C C . GLN F 124 ? 1.2119 1.3591 1.0635 0.0734 0.1269 0.1101 124 GLN E C 9093 O O . GLN F 124 ? 1.3069 1.4112 1.0926 0.0985 0.1585 0.1146 124 GLN E O 9094 C CB . GLN F 124 ? 1.1088 1.2863 0.9932 0.0593 0.0694 0.0778 124 GLN E CB 9095 C CG . GLN F 124 ? 1.1630 1.2811 0.9563 0.0746 0.0853 0.0764 124 GLN E CG 9096 C CD . GLN F 124 ? 1.1899 1.2807 0.9463 0.0547 0.0602 0.0675 124 GLN E CD 9097 O OE1 . GLN F 124 ? 1.1584 1.2764 0.9549 0.0330 0.0329 0.0661 124 GLN E OE1 9098 N NE2 . GLN F 124 ? 1.2646 1.2998 0.9470 0.0634 0.0740 0.0653 124 GLN E NE2 9099 N N . LEU F 125 ? 1.1666 1.3038 1.0213 0.0480 0.1225 0.1220 125 LEU E N 9100 C CA . LEU F 125 ? 1.1852 1.2653 0.9573 0.0442 0.1503 0.1388 125 LEU E CA 9101 C C . LEU F 125 ? 1.1885 1.2823 0.9750 0.0758 0.1944 0.1551 125 LEU E C 9102 O O . LEU F 125 ? 1.2770 1.3083 0.9720 0.0882 0.2309 0.1629 125 LEU E O 9103 C CB . LEU F 125 ? 1.1544 1.2406 0.9394 0.0136 0.1347 0.1565 125 LEU E CB 9104 C CG . LEU F 125 ? 1.1065 1.1871 0.8766 -0.0150 0.0959 0.1529 125 LEU E CG 9105 C CD1 . LEU F 125 ? 1.0784 1.1747 0.8654 -0.0369 0.0868 0.1828 125 LEU E CD1 9106 C CD2 . LEU F 125 ? 1.1645 1.1812 0.8192 -0.0274 0.0919 0.1400 125 LEU E CD2 9107 N N . LYS F 126 ? 1.1176 1.2937 1.0166 0.0871 0.1924 0.1606 126 LYS E N 9108 C CA . LYS F 126 ? 1.1684 1.3821 1.1026 0.1182 0.2326 0.1837 126 LYS E CA 9109 C C . LYS F 126 ? 1.2152 1.4326 1.1275 0.1594 0.2531 0.1828 126 LYS E C 9110 O O . LYS F 126 ? 1.2427 1.4894 1.1743 0.1954 0.2937 0.2085 126 LYS E O 9111 C CB . LYS F 126 ? 1.1084 1.4184 1.1779 0.1046 0.2198 0.1935 126 LYS E CB 9112 C CG . LYS F 126 ? 1.1151 1.4191 1.2129 0.0765 0.2215 0.2100 126 LYS E CG 9113 C CD . LYS F 126 ? 1.0548 1.4441 1.2843 0.0616 0.2190 0.2213 126 LYS E CD 9114 C CE . LYS F 126 ? 1.0423 1.4188 1.3008 0.0391 0.2311 0.2460 126 LYS E CE 9115 N NZ . LYS F 126 ? 0.9984 1.4491 1.3856 0.0181 0.2327 0.2572 126 LYS E NZ 9116 N N . SER F 127 ? 1.2115 1.4031 1.0876 0.1576 0.2287 0.1594 127 SER E N 9117 C CA . SER F 127 ? 1.2115 1.4042 1.0670 0.1990 0.2482 0.1628 127 SER E CA 9118 C C . SER F 127 ? 1.2870 1.3554 1.0059 0.2165 0.2889 0.1612 127 SER E C 9119 O O . SER F 127 ? 1.3393 1.3863 1.0282 0.2609 0.3256 0.1732 127 SER E O 9120 C CB . SER F 127 ? 1.2051 1.4391 1.0962 0.1902 0.2040 0.1413 127 SER E CB 9121 O OG . SER F 127 ? 1.1828 1.5209 1.1873 0.1718 0.1701 0.1365 127 SER E OG 9122 N N . GLY F 128 ? 1.2487 1.2343 0.8825 0.1802 0.2833 0.1476 128 GLY E N 9123 C CA . GLY F 128 ? 1.3229 1.1793 0.8127 0.1827 0.3199 0.1389 128 GLY E CA 9124 C C . GLY F 128 ? 1.3242 1.1138 0.7403 0.1442 0.2877 0.1122 128 GLY E C 9125 O O . GLY F 128 ? 1.4592 1.1347 0.7476 0.1281 0.3095 0.0988 128 GLY E O 9126 N N . THR F 129 ? 1.2246 1.0833 0.7178 0.1268 0.2376 0.1042 129 THR E N 9127 C CA . THR F 129 ? 1.2596 1.0742 0.7014 0.0910 0.2058 0.0859 129 THR E CA 9128 C C . THR F 129 ? 1.2145 1.0859 0.7100 0.0478 0.1538 0.0846 129 THR E C 9129 O O . THR F 129 ? 1.1427 1.0828 0.7200 0.0480 0.1431 0.0951 129 THR E O 9130 C CB . THR F 129 ? 1.1826 1.0169 0.6535 0.1175 0.2014 0.0823 129 THR E CB 9131 O OG1 . THR F 129 ? 1.0712 1.0241 0.6658 0.1349 0.1760 0.0876 129 THR E OG1 9132 C CG2 . THR F 129 ? 1.2407 1.0085 0.6520 0.1648 0.2587 0.0910 129 THR E CG2 9133 N N . ALA F 130 ? 1.2733 1.1153 0.7253 0.0117 0.1253 0.0758 130 ALA E N 9134 C CA . ALA F 130 ? 1.2147 1.1123 0.7172 -0.0233 0.0806 0.0827 130 ALA E CA 9135 C C . ALA F 130 ? 1.2011 1.1061 0.7073 -0.0396 0.0521 0.0768 130 ALA E C 9136 O O . ALA F 130 ? 1.3022 1.1402 0.7221 -0.0626 0.0549 0.0703 130 ALA E O 9137 C CB . ALA F 130 ? 1.2643 1.1308 0.6996 -0.0630 0.0748 0.0935 130 ALA E CB 9138 N N . SER F 131 ? 1.0664 1.0481 0.6694 -0.0293 0.0278 0.0788 131 SER E N 9139 C CA . SER F 131 ? 1.0001 1.0000 0.6164 -0.0395 0.0038 0.0780 131 SER E CA 9140 C C . SER F 131 ? 0.9586 1.0124 0.6276 -0.0639 -0.0270 0.0960 131 SER E C 9141 O O . SER F 131 ? 0.9087 1.0122 0.6562 -0.0502 -0.0311 0.0997 131 SER E O 9142 C CB . SER F 131 ? 0.9387 0.9790 0.6115 -0.0001 0.0072 0.0657 131 SER E CB 9143 O OG . SER F 131 ? 1.0214 1.0182 0.6462 0.0268 0.0369 0.0598 131 SER E OG 9144 N N . VAL F 132 ? 1.0100 1.0532 0.6365 -0.1011 -0.0462 0.1101 132 VAL E N 9145 C CA . VAL F 132 ? 0.9417 1.0477 0.6228 -0.1194 -0.0734 0.1379 132 VAL E CA 9146 C C . VAL F 132 ? 0.8920 1.0314 0.6127 -0.1095 -0.0838 0.1399 132 VAL E C 9147 O O . VAL F 132 ? 0.8789 0.9869 0.5492 -0.1238 -0.0846 0.1351 132 VAL E O 9148 C CB . VAL F 132 ? 0.9952 1.0946 0.6138 -0.1715 -0.0930 0.1623 132 VAL E CB 9149 C CG1 . VAL F 132 ? 0.9144 1.0973 0.6059 -0.1805 -0.1172 0.2036 132 VAL E CG1 9150 C CG2 . VAL F 132 ? 1.0779 1.1291 0.6304 -0.1810 -0.0771 0.1559 132 VAL E CG2 9151 N N . VAL F 133 ? 0.8764 1.0720 0.6833 -0.0844 -0.0871 0.1471 133 VAL E N 9152 C CA . VAL F 133 ? 0.8675 1.0958 0.7122 -0.0670 -0.0907 0.1483 133 VAL E CA 9153 C C . VAL F 133 ? 0.8434 1.1298 0.7360 -0.0790 -0.1057 0.1893 133 VAL E C 9154 O O . VAL F 133 ? 0.7408 1.0575 0.6862 -0.0709 -0.1044 0.2090 133 VAL E O 9155 C CB . VAL F 133 ? 0.7867 1.0294 0.6842 -0.0245 -0.0769 0.1198 133 VAL E CB 9156 C CG1 . VAL F 133 ? 0.6960 0.9706 0.6217 -0.0048 -0.0775 0.1210 133 VAL E CG1 9157 C CG2 . VAL F 133 ? 0.8324 1.0416 0.6951 -0.0091 -0.0636 0.0890 133 VAL E CG2 9158 N N . CYS F 134 ? 0.8622 1.1663 0.7407 -0.0964 -0.1166 0.2073 134 CYS E N 9159 C CA . CYS F 134 ? 0.8470 1.2223 0.7808 -0.1030 -0.1284 0.2538 134 CYS E CA 9160 C C . CYS F 134 ? 0.8110 1.2120 0.7906 -0.0635 -0.1137 0.2502 134 CYS E C 9161 O O . CYS F 134 ? 0.8292 1.2034 0.7749 -0.0566 -0.1077 0.2272 134 CYS E O 9162 C CB . CYS F 134 ? 0.9331 1.3247 0.8227 -0.1606 -0.1540 0.2846 134 CYS E CB 9163 S SG . CYS F 134 ? 1.6136 2.1206 1.5808 -0.1754 -0.1739 0.3585 134 CYS E SG 9164 N N . LEU F 135 ? 0.7525 1.2012 0.8045 -0.0344 -0.1034 0.2751 135 LEU E N 9165 C CA . LEU F 135 ? 0.7129 1.1770 0.7997 0.0082 -0.0825 0.2669 135 LEU E CA 9166 C C . LEU F 135 ? 0.7047 1.2412 0.8405 0.0108 -0.0819 0.3240 135 LEU E C 9167 O O . LEU F 135 ? 0.6866 1.2741 0.8706 0.0056 -0.0859 0.3732 135 LEU E O 9168 C CB . LEU F 135 ? 0.7130 1.1551 0.8374 0.0484 -0.0585 0.2395 135 LEU E CB 9169 C CG . LEU F 135 ? 0.7520 1.1980 0.8982 0.0924 -0.0328 0.2231 135 LEU E CG 9170 C CD1 . LEU F 135 ? 0.7942 1.2228 0.8879 0.0971 -0.0361 0.1856 135 LEU E CD1 9171 C CD2 . LEU F 135 ? 0.7705 1.1799 0.9448 0.1202 -0.0087 0.1924 135 LEU E CD2 9172 N N . LEU F 136 ? 0.6968 1.2456 0.8242 0.0212 -0.0751 0.3236 136 LEU E N 9173 C CA . LEU F 136 ? 0.7310 1.3548 0.9131 0.0322 -0.0671 0.3791 136 LEU E CA 9174 C C . LEU F 136 ? 0.7691 1.3846 0.9693 0.0923 -0.0308 0.3582 136 LEU E C 9175 O O . LEU F 136 ? 0.8393 1.4208 0.9944 0.1043 -0.0247 0.3191 136 LEU E O 9176 C CB . LEU F 136 ? 0.7437 1.3942 0.9004 -0.0134 -0.0879 0.4052 136 LEU E CB 9177 C CG . LEU F 136 ? 0.7355 1.4057 0.8693 -0.0845 -0.1253 0.4344 136 LEU E CG 9178 C CD1 . LEU F 136 ? 0.7387 1.3264 0.7993 -0.1104 -0.1379 0.3861 136 LEU E CD1 9179 C CD2 . LEU F 136 ? 0.7034 1.3936 0.8171 -0.1285 -0.1383 0.4573 136 LEU E CD2 9180 N N . ASN F 137 ? 0.7336 1.3782 0.9945 0.1317 -0.0038 0.3859 137 ASN E N 9181 C CA . ASN F 137 ? 0.7874 1.3996 1.0487 0.1880 0.0358 0.3524 137 ASN E CA 9182 C C . ASN F 137 ? 0.8075 1.4774 1.1143 0.2275 0.0681 0.4010 137 ASN E C 9183 O O . ASN F 137 ? 0.8439 1.5815 1.2180 0.2323 0.0746 0.4701 137 ASN E O 9184 C CB . ASN F 137 ? 0.8536 1.4149 1.1327 0.2106 0.0561 0.3266 137 ASN E CB 9185 C CG . ASN F 137 ? 0.9578 1.4537 1.2010 0.2467 0.0851 0.2603 137 ASN E CG 9186 O OD1 . ASN F 137 ? 0.9978 1.4693 1.1836 0.2381 0.0714 0.2105 137 ASN E OD1 9187 N ND2 . ASN F 137 ? 1.0044 1.4708 1.2776 0.2869 0.1271 0.2607 137 ASN E ND2 9188 N N . ASN F 138 ? 0.8200 1.4693 1.0897 0.2582 0.0896 0.3684 138 ASN E N 9189 C CA . ASN F 138 ? 0.8725 1.5625 1.1727 0.3066 0.1310 0.4042 138 ASN E CA 9190 C C . ASN F 138 ? 0.8477 1.6421 1.2183 0.2934 0.1259 0.4950 138 ASN E C 9191 O O . ASN F 138 ? 0.8407 1.6847 1.2823 0.3224 0.1517 0.5527 138 ASN E O 9192 C CB . ASN F 138 ? 0.9273 1.5744 1.2479 0.3608 0.1798 0.3915 138 ASN E CB 9193 C CG . ASN F 138 ? 0.9429 1.4929 1.1909 0.3730 0.1898 0.2997 138 ASN E CG 9194 O OD1 . ASN F 138 ? 0.9080 1.4411 1.0933 0.3580 0.1690 0.2530 138 ASN E OD1 9195 N ND2 . ASN F 138 ? 0.9965 1.4846 1.2542 0.3992 0.2230 0.2766 138 ASN E ND2 9196 N N . PHE F 139 ? 0.8164 1.6457 1.1699 0.2491 0.0948 0.5113 139 PHE E N 9197 C CA . PHE F 139 ? 0.7956 1.7302 1.2148 0.2203 0.0818 0.5961 139 PHE E CA 9198 C C . PHE F 139 ? 0.8238 1.7932 1.2343 0.2191 0.0907 0.6165 139 PHE E C 9199 O O . PHE F 139 ? 0.8945 1.8029 1.2382 0.2368 0.1016 0.5634 139 PHE E O 9200 C CB . PHE F 139 ? 0.7668 1.7168 1.1812 0.1436 0.0274 0.6095 139 PHE E CB 9201 C CG . PHE F 139 ? 0.7873 1.6651 1.1163 0.0963 -0.0024 0.5541 139 PHE E CG 9202 C CD1 . PHE F 139 ? 0.7824 1.5658 1.0477 0.1004 -0.0079 0.4813 139 PHE E CD1 9203 C CD2 . PHE F 139 ? 0.7962 1.7002 1.1120 0.0484 -0.0208 0.5792 139 PHE E CD2 9204 C CE1 . PHE F 139 ? 0.7682 1.4883 0.9600 0.0661 -0.0278 0.4385 139 PHE E CE1 9205 C CE2 . PHE F 139 ? 0.7895 1.6146 1.0250 0.0114 -0.0388 0.5320 139 PHE E CE2 9206 C CZ . PHE F 139 ? 0.7825 1.5174 0.9567 0.0243 -0.0407 0.4636 139 PHE E CZ 9207 N N . TYR F 140 ? 0.7780 1.8540 1.2599 0.1968 0.0855 0.6987 140 TYR E N 9208 C CA . TYR F 140 ? 0.7912 1.9134 1.2800 0.1881 0.0942 0.7326 140 TYR E CA 9209 C C . TYR F 140 ? 0.8537 2.0936 1.4187 0.1254 0.0634 0.8188 140 TYR E C 9210 O O . TYR F 140 ? 0.8988 2.1737 1.5034 0.1169 0.0649 0.8586 140 TYR E O 9211 C CB . TYR F 140 ? 0.7516 1.8930 1.2603 0.2711 0.1557 0.7471 140 TYR E CB 9212 C CG . TYR F 140 ? 0.7230 1.9091 1.2353 0.2697 0.1712 0.7820 140 TYR E CG 9213 C CD1 . TYR F 140 ? 0.7072 1.8188 1.1341 0.2792 0.1781 0.7264 140 TYR E CD1 9214 C CD2 . TYR F 140 ? 0.7493 2.0192 1.3235 0.2515 0.1727 0.8656 140 TYR E CD2 9215 C CE1 . TYR F 140 ? 0.7322 1.8823 1.1627 0.2797 0.1955 0.7629 140 TYR E CE1 9216 C CE2 . TYR F 140 ? 0.7748 2.0774 1.3550 0.2518 0.1814 0.8972 140 TYR E CE2 9217 C CZ . TYR F 140 ? 0.7319 1.9873 1.2502 0.2663 0.2006 0.8501 140 TYR E CZ 9218 O OH . TYR F 140 ? 0.7526 2.0282 1.2747 0.2662 0.2097 0.8775 140 TYR E OH 9219 N N . PRO F 141 ? 0.8750 2.1251 1.4207 0.0670 0.0419 0.8314 141 PRO E N 9220 C CA . PRO F 141 ? 0.9079 2.0669 1.3696 0.0647 0.0493 0.7774 141 PRO E CA 9221 C C . PRO F 141 ? 0.9683 2.0050 1.3330 0.0319 0.0203 0.6968 141 PRO E C 9222 O O . PRO F 141 ? 0.9737 1.9862 1.3286 0.0120 -0.0052 0.6738 141 PRO E O 9223 C CB . PRO F 141 ? 0.9170 2.1422 1.4120 0.0010 0.0352 0.8382 141 PRO E CB 9224 C CG . PRO F 141 ? 0.9084 2.2001 1.4545 -0.0666 -0.0153 0.8726 141 PRO E CG 9225 C CD . PRO F 141 ? 0.8822 2.2260 1.4833 -0.0077 -0.0004 0.8979 141 PRO E CD 9226 N N . ARG F 142 ? 1.0032 1.9684 1.3000 0.0319 0.0292 0.6608 142 ARG E N 9227 C CA . ARG F 142 ? 1.0180 1.8695 1.2238 0.0103 0.0116 0.5922 142 ARG E CA 9228 C C . ARG F 142 ? 1.0316 1.8588 1.2171 -0.0771 -0.0314 0.5940 142 ARG E C 9229 O O . ARG F 142 ? 1.0347 1.7899 1.1676 -0.0901 -0.0488 0.5445 142 ARG E O 9230 C CB . ARG F 142 ? 1.0881 1.8883 1.2392 0.0268 0.0342 0.5771 142 ARG E CB 9231 C CG . ARG F 142 ? 1.1574 1.8477 1.2223 -0.0042 0.0209 0.5279 142 ARG E CG 9232 C CD . ARG F 142 ? 1.1720 1.8051 1.1909 0.0412 0.0217 0.4622 142 ARG E CD 9233 N NE . ARG F 142 ? 1.2403 1.7975 1.1871 0.0589 0.0341 0.4282 142 ARG E NE 9234 C CZ . ARG F 142 ? 1.2736 1.7488 1.1655 0.0184 0.0239 0.4094 142 ARG E CZ 9235 N NH1 . ARG F 142 ? 1.2818 1.7360 1.1722 -0.0485 -0.0021 0.4145 142 ARG E NH1 9236 N NH2 . ARG F 142 ? 1.2859 1.7006 1.1204 0.0468 0.0423 0.3877 142 ARG E NH2 9237 N N . GLU F 143 ? 1.0313 1.9212 1.2561 -0.1395 -0.0478 0.6518 143 GLU E N 9238 C CA . GLU F 143 ? 1.0084 1.8754 1.2020 -0.2345 -0.0898 0.6535 143 GLU E CA 9239 C C . GLU F 143 ? 0.9758 1.8769 1.1881 -0.2492 -0.1201 0.6527 143 GLU E C 9240 O O . GLU F 143 ? 0.9587 1.9706 1.2569 -0.2276 -0.1213 0.7041 143 GLU E O 9241 C CB . GLU F 143 ? 0.9819 1.9291 1.2246 -0.3038 -0.1033 0.7213 143 GLU E CB 9242 C CG . GLU F 143 ? 1.0036 1.8934 1.2119 -0.3144 -0.0776 0.7220 143 GLU E CG 9243 C CD . GLU F 143 ? 0.9432 1.8683 1.1885 -0.2225 -0.0299 0.7384 143 GLU E CD 9244 O OE1 . GLU F 143 ? 0.8917 1.9005 1.2014 -0.1606 -0.0158 0.7605 143 GLU E OE1 9245 O OE2 . GLU F 143 ? 0.9583 1.8226 1.1626 -0.2107 -0.0029 0.7300 143 GLU E OE2 9246 N N . ALA F 144 ? 0.9830 1.7884 1.1147 -0.2810 -0.1395 0.5987 144 ALA E N 9247 C CA . ALA F 144 ? 1.0053 1.8332 1.1421 -0.2982 -0.1675 0.5965 144 ALA E CA 9248 C C . ALA F 144 ? 1.1119 1.8316 1.1446 -0.3598 -0.1904 0.5463 144 ALA E C 9249 O O . ALA F 144 ? 1.1555 1.7601 1.1148 -0.3375 -0.1701 0.4891 144 ALA E O 9250 C CB . ALA F 144 ? 0.9507 1.7768 1.1166 -0.2118 -0.1431 0.5733 144 ALA E CB 9251 N N . LYS F 145 ? 1.1477 1.9088 1.1721 -0.4358 -0.2310 0.5707 145 LYS E N 9252 C CA . LYS F 145 ? 1.1913 1.8476 1.1054 -0.4999 -0.2509 0.5241 145 LYS E CA 9253 C C . LYS F 145 ? 1.1680 1.8020 1.0624 -0.4686 -0.2549 0.4955 145 LYS E C 9254 O O . LYS F 145 ? 1.1113 1.8418 1.0831 -0.4351 -0.2616 0.5318 145 LYS E O 9255 C CB . LYS F 145 ? 1.2717 1.9782 1.1683 -0.6102 -0.2956 0.5599 145 LYS E CB 9256 C CG . LYS F 145 ? 1.3987 1.9744 1.1593 -0.6862 -0.3101 0.5058 145 LYS E CG 9257 C CD . LYS F 145 ? 1.4786 2.1183 1.2180 -0.8031 -0.3620 0.5396 145 LYS E CD 9258 C CE . LYS F 145 ? 1.4140 2.1733 1.2075 -0.7922 -0.3860 0.5840 145 LYS E CE 9259 N NZ . LYS F 145 ? 1.4942 2.2824 1.2413 -0.8706 -0.4138 0.6132 145 LYS E NZ 9260 N N . VAL F 146 ? 1.2115 1.7157 1.0040 -0.4766 -0.2455 0.4344 146 VAL E N 9261 C CA . VAL F 146 ? 1.1499 1.6252 0.9174 -0.4512 -0.2462 0.4066 146 VAL E CA 9262 C C . VAL F 146 ? 1.2135 1.5627 0.8526 -0.5017 -0.2481 0.3571 146 VAL E C 9263 O O . VAL F 146 ? 1.2027 1.4388 0.7736 -0.4966 -0.2204 0.3171 146 VAL E O 9264 C CB . VAL F 146 ? 1.0610 1.5145 0.8679 -0.3552 -0.2101 0.3784 146 VAL E CB 9265 C CG1 . VAL F 146 ? 1.0738 1.4586 0.8557 -0.3229 -0.1785 0.3499 146 VAL E CG1 9266 C CG2 . VAL F 146 ? 1.0413 1.4344 0.8039 -0.3374 -0.2049 0.3398 146 VAL E CG2 9267 N N . GLN F 147 ? 1.2972 1.6662 0.9011 -0.5469 -0.2769 0.3638 147 GLN E N 9268 C CA . GLN F 147 ? 1.4186 1.6690 0.8895 -0.5989 -0.2776 0.3185 147 GLN E CA 9269 C C . GLN F 147 ? 1.4091 1.6529 0.8623 -0.5699 -0.2757 0.3047 147 GLN E C 9270 O O . GLN F 147 ? 1.3433 1.6929 0.8883 -0.5425 -0.2881 0.3409 147 GLN E O 9271 C CB . GLN F 147 ? 1.5575 1.8269 0.9690 -0.7092 -0.3193 0.3369 147 GLN E CB 9272 C CG . GLN F 147 ? 1.5983 1.8742 1.0270 -0.7515 -0.3223 0.3545 147 GLN E CG 9273 C CD . GLN F 147 ? 1.6859 1.9975 1.0730 -0.8667 -0.3654 0.3764 147 GLN E CD 9274 O OE1 . GLN F 147 ? 1.7343 2.0570 1.0976 -0.8949 -0.3740 0.3774 147 GLN E OE1 9275 N NE2 . GLN F 147 ? 1.7200 2.0409 1.1164 -0.9200 -0.3746 0.3946 147 GLN E NE2 9276 N N . TRP F 148 ? 1.4620 1.5760 0.8093 -0.5692 -0.2503 0.2525 148 TRP E N 9277 C CA . TRP F 148 ? 1.4018 1.5004 0.7258 -0.5418 -0.2425 0.2388 148 TRP E CA 9278 C C . TRP F 148 ? 1.4945 1.5572 0.7394 -0.6070 -0.2559 0.2252 148 TRP E C 9279 O O . TRP F 148 ? 1.6180 1.5744 0.7519 -0.6617 -0.2489 0.1922 148 TRP E O 9280 C CB . TRP F 148 ? 1.3568 1.3479 0.6494 -0.4769 -0.1927 0.1914 148 TRP E CB 9281 C CG . TRP F 148 ? 1.2109 1.2486 0.6131 -0.3962 -0.1728 0.1956 148 TRP E CG 9282 C CD1 . TRP F 148 ? 1.1783 1.1940 0.6040 -0.3649 -0.1525 0.1862 148 TRP E CD1 9283 C CD2 . TRP F 148 ? 1.1410 1.2501 0.6353 -0.3400 -0.1701 0.2086 148 TRP E CD2 9284 N NE1 . TRP F 148 ? 1.0667 1.1399 0.5868 -0.2954 -0.1409 0.1894 148 TRP E NE1 9285 C CE2 . TRP F 148 ? 1.0439 1.1687 0.6070 -0.2814 -0.1505 0.2007 148 TRP E CE2 9286 C CE3 . TRP F 148 ? 1.1354 1.2926 0.6571 -0.3355 -0.1806 0.2270 148 TRP E CE3 9287 C CZ2 . TRP F 148 ? 0.9563 1.1349 0.6077 -0.2253 -0.1421 0.2036 148 TRP E CZ2 9288 C CZ3 . TRP F 148 ? 1.0240 1.2313 0.6417 -0.2761 -0.1685 0.2343 148 TRP E CZ3 9289 C CH2 . TRP F 148 ? 0.9589 1.1723 0.6372 -0.2249 -0.1499 0.2193 148 TRP E CH2 9290 N N . LYS F 149 ? 1.4609 1.6061 0.7589 -0.6000 -0.2711 0.2516 149 LYS E N 9291 C CA . LYS F 149 ? 1.6065 1.7282 0.8318 -0.6530 -0.2816 0.2426 149 LYS E CA 9292 C C . LYS F 149 ? 1.6467 1.7408 0.8510 -0.6060 -0.2603 0.2288 149 LYS E C 9293 O O . LYS F 149 ? 1.5774 1.7561 0.8738 -0.5559 -0.2618 0.2612 149 LYS E O 9294 C CB . LYS F 149 ? 1.5939 1.8507 0.8924 -0.6983 -0.3203 0.2970 149 LYS E CB 9295 C CG . LYS F 149 ? 1.6187 1.9032 0.9212 -0.7640 -0.3421 0.3152 149 LYS E CG 9296 C CD . LYS F 149 ? 1.6219 2.0473 0.9937 -0.8070 -0.3748 0.3758 149 LYS E CD 9297 C CE . LYS F 149 ? 1.6673 2.1272 1.0411 -0.8764 -0.3950 0.4017 149 LYS E CE 9298 N NZ . LYS F 149 ? 1.6823 2.2852 1.1181 -0.9175 -0.4235 0.4672 149 LYS E NZ 9299 N N . VAL F 150 ? 1.7952 1.7658 0.8759 -0.6221 -0.2360 0.1830 150 VAL E N 9300 C CA . VAL F 150 ? 1.8455 1.7843 0.8957 -0.5802 -0.2111 0.1712 150 VAL E CA 9301 C C . VAL F 150 ? 1.9502 1.9015 0.9441 -0.6269 -0.2274 0.1762 150 VAL E C 9302 O O . VAL F 150 ? 2.0863 1.9613 0.9773 -0.6877 -0.2288 0.1483 150 VAL E O 9303 C CB . VAL F 150 ? 1.9425 1.7356 0.8984 -0.5476 -0.1602 0.1207 150 VAL E CB 9304 C CG1 . VAL F 150 ? 1.9768 1.7373 0.8905 -0.5145 -0.1322 0.1117 150 VAL E CG1 9305 C CG2 . VAL F 150 ? 1.8608 1.6563 0.8771 -0.4911 -0.1417 0.1214 150 VAL E CG2 9306 N N . GLN F 155 ? 2.3551 1.9497 1.3310 -0.2538 -0.3093 -0.0985 155 GLN E N 9307 C CA . GLN F 155 ? 2.4388 1.9500 1.3215 -0.2127 -0.2596 -0.1425 155 GLN E CA 9308 C C . GLN F 155 ? 2.3344 1.8064 1.3169 -0.2305 -0.2506 -0.1630 155 GLN E C 9309 O O . GLN F 155 ? 2.4458 1.8202 1.3763 -0.2431 -0.2823 -0.2163 155 GLN E O 9310 C CB . GLN F 155 ? 2.4229 1.9853 1.2894 -0.1568 -0.1756 -0.1052 155 GLN E CB 9311 C CG . GLN F 155 ? 2.5416 2.0237 1.3017 -0.1052 -0.1169 -0.1412 155 GLN E CG 9312 C CD . GLN F 155 ? 2.4945 2.0361 1.2466 -0.0493 -0.0367 -0.0919 155 GLN E CD 9313 O OE1 . GLN F 155 ? 2.3755 2.0172 1.2127 -0.0522 -0.0270 -0.0320 155 GLN E OE1 9314 N NE2 . GLN F 155 ? 2.5839 2.0633 1.2423 0.0031 0.0219 -0.1129 155 GLN E NE2 9315 N N . SER F 156 ? 2.1525 1.6987 1.2760 -0.2299 -0.2089 -0.1196 156 SER E N 9316 C CA . SER F 156 ? 2.0323 1.5636 1.2648 -0.2432 -0.1950 -0.1246 156 SER E CA 9317 C C . SER F 156 ? 2.1318 1.5838 1.3047 -0.2086 -0.1471 -0.1618 156 SER E C 9318 O O . SER F 156 ? 2.2453 1.6192 1.2777 -0.1837 -0.1438 -0.2028 156 SER E O 9319 C CB . SER F 156 ? 1.9405 1.4470 1.2360 -0.2958 -0.2661 -0.1365 156 SER E CB 9320 O OG . SER F 156 ? 1.8145 1.3999 1.1817 -0.3256 -0.3047 -0.0941 156 SER E OG 9321 N N . GLY F 157 ? 2.0837 1.5553 1.3611 -0.2035 -0.1086 -0.1457 157 GLY E N 9322 C CA . GLY F 157 ? 2.1191 1.5266 1.3659 -0.1714 -0.0595 -0.1706 157 GLY E CA 9323 C C . GLY F 157 ? 2.0343 1.5013 1.3207 -0.1315 0.0121 -0.1318 157 GLY E C 9324 O O . GLY F 157 ? 2.0315 1.4687 1.3320 -0.1068 0.0572 -0.1367 157 GLY E O 9325 N N . ASN F 158 ? 1.9019 1.4538 1.2156 -0.1267 0.0195 -0.0897 158 ASN E N 9326 C CA . ASN F 158 ? 1.7443 1.3565 1.1057 -0.0934 0.0769 -0.0477 158 ASN E CA 9327 C C . ASN F 158 ? 1.5312 1.2362 1.0148 -0.1135 0.0647 -0.0041 158 ASN E C 9328 O O . ASN F 158 ? 1.4491 1.2142 0.9637 -0.0958 0.0887 0.0348 158 ASN E O 9329 C CB . ASN F 158 ? 1.8182 1.4335 1.0812 -0.0533 0.1102 -0.0350 158 ASN E CB 9330 C CG . ASN F 158 ? 1.8624 1.4904 1.0580 -0.0685 0.0664 -0.0366 158 ASN E CG 9331 O OD1 . ASN F 158 ? 1.8067 1.4548 1.0493 -0.1115 0.0112 -0.0389 158 ASN E OD1 9332 N ND2 . ASN F 158 ? 1.9592 1.5793 1.0456 -0.0299 0.0933 -0.0296 158 ASN E ND2 9333 N N . SER F 159 ? 1.4144 1.1274 0.9698 -0.1482 0.0280 -0.0088 159 SER E N 9334 C CA . SER F 159 ? 1.2238 1.0114 0.8838 -0.1628 0.0170 0.0262 159 SER E CA 9335 C C . SER F 159 ? 1.1837 0.9762 0.9253 -0.1649 0.0277 0.0292 159 SER E C 9336 O O . SER F 159 ? 1.2572 0.9985 0.9889 -0.1649 0.0340 0.0068 159 SER E O 9337 C CB . SER F 159 ? 1.1531 0.9620 0.8276 -0.1962 -0.0341 0.0311 159 SER E CB 9338 O OG . SER F 159 ? 1.1861 0.9529 0.8709 -0.2232 -0.0676 0.0084 159 SER E OG 9339 N N . GLN F 160 ? 1.0842 0.9355 0.9036 -0.1646 0.0291 0.0573 160 GLN E N 9340 C CA . GLN F 160 ? 1.0149 0.8783 0.9016 -0.1607 0.0391 0.0640 160 GLN E CA 9341 C C . GLN F 160 ? 1.0273 0.9447 0.9785 -0.1660 0.0232 0.0867 160 GLN E C 9342 O O . GLN F 160 ? 1.1038 1.0526 1.0596 -0.1662 0.0153 0.1010 160 GLN E O 9343 C CB . GLN F 160 ? 0.9928 0.8535 0.8813 -0.1323 0.0787 0.0695 160 GLN E CB 9344 C CG . GLN F 160 ? 1.0224 0.8631 0.9417 -0.1262 0.0938 0.0650 160 GLN E CG 9345 C CD . GLN F 160 ? 1.0265 0.8629 0.9451 -0.0984 0.1331 0.0736 160 GLN E CD 9346 O OE1 . GLN F 160 ? 0.9825 0.8329 0.8835 -0.0831 0.1499 0.0859 160 GLN E OE1 9347 N NE2 . GLN F 160 ? 1.0442 0.8662 0.9918 -0.0903 0.1496 0.0747 160 GLN E NE2 9348 N N . GLU F 161 ? 0.9585 0.8846 0.9592 -0.1666 0.0209 0.0921 161 GLU E N 9349 C CA . GLU F 161 ? 0.8911 0.8572 0.9409 -0.1660 0.0083 0.1096 161 GLU E CA 9350 C C . GLU F 161 ? 0.8593 0.8364 0.9456 -0.1465 0.0229 0.1170 161 GLU E C 9351 O O . GLU F 161 ? 0.8767 0.8361 0.9634 -0.1384 0.0405 0.1142 161 GLU E O 9352 C CB . GLU F 161 ? 0.9261 0.8987 0.9934 -0.1901 -0.0199 0.1173 161 GLU E CB 9353 C CG . GLU F 161 ? 0.9517 0.9050 1.0450 -0.2025 -0.0264 0.1188 161 GLU E CG 9354 C CD . GLU F 161 ? 1.0239 0.9828 1.1374 -0.2320 -0.0619 0.1300 161 GLU E CD 9355 O OE1 . GLU F 161 ? 1.0124 0.9775 1.1839 -0.2408 -0.0699 0.1491 161 GLU E OE1 9356 O OE2 . GLU F 161 ? 1.0904 1.0518 1.1669 -0.2454 -0.0820 0.1256 161 GLU E OE2 9357 N N . SER F 162 ? 0.8200 0.8240 0.9330 -0.1357 0.0164 0.1271 162 SER E N 9358 C CA . SER F 162 ? 0.7916 0.8056 0.9232 -0.1106 0.0291 0.1341 162 SER E CA 9359 C C . SER F 162 ? 0.7536 0.7853 0.9105 -0.1030 0.0200 0.1454 162 SER E C 9360 O O . SER F 162 ? 0.6903 0.7297 0.8569 -0.1173 0.0025 0.1476 162 SER E O 9361 C CB . SER F 162 ? 0.7539 0.7706 0.8697 -0.0894 0.0358 0.1273 162 SER E CB 9362 O OG . SER F 162 ? 0.7436 0.7692 0.8627 -0.0907 0.0165 0.1235 162 SER E OG 9363 N N . VAL F 163 ? 0.8013 0.8403 0.9684 -0.0761 0.0360 0.1561 163 VAL E N 9364 C CA . VAL F 163 ? 0.8027 0.8539 0.9892 -0.0588 0.0371 0.1693 163 VAL E CA 9365 C C . VAL F 163 ? 0.7931 0.8400 0.9481 -0.0160 0.0483 0.1613 163 VAL E C 9366 O O . VAL F 163 ? 0.7902 0.8364 0.9222 0.0036 0.0624 0.1600 163 VAL E O 9367 C CB . VAL F 163 ? 0.8313 0.8976 1.0659 -0.0623 0.0493 0.2018 163 VAL E CB 9368 C CG1 . VAL F 163 ? 0.8492 0.9162 1.1111 -0.1059 0.0249 0.2076 163 VAL E CG1 9369 C CG2 . VAL F 163 ? 0.8674 0.9343 1.1089 -0.0487 0.0727 0.2142 163 VAL E CG2 9370 N N . THR F 164 ? 0.8387 0.8796 0.9891 0.0003 0.0403 0.1553 164 THR E N 9371 C CA . THR F 164 ? 0.9020 0.9267 1.0068 0.0450 0.0458 0.1408 164 THR E CA 9372 C C . THR F 164 ? 0.9145 0.9528 1.0177 0.0838 0.0830 0.1686 164 THR E C 9373 O O . THR F 164 ? 0.8952 0.9564 1.0524 0.0734 0.0999 0.2029 164 THR E O 9374 C CB . THR F 164 ? 0.9322 0.9339 1.0318 0.0533 0.0255 0.1224 164 THR E CB 9375 O OG1 . THR F 164 ? 0.8441 0.8590 0.9885 0.0515 0.0390 0.1483 164 THR E OG1 9376 C CG2 . THR F 164 ? 0.9449 0.9396 1.0606 0.0177 -0.0096 0.1048 164 THR E CG2 9377 N N . GLU F 165 ? 0.9563 0.9826 0.9996 0.1298 0.0941 0.1580 165 GLU E N 9378 C CA . GLU F 165 ? 1.0194 1.0608 1.0532 0.1787 0.1359 0.1896 165 GLU E CA 9379 C C . GLU F 165 ? 1.0728 1.1053 1.1175 0.2019 0.1486 0.1989 165 GLU E C 9380 O O . GLU F 165 ? 1.0580 1.0652 1.1026 0.1856 0.1209 0.1723 165 GLU E O 9381 C CB . GLU F 165 ? 1.1415 1.1710 1.0908 0.2281 0.1433 0.1746 165 GLU E CB 9382 C CG . GLU F 165 ? 1.2646 1.2473 1.1330 0.2640 0.1229 0.1325 165 GLU E CG 9383 C CD . GLU F 165 ? 1.3869 1.3583 1.1580 0.3254 0.1355 0.1244 165 GLU E CD 9384 O OE1 . GLU F 165 ? 1.3926 1.3970 1.1637 0.3319 0.1528 0.1491 165 GLU E OE1 9385 O OE2 . GLU F 165 ? 1.4696 1.3963 1.1608 0.3693 0.1279 0.0932 165 GLU E OE2 9386 N N . GLN F 166 ? 1.1312 1.1871 1.1945 0.2423 0.1935 0.2430 166 GLN E N 9387 C CA . GLN F 166 ? 1.1395 1.1905 1.2190 0.2730 0.2157 0.2615 166 GLN E CA 9388 C C . GLN F 166 ? 1.2374 1.2313 1.2183 0.3176 0.2058 0.2115 166 GLN E C 9389 O O . GLN F 166 ? 1.3307 1.3034 1.2204 0.3631 0.2126 0.1902 166 GLN E O 9390 C CB . GLN F 166 ? 1.0915 1.1832 1.2115 0.3171 0.2727 0.3273 166 GLN E CB 9391 C CG . GLN F 166 ? 1.0698 1.1738 1.2499 0.3354 0.2991 0.3671 166 GLN E CG 9392 C CD . GLN F 166 ? 1.0604 1.2183 1.3151 0.3685 0.3536 0.4479 166 GLN E CD 9393 O OE1 . GLN F 166 ? 1.0831 1.2596 1.3138 0.4034 0.3836 0.4700 166 GLN E OE1 9394 N NE2 . GLN F 166 ? 1.0597 1.2484 1.4161 0.3576 0.3663 0.4999 166 GLN E NE2 9395 N N . ASP F 167 ? 1.2174 1.1840 1.2169 0.3037 0.1856 0.1924 167 ASP E N 9396 C CA . ASP F 167 ? 1.3351 1.2349 1.2522 0.3374 0.1655 0.1384 167 ASP E CA 9397 C C . ASP F 167 ? 1.4903 1.3639 1.3278 0.4231 0.2128 0.1437 167 ASP E C 9398 O O . ASP F 167 ? 1.4914 1.4063 1.3673 0.4545 0.2676 0.2019 167 ASP E O 9399 C CB . ASP F 167 ? 1.3146 1.1955 1.2897 0.3052 0.1403 0.1283 167 ASP E CB 9400 C CG . ASP F 167 ? 1.3930 1.1986 1.3015 0.3208 0.1013 0.0655 167 ASP E CG 9401 O OD1 . ASP F 167 ? 1.4100 1.2037 1.3258 0.2761 0.0500 0.0341 167 ASP E OD1 9402 O OD2 . ASP F 167 ? 1.4366 1.1919 1.2883 0.3795 0.1216 0.0492 167 ASP E OD2 9403 N N . SER F 168 ? 1.6359 1.4390 1.3626 0.4627 0.1906 0.0849 168 SER E N 9404 C CA . SER F 168 ? 1.7696 1.5381 1.3858 0.5525 0.2331 0.0801 168 SER E CA 9405 C C . SER F 168 ? 1.8477 1.5582 1.4396 0.6009 0.2547 0.0665 168 SER E C 9406 O O . SER F 168 ? 1.9922 1.6642 1.4816 0.6845 0.2956 0.0605 168 SER E O 9407 C CB . SER F 168 ? 1.8888 1.6088 1.3737 0.5761 0.1934 0.0211 168 SER E CB 9408 O OG . SER F 168 ? 1.9356 1.5888 1.3990 0.5433 0.1232 -0.0454 168 SER E OG 9409 N N . LYS F 169 ? 1.7450 1.4480 1.4272 0.5536 0.2310 0.0640 169 LYS E N 9410 C CA . LYS F 169 ? 1.7747 1.4207 1.4473 0.5972 0.2519 0.0533 169 LYS E CA 9411 C C . LYS F 169 ? 1.6221 1.3291 1.4345 0.5771 0.2913 0.1256 169 LYS E C 9412 O O . LYS F 169 ? 1.6859 1.3639 1.5051 0.6252 0.3300 0.1399 169 LYS E O 9413 C CB . LYS F 169 ? 1.8326 1.3962 1.4806 0.5701 0.1831 -0.0203 169 LYS E CB 9414 C CG . LYS F 169 ? 1.7189 1.3200 1.5005 0.4820 0.1407 -0.0066 169 LYS E CG 9415 C CD . LYS F 169 ? 1.7603 1.2800 1.5324 0.4635 0.0788 -0.0692 169 LYS E CD 9416 C CE . LYS F 169 ? 1.6125 1.1772 1.5196 0.3829 0.0438 -0.0456 169 LYS E CE 9417 N NZ . LYS F 169 ? 1.6474 1.1380 1.5676 0.3652 -0.0143 -0.0957 169 LYS E NZ 9418 N N . ASP F 170 ? 1.4476 1.2361 1.3694 0.5079 0.2797 0.1712 170 ASP E N 9419 C CA . ASP F 170 ? 1.3401 1.1916 1.3972 0.4809 0.3050 0.2419 170 ASP E CA 9420 C C . ASP F 170 ? 1.2047 1.1432 1.3400 0.4438 0.3174 0.3029 170 ASP E C 9421 O O . ASP F 170 ? 1.1238 1.1205 1.3752 0.4169 0.3314 0.3664 170 ASP E O 9422 C CB . ASP F 170 ? 1.3016 1.1466 1.4333 0.4165 0.2551 0.2259 170 ASP E CB 9423 C CG . ASP F 170 ? 1.2534 1.1152 1.3941 0.3428 0.1952 0.1966 170 ASP E CG 9424 O OD1 . ASP F 170 ? 1.2885 1.1331 1.3491 0.3489 0.1802 0.1607 170 ASP E OD1 9425 O OD2 . ASP F 170 ? 1.1691 1.0630 1.3953 0.2825 0.1656 0.2131 170 ASP E OD2 9426 N N . SER F 171 ? 1.2053 1.1497 1.2806 0.4413 0.3079 0.2839 171 SER E N 9427 C CA . SER F 171 ? 1.1318 1.1463 1.2727 0.4131 0.3204 0.3363 171 SER E CA 9428 C C . SER F 171 ? 1.0215 1.0796 1.2718 0.3267 0.2802 0.3565 171 SER E C 9429 O O . SER F 171 ? 0.9790 1.0942 1.3253 0.3056 0.2951 0.4187 171 SER E O 9430 C CB . SER F 171 ? 1.2031 1.2606 1.3889 0.4712 0.3904 0.4133 171 SER E CB 9431 O OG . SER F 171 ? 1.1734 1.2997 1.4573 0.4332 0.3951 0.4722 171 SER E OG 9432 N N . THR F 172 ? 1.0133 1.0435 1.2486 0.2783 0.2273 0.3061 172 THR E N 9433 C CA . THR F 172 ? 0.9540 1.0197 1.2699 0.2029 0.1891 0.3200 172 THR E CA 9434 C C . THR F 172 ? 0.9697 1.0321 1.2501 0.1611 0.1541 0.2843 172 THR E C 9435 O O . THR F 172 ? 0.8779 0.9060 1.0766 0.1822 0.1473 0.2411 172 THR E O 9436 C CB . THR F 172 ? 0.9174 0.9668 1.2646 0.1789 0.1615 0.3065 172 THR E CB 9437 O OG1 . THR F 172 ? 0.9647 0.9543 1.2348 0.1920 0.1375 0.2435 172 THR E OG1 9438 C CG2 . THR F 172 ? 0.9121 0.9715 1.3146 0.2156 0.1984 0.3519 172 THR E CG2 9439 N N . TYR F 173 ? 0.9050 1.0013 1.2452 0.1036 0.1311 0.3038 173 TYR E N 9440 C CA . TYR F 173 ? 0.8504 0.9418 1.1619 0.0649 0.1027 0.2739 173 TYR E CA 9441 C C . TYR F 173 ? 0.8513 0.9354 1.1691 0.0195 0.0622 0.2503 173 TYR E C 9442 O O . TYR F 173 ? 0.8457 0.9391 1.2065 0.0086 0.0534 0.2662 173 TYR E O 9443 C CB . TYR F 173 ? 0.7784 0.9019 1.1392 0.0382 0.1071 0.3080 173 TYR E CB 9444 C CG . TYR F 173 ? 0.8051 0.9443 1.1740 0.0820 0.1495 0.3415 173 TYR E CG 9445 C CD1 . TYR F 173 ? 0.8119 0.9415 1.1303 0.0998 0.1609 0.3247 173 TYR E CD1 9446 C CD2 . TYR F 173 ? 0.8193 0.9889 1.2539 0.1083 0.1811 0.3980 173 TYR E CD2 9447 C CE1 . TYR F 173 ? 0.8553 1.0058 1.1839 0.1434 0.2029 0.3627 173 TYR E CE1 9448 C CE2 . TYR F 173 ? 0.8873 1.0782 1.3362 0.1535 0.2257 0.4386 173 TYR E CE2 9449 C CZ . TYR F 173 ? 0.9110 1.0925 1.3044 0.1714 0.2365 0.4205 173 TYR E CZ 9450 O OH . TYR F 173 ? 0.9933 1.2021 1.4036 0.2200 0.2841 0.4681 173 TYR E OH 9451 N N . SER F 174 ? 0.8559 0.9275 1.1356 -0.0034 0.0413 0.2188 174 SER E N 9452 C CA . SER F 174 ? 0.8318 0.9030 1.1179 -0.0425 0.0092 0.2048 174 SER E CA 9453 C C . SER F 174 ? 0.8226 0.8975 1.0901 -0.0733 -0.0006 0.1959 174 SER E C 9454 O O . SER F 174 ? 0.8324 0.8977 1.0689 -0.0602 0.0121 0.1845 174 SER E O 9455 C CB . SER F 174 ? 0.8510 0.8923 1.1095 -0.0280 -0.0063 0.1726 174 SER E CB 9456 O OG . SER F 174 ? 0.8689 0.8954 1.1425 0.0003 0.0008 0.1761 174 SER E OG 9457 N N . LEU F 175 ? 0.7319 1.0353 1.0687 -0.0508 0.0865 0.2742 175 LEU E N 9458 C CA . LEU F 175 ? 0.8114 1.0724 1.0598 -0.0721 0.0586 0.2540 175 LEU E CA 9459 C C . LEU F 175 ? 0.9029 1.1341 1.1272 -0.0391 0.0649 0.2634 175 LEU E C 9460 O O . LEU F 175 ? 0.9232 1.1979 1.1964 -0.0046 0.0765 0.2967 175 LEU E O 9461 C CB . LEU F 175 ? 0.8258 1.1528 1.0540 -0.1037 0.0215 0.2633 175 LEU E CB 9462 C CG . LEU F 175 ? 0.8524 1.1418 0.9890 -0.1370 -0.0094 0.2374 175 LEU E CG 9463 C CD1 . LEU F 175 ? 0.9210 1.2589 1.0472 -0.1798 -0.0393 0.2334 175 LEU E CD1 9464 C CD2 . LEU F 175 ? 0.8438 1.1433 0.9441 -0.1218 -0.0211 0.2534 175 LEU E CD2 9465 N N . SER F 176 ? 0.9240 1.0803 1.0762 -0.0507 0.0576 0.2339 176 SER E N 9466 C CA . SER F 176 ? 0.9009 1.0211 1.0233 -0.0239 0.0650 0.2370 176 SER E CA 9467 C C . SER F 176 ? 0.9565 1.0387 0.9948 -0.0524 0.0410 0.2107 176 SER E C 9468 O O . SER F 176 ? 0.9501 0.9669 0.9504 -0.0768 0.0362 0.1751 176 SER E O 9469 C CB . SER F 176 ? 0.8586 0.9040 0.9981 0.0043 0.0973 0.2252 176 SER E CB 9470 O OG . SER F 176 ? 0.8869 0.8907 0.9943 0.0271 0.1046 0.2238 176 SER E OG 9471 N N . SER F 177 ? 0.9924 1.1146 1.0026 -0.0513 0.0258 0.2282 177 SER E N 9472 C CA . SER F 177 ? 0.9961 1.0859 0.9251 -0.0794 0.0058 0.2029 177 SER E CA 9473 C C . SER F 177 ? 0.9585 1.0088 0.8564 -0.0547 0.0214 0.2024 177 SER E C 9474 O O . SER F 177 ? 0.8900 0.9756 0.8196 -0.0225 0.0334 0.2356 177 SER E O 9475 C CB . SER F 177 ? 1.0411 1.2061 0.9468 -0.1100 -0.0280 0.2185 177 SER E CB 9476 O OG . SER F 177 ? 1.1080 1.2386 0.9324 -0.1413 -0.0460 0.1901 177 SER E OG 9477 N N . THR F 178 ? 1.0243 1.0010 0.8633 -0.0707 0.0216 0.1645 178 THR E N 9478 C CA . THR F 178 ? 1.0415 0.9735 0.8490 -0.0506 0.0393 0.1579 178 THR E CA 9479 C C . THR F 178 ? 1.0867 1.0088 0.8150 -0.0832 0.0223 0.1363 178 THR E C 9480 O O . THR F 178 ? 1.0863 0.9635 0.7769 -0.1149 0.0112 0.0989 178 THR E O 9481 C CB . THR F 178 ? 1.0135 0.8521 0.8331 -0.0328 0.0647 0.1301 178 THR E CB 9482 O OG1 . THR F 178 ? 1.0029 0.8484 0.8915 -0.0014 0.0837 0.1512 178 THR E OG1 9483 C CG2 . THR F 178 ? 1.0163 0.8084 0.8044 -0.0141 0.0840 0.1210 178 THR E CG2 9484 N N . LEU F 179 ? 1.1274 1.0908 0.8308 -0.0768 0.0202 0.1604 179 LEU E N 9485 C CA . LEU F 179 ? 1.2017 1.1551 0.8246 -0.1075 0.0085 0.1412 179 LEU E CA 9486 C C . LEU F 179 ? 1.2175 1.0956 0.8118 -0.0910 0.0380 0.1165 179 LEU E C 9487 O O . LEU F 179 ? 1.2029 1.0877 0.8129 -0.0585 0.0575 0.1404 179 LEU E O 9488 C CB . LEU F 179 ? 1.2463 1.2846 0.8504 -0.1163 -0.0124 0.1815 179 LEU E CB 9489 C CG . LEU F 179 ? 1.3148 1.3508 0.8281 -0.1551 -0.0275 0.1645 179 LEU E CG 9490 C CD1 . LEU F 179 ? 1.3671 1.3966 0.8450 -0.2001 -0.0528 0.1330 179 LEU E CD1 9491 C CD2 . LEU F 179 ? 1.3272 1.4422 0.8252 -0.1592 -0.0462 0.2110 179 LEU E CD2 9492 N N . THR F 180 ? 1.2422 1.0491 0.7987 -0.1135 0.0415 0.0689 180 THR E N 9493 C CA . THR F 180 ? 1.2279 0.9568 0.7666 -0.0991 0.0714 0.0405 180 THR E CA 9494 C C . THR F 180 ? 1.3084 1.0222 0.7665 -0.1302 0.0709 0.0148 180 THR E C 9495 O O . THR F 180 ? 1.3213 1.0229 0.7381 -0.1698 0.0531 -0.0154 180 THR E O 9496 C CB . THR F 180 ? 1.1812 0.8273 0.7484 -0.0981 0.0809 0.0033 180 THR E CB 9497 O OG1 . THR F 180 ? 1.0723 0.7259 0.7089 -0.0704 0.0851 0.0259 180 THR E OG1 9498 C CG2 . THR F 180 ? 1.2168 0.7830 0.7734 -0.0832 0.1116 -0.0256 180 THR E CG2 9499 N N . LEU F 181 ? 1.3559 1.0697 0.7908 -0.1135 0.0915 0.0264 181 LEU E N 9500 C CA . LEU F 181 ? 1.4332 1.1252 0.7891 -0.1422 0.0986 -0.0003 181 LEU E CA 9501 C C . LEU F 181 ? 1.4391 1.0648 0.7967 -0.1159 0.1389 -0.0184 181 LEU E C 9502 O O . LEU F 181 ? 1.3883 1.0030 0.8037 -0.0734 0.1572 0.0020 181 LEU E O 9503 C CB . LEU F 181 ? 1.4971 1.2685 0.8040 -0.1605 0.0786 0.0358 181 LEU E CB 9504 C CG . LEU F 181 ? 1.4843 1.3382 0.8007 -0.1799 0.0380 0.0682 181 LEU E CG 9505 C CD1 . LEU F 181 ? 1.4245 1.3389 0.8139 -0.1410 0.0345 0.1230 181 LEU E CD1 9506 C CD2 . LEU F 181 ? 1.5472 1.4450 0.7816 -0.2236 0.0148 0.0741 181 LEU E CD2 9507 N N . SER F 182 ? 1.4968 1.0778 0.7924 -0.1418 0.1540 -0.0576 182 SER E N 9508 C CA . SER F 182 ? 1.5120 1.0330 0.8051 -0.1205 0.1944 -0.0761 182 SER E CA 9509 C C . SER F 182 ? 1.5692 1.1396 0.8423 -0.1027 0.2032 -0.0337 182 SER E C 9510 O O . SER F 182 ? 1.5945 1.2407 0.8405 -0.1173 0.1764 0.0029 182 SER E O 9511 C CB . SER F 182 ? 1.5662 1.0268 0.8003 -0.1565 0.2107 -0.1328 182 SER E CB 9512 O OG . SER F 182 ? 1.6447 1.1491 0.7938 -0.1970 0.1974 -0.1311 182 SER E OG 9513 N N . LYS F 183 ? 1.5695 1.0967 0.8590 -0.0721 0.2392 -0.0371 183 LYS E N 9514 C CA . LYS F 183 ? 1.5673 1.1339 0.8402 -0.0537 0.2500 0.0023 183 LYS E CA 9515 C C . LYS F 183 ? 1.6724 1.2702 0.8483 -0.0976 0.2427 0.0005 183 LYS E C 9516 O O . LYS F 183 ? 1.6876 1.3538 0.8414 -0.0999 0.2251 0.0467 183 LYS E O 9517 C CB . LYS F 183 ? 1.5619 1.0658 0.8652 -0.0172 0.2929 -0.0094 183 LYS E CB 9518 C CG . LYS F 183 ? 1.5619 1.1008 0.8494 0.0027 0.3063 0.0305 183 LYS E CG 9519 C CD . LYS F 183 ? 1.5196 0.9913 0.8347 0.0358 0.3503 0.0138 183 LYS E CD 9520 C CE . LYS F 183 ? 1.5298 1.0380 0.8360 0.0584 0.3620 0.0574 183 LYS E CE 9521 N NZ . LYS F 183 ? 1.6725 1.2145 0.8828 0.0172 0.3571 0.0614 183 LYS E NZ 9522 N N . ALA F 184 ? 1.7398 1.2860 0.8592 -0.1342 0.2556 -0.0529 184 ALA E N 9523 C CA . ALA F 184 ? 1.8455 1.4109 0.8643 -0.1818 0.2521 -0.0627 184 ALA E CA 9524 C C . ALA F 184 ? 1.9168 1.5580 0.9034 -0.2155 0.2037 -0.0354 184 ALA E C 9525 O O . ALA F 184 ? 1.9757 1.6728 0.9050 -0.2373 0.1868 -0.0028 184 ALA E O 9526 C CB . ALA F 184 ? 1.8852 1.3732 0.8604 -0.2128 0.2798 -0.1312 184 ALA E CB 9527 N N . ASP F 185 ? 1.9334 1.5759 0.9576 -0.2211 0.1803 -0.0475 185 ASP E N 9528 C CA . ASP F 185 ? 1.9602 1.6723 0.9626 -0.2523 0.1343 -0.0240 185 ASP E CA 9529 C C . ASP F 185 ? 1.8844 1.6788 0.9333 -0.2253 0.1097 0.0444 185 ASP E C 9530 O O . ASP F 185 ? 1.9127 1.7773 0.9321 -0.2512 0.0739 0.0775 185 ASP E O 9531 C CB . ASP F 185 ? 1.9763 1.6657 1.0142 -0.2625 0.1179 -0.0541 185 ASP E CB 9532 C CG . ASP F 185 ? 2.0467 1.8004 1.0526 -0.3017 0.0727 -0.0387 185 ASP E CG 9533 O OD1 . ASP F 185 ? 2.0221 1.7893 1.0785 -0.2985 0.0508 -0.0364 185 ASP E OD1 9534 O OD2 . ASP F 185 ? 2.1106 1.9006 1.0395 -0.3378 0.0586 -0.0284 185 ASP E OD2 9535 N N . TYR F 186 ? 1.7760 1.5606 0.9010 -0.1737 0.1290 0.0654 186 TYR E N 9536 C CA . TYR F 186 ? 1.6395 1.4965 0.8207 -0.1431 0.1112 0.1281 186 TYR E CA 9537 C C . TYR F 186 ? 1.6625 1.5603 0.7966 -0.1481 0.1102 0.1660 186 TYR E C 9538 O O . TYR F 186 ? 1.6302 1.6061 0.7688 -0.1550 0.0774 0.2159 186 TYR E O 9539 C CB . TYR F 186 ? 1.4792 1.3074 0.7539 -0.0879 0.1347 0.1358 186 TYR E CB 9540 C CG . TYR F 186 ? 1.3660 1.2630 0.7058 -0.0527 0.1229 0.1977 186 TYR E CG 9541 C CD1 . TYR F 186 ? 1.3086 1.2669 0.7010 -0.0512 0.0923 0.2267 186 TYR E CD1 9542 C CD2 . TYR F 186 ? 1.3153 1.2154 0.6679 -0.0211 0.1436 0.2263 186 TYR E CD2 9543 C CE1 . TYR F 186 ? 1.2209 1.2417 0.6810 -0.0190 0.0837 0.2814 186 TYR E CE1 9544 C CE2 . TYR F 186 ? 1.2389 1.2010 0.6568 0.0113 0.1330 0.2825 186 TYR E CE2 9545 C CZ . TYR F 186 ? 1.2058 1.2279 0.6792 0.0125 0.1036 0.3093 186 TYR E CZ 9546 O OH . TYR F 186 ? 1.1770 1.2604 0.7230 0.0448 0.0952 0.3636 186 TYR E OH 9547 N N . GLU F 187 ? 1.7226 1.5670 0.8135 -0.1462 0.1457 0.1427 187 GLU E N 9548 C CA . GLU F 187 ? 1.8088 1.6835 0.8528 -0.1506 0.1489 0.1771 187 GLU E CA 9549 C C . GLU F 187 ? 1.9179 1.8140 0.8522 -0.2116 0.1295 0.1703 187 GLU E C 9550 O O . GLU F 187 ? 1.9739 1.8837 0.8487 -0.2265 0.1342 0.1900 187 GLU E O 9551 C CB . GLU F 187 ? 1.8435 1.6520 0.8883 -0.1228 0.1976 0.1558 187 GLU E CB 9552 C CG . GLU F 187 ? 1.7756 1.5689 0.9244 -0.0618 0.2155 0.1727 187 GLU E CG 9553 C CD . GLU F 187 ? 1.7934 1.5241 0.9436 -0.0350 0.2620 0.1548 187 GLU E CD 9554 O OE1 . GLU F 187 ? 1.8747 1.5637 0.9491 -0.0644 0.2849 0.1192 187 GLU E OE1 9555 O OE2 . GLU F 187 ? 1.7304 1.4529 0.9580 0.0145 0.2768 0.1756 187 GLU E OE2 9556 N N . LYS F 188 ? 1.9480 1.8458 0.8535 -0.2488 0.1072 0.1427 188 LYS E N 9557 C CA . LYS F 188 ? 2.0293 1.9496 0.8313 -0.3100 0.0846 0.1364 188 LYS E CA 9558 C C . LYS F 188 ? 2.0056 2.0212 0.8177 -0.3237 0.0316 0.1976 188 LYS E C 9559 O O . LYS F 188 ? 2.0892 2.1401 0.8364 -0.3646 0.0061 0.2115 188 LYS E O 9560 C CB . LYS F 188 ? 2.0770 1.9470 0.8402 -0.3458 0.0884 0.0729 188 LYS E CB 9561 C CG . LYS F 188 ? 2.1958 2.0670 0.8535 -0.4061 0.0786 0.0507 188 LYS E CG 9562 C CD . LYS F 188 ? 2.2260 2.0392 0.8639 -0.4341 0.0887 -0.0169 188 LYS E CD 9563 C CE . LYS F 188 ? 2.1624 2.0031 0.8382 -0.4394 0.0533 -0.0133 188 LYS E CE 9564 N NZ . LYS F 188 ? 2.1631 1.9493 0.8278 -0.4662 0.0600 -0.0765 188 LYS E NZ 9565 N N . HIS F 189 ? 1.8994 1.9548 0.8136 -0.2839 0.0156 0.2312 189 HIS E N 9566 C CA . HIS F 189 ? 1.8648 2.0125 0.8117 -0.2894 -0.0321 0.2918 189 HIS E CA 9567 C C . HIS F 189 ? 1.7875 1.9752 0.8252 -0.2366 -0.0297 0.3473 189 HIS E C 9568 O O . HIS F 189 ? 1.7437 1.8858 0.8291 -0.1925 0.0077 0.3350 189 HIS E O 9569 C CB . HIS F 189 ? 1.7954 1.9635 0.7832 -0.2990 -0.0583 0.2802 189 HIS E CB 9570 C CG . HIS F 189 ? 1.8089 1.9213 0.7291 -0.3392 -0.0521 0.2166 189 HIS E CG 9571 N ND1 . HIS F 189 ? 1.7571 1.7871 0.6902 -0.3234 -0.0146 0.1599 189 HIS E ND1 9572 C CD2 . HIS F 189 ? 1.8768 2.0031 0.7189 -0.3953 -0.0793 0.2013 189 HIS E CD2 9573 C CE1 . HIS F 189 ? 1.8282 1.8241 0.6978 -0.3670 -0.0184 0.1120 189 HIS E CE1 9574 N NE2 . HIS F 189 ? 1.8991 1.9519 0.7104 -0.4112 -0.0565 0.1349 189 HIS E NE2 9575 N N . LYS F 190 ? 1.7666 2.0387 0.8312 -0.2416 -0.0700 0.4087 190 LYS E N 9576 C CA . LYS F 190 ? 1.6911 2.0069 0.8443 -0.1945 -0.0705 0.4646 190 LYS E CA 9577 C C . LYS F 190 ? 1.6149 1.9998 0.8690 -0.1771 -0.1014 0.5018 190 LYS E C 9578 O O . LYS F 190 ? 1.5636 1.9867 0.9082 -0.1355 -0.1012 0.5455 190 LYS E O 9579 C CB . LYS F 190 ? 1.7674 2.1111 0.8873 -0.2067 -0.0850 0.5007 190 LYS E CB 9580 C CG . LYS F 190 ? 1.8315 2.1095 0.8583 -0.2207 -0.0505 0.4675 190 LYS E CG 9581 C CD . LYS F 190 ? 1.8761 2.1793 0.8883 -0.2252 -0.0636 0.5045 190 LYS E CD 9582 C CE . LYS F 190 ? 1.9108 2.1484 0.8373 -0.2349 -0.0243 0.4726 190 LYS E CE 9583 N NZ . LYS F 190 ? 1.9569 2.1440 0.7873 -0.2807 -0.0109 0.4112 190 LYS E NZ 9584 N N . VAL F 191 ? 1.6236 2.0238 0.8643 -0.2093 -0.1262 0.4831 191 VAL E N 9585 C CA . VAL F 191 ? 1.5660 2.0348 0.8973 -0.1996 -0.1564 0.5167 191 VAL E CA 9586 C C . VAL F 191 ? 1.5357 1.9696 0.9114 -0.1879 -0.1415 0.4726 191 VAL E C 9587 O O . VAL F 191 ? 1.5703 1.9568 0.8824 -0.2187 -0.1378 0.4217 191 VAL E O 9588 C CB . VAL F 191 ? 1.5870 2.1135 0.8919 -0.2462 -0.2046 0.5358 191 VAL E CB 9589 C CG1 . VAL F 191 ? 1.5363 2.1352 0.9439 -0.2352 -0.2330 0.5708 191 VAL E CG1 9590 C CG2 . VAL F 191 ? 1.5989 2.1449 0.8787 -0.2565 -0.2174 0.5654 191 VAL E CG2 9591 N N . TYR F 192 ? 1.4647 1.9217 0.9501 -0.1451 -0.1331 0.4925 192 TYR E N 9592 C CA . TYR F 192 ? 1.3958 1.8225 0.9286 -0.1337 -0.1194 0.4559 192 TYR E CA 9593 C C . TYR F 192 ? 1.3294 1.8276 0.9681 -0.1164 -0.1374 0.4938 192 TYR E C 9594 O O . TYR F 192 ? 1.3016 1.8355 1.0196 -0.0786 -0.1303 0.5348 192 TYR E O 9595 C CB . TYR F 192 ? 1.3571 1.7044 0.9107 -0.0942 -0.0723 0.4221 192 TYR E CB 9596 C CG . TYR F 192 ? 1.4424 1.7129 0.9023 -0.1105 -0.0497 0.3774 192 TYR E CG 9597 C CD1 . TYR F 192 ? 1.4711 1.7291 0.8953 -0.1002 -0.0342 0.3922 192 TYR E CD1 9598 C CD2 . TYR F 192 ? 1.4918 1.7022 0.9019 -0.1374 -0.0433 0.3202 192 TYR E CD2 9599 C CE1 . TYR F 192 ? 1.5327 1.7206 0.8744 -0.1162 -0.0100 0.3493 192 TYR E CE1 9600 C CE2 . TYR F 192 ? 1.5514 1.6912 0.8839 -0.1524 -0.0202 0.2774 192 TYR E CE2 9601 C CZ . TYR F 192 ? 1.5720 1.7010 0.8706 -0.1418 -0.0022 0.2913 192 TYR E CZ 9602 O OH . TYR F 192 ? 1.6234 1.6822 0.8478 -0.1578 0.0244 0.2467 192 TYR E OH 9603 N N . ALA F 193 ? 1.3200 1.8376 0.9623 -0.1444 -0.1589 0.4787 193 ALA E N 9604 C CA . ALA F 193 ? 1.2434 1.8318 0.9833 -0.1345 -0.1765 0.5120 193 ALA E CA 9605 C C . ALA F 193 ? 1.2744 1.8324 1.0490 -0.1332 -0.1630 0.4729 193 ALA E C 9606 O O . ALA F 193 ? 1.2784 1.7674 0.9931 -0.1498 -0.1509 0.4214 193 ALA E O 9607 C CB . ALA F 193 ? 1.2026 1.8683 0.9250 -0.1744 -0.2254 0.5473 193 ALA E CB 9608 N N . CYS F 194 ? 1.2966 1.9073 1.1710 -0.1148 -0.1652 0.4985 194 CYS E N 9609 C CA . CYS F 194 ? 1.2713 1.8632 1.1852 -0.1159 -0.1540 0.4679 194 CYS E CA 9610 C C . CYS F 194 ? 1.2907 1.9686 1.2804 -0.1263 -0.1794 0.5005 194 CYS E C 9611 O O . CYS F 194 ? 1.2870 2.0135 1.3737 -0.0953 -0.1710 0.5369 194 CYS E O 9612 C CB . CYS F 194 ? 1.2320 1.7734 1.2015 -0.0713 -0.1103 0.4539 194 CYS E CB 9613 S SG . CYS F 194 ? 1.8428 2.3637 1.8647 -0.0742 -0.0956 0.4217 194 CYS E SG 9614 N N . GLU F 195 ? 1.3110 2.0072 1.2594 -0.1702 -0.2097 0.4869 195 GLU E N 9615 C CA . GLU F 195 ? 1.2418 2.0208 1.2584 -0.1847 -0.2365 0.5170 195 GLU E CA 9616 C C . GLU F 195 ? 1.1378 1.9016 1.2003 -0.1862 -0.2201 0.4869 195 GLU E C 9617 O O . GLU F 195 ? 1.1345 1.8351 1.1365 -0.2065 -0.2137 0.4390 195 GLU E O 9618 C CB . GLU F 195 ? 1.3038 2.1203 1.2525 -0.2340 -0.2830 0.5260 195 GLU E CB 9619 C CG . GLU F 195 ? 1.3084 2.2187 1.3315 -0.2489 -0.3157 0.5661 195 GLU E CG 9620 C CD . GLU F 195 ? 1.3960 2.3480 1.3530 -0.2950 -0.3649 0.5858 195 GLU E CD 9621 O OE1 . GLU F 195 ? 1.4613 2.3645 1.3116 -0.3295 -0.3740 0.5480 195 GLU E OE1 9622 O OE2 . GLU F 195 ? 1.4055 2.4383 1.4194 -0.2979 -0.3949 0.6395 195 GLU E OE2 9623 N N . VAL F 196 ? 1.0506 1.8722 1.2222 -0.1660 -0.2128 0.5154 196 VAL E N 9624 C CA . VAL F 196 ? 1.0003 1.8131 1.2221 -0.1678 -0.1941 0.4903 196 VAL E CA 9625 C C . VAL F 196 ? 1.0246 1.9210 1.3033 -0.1929 -0.2225 0.5138 196 VAL E C 9626 O O . VAL F 196 ? 1.0403 2.0136 1.3817 -0.1855 -0.2414 0.5625 196 VAL E O 9627 C CB . VAL F 196 ? 0.9051 1.7034 1.2124 -0.1215 -0.1501 0.4948 196 VAL E CB 9628 C CG1 . VAL F 196 ? 0.8259 1.6198 1.1845 -0.1282 -0.1306 0.4710 196 VAL E CG1 9629 C CG2 . VAL F 196 ? 0.9242 1.6362 1.1777 -0.0973 -0.1218 0.4698 196 VAL E CG2 9630 N N . THR F 197 ? 1.0031 1.8836 1.2617 -0.2238 -0.2267 0.4802 197 THR E N 9631 C CA . THR F 197 ? 0.9978 1.9524 1.3145 -0.2479 -0.2489 0.4974 197 THR E CA 9632 C C . THR F 197 ? 0.9773 1.9193 1.3561 -0.2428 -0.2164 0.4733 197 THR E C 9633 O O . THR F 197 ? 0.9660 1.8343 1.2919 -0.2529 -0.1992 0.4282 197 THR E O 9634 C CB . THR F 197 ? 1.0508 2.0088 1.2821 -0.2988 -0.2906 0.4823 197 THR E CB 9635 O OG1 . THR F 197 ? 1.1117 2.0777 1.2778 -0.3073 -0.3189 0.5028 197 THR E OG1 9636 C CG2 . THR F 197 ? 1.0590 2.0981 1.3562 -0.3229 -0.3149 0.5038 197 THR E CG2 9637 N N . HIS F 198 ? 0.9463 1.9592 1.4388 -0.2287 -0.2077 0.5038 198 HIS E N 9638 C CA . HIS F 198 ? 0.8643 1.8697 1.4241 -0.2222 -0.1710 0.4837 198 HIS E CA 9639 C C . HIS F 198 ? 0.8028 1.9013 1.4662 -0.2322 -0.1806 0.5126 198 HIS E C 9640 O O . HIS F 198 ? 0.8632 2.0334 1.5633 -0.2338 -0.2125 0.5554 198 HIS E O 9641 C CB . HIS F 198 ? 0.7950 1.7658 1.4027 -0.1754 -0.1255 0.4847 198 HIS E CB 9642 C CG . HIS F 198 ? 0.7262 1.6676 1.3782 -0.1720 -0.0839 0.4556 198 HIS E CG 9643 N ND1 . HIS F 198 ? 0.6772 1.6718 1.4479 -0.1526 -0.0561 0.4746 198 HIS E ND1 9644 C CD2 . HIS F 198 ? 0.7053 1.5681 1.2983 -0.1879 -0.0654 0.4091 198 HIS E CD2 9645 C CE1 . HIS F 198 ? 0.6333 1.5823 1.4100 -0.1581 -0.0204 0.4394 198 HIS E CE1 9646 N NE2 . HIS F 198 ? 0.6636 1.5327 1.3329 -0.1802 -0.0273 0.4010 198 HIS E NE2 9647 N N . GLN F 199 ? 0.7581 1.8549 1.4689 -0.2410 -0.1534 0.4896 199 GLN E N 9648 C CA . GLN F 199 ? 0.7600 1.9421 1.5752 -0.2516 -0.1565 0.5120 199 GLN E CA 9649 C C . GLN F 199 ? 0.7666 1.9958 1.6909 -0.2084 -0.1400 0.5528 199 GLN E C 9650 O O . GLN F 199 ? 0.7952 2.0739 1.7673 -0.2081 -0.1602 0.5813 199 GLN E O 9651 C CB . GLN F 199 ? 0.7151 1.8737 1.5517 -0.2694 -0.1232 0.4740 199 GLN E CB 9652 C CG . GLN F 199 ? 0.7131 1.9189 1.6300 -0.2724 -0.1174 0.4813 199 GLN E CG 9653 C CD . GLN F 199 ? 0.7297 1.8975 1.6471 -0.2915 -0.0840 0.4373 199 GLN E CD 9654 O OE1 . GLN F 199 ? 0.7724 1.8817 1.6246 -0.3099 -0.0720 0.4037 199 GLN E OE1 9655 N NE2 . GLN F 199 ? 0.7544 1.9525 1.7439 -0.2890 -0.0693 0.4366 199 GLN E NE2 9656 N N . GLY F 200 ? 0.7568 1.9449 1.7016 -0.1694 -0.1019 0.5487 200 GLY E N 9657 C CA . GLY F 200 ? 0.8059 2.0015 1.8238 -0.1243 -0.0837 0.5764 200 GLY E CA 9658 C C . GLY F 200 ? 0.8748 2.1096 1.8825 -0.1162 -0.1233 0.6233 200 GLY E C 9659 O O . GLY F 200 ? 0.8912 2.1426 1.9578 -0.0888 -0.1207 0.6539 200 GLY E O 9660 N N . LEU F 201 ? 0.9132 2.1574 1.8390 -0.1435 -0.1611 0.6265 201 LEU E N 9661 C CA . LEU F 201 ? 0.9337 2.2083 1.8277 -0.1433 -0.2025 0.6667 201 LEU E CA 9662 C C . LEU F 201 ? 0.9551 2.2816 1.8439 -0.1780 -0.2478 0.6885 201 LEU E C 9663 O O . LEU F 201 ? 0.9561 2.2859 1.7828 -0.2194 -0.2739 0.6680 201 LEU E O 9664 C CB . LEU F 201 ? 1.0006 2.2039 1.7615 -0.1518 -0.2117 0.6413 201 LEU E CB 9665 C CG . LEU F 201 ? 1.0310 2.1564 1.7731 -0.1158 -0.1661 0.6155 201 LEU E CG 9666 C CD1 . LEU F 201 ? 1.0767 2.1265 1.6859 -0.1244 -0.1759 0.5906 201 LEU E CD1 9667 C CD2 . LEU F 201 ? 1.0219 2.1843 1.8669 -0.0695 -0.1465 0.6567 201 LEU E CD2 9668 N N . SER F 202 ? 0.9728 2.3333 1.9243 -0.1622 -0.2566 0.7289 202 SER E N 9669 C CA . SER F 202 ? 0.9853 2.3938 1.9375 -0.1927 -0.2998 0.7560 202 SER E CA 9670 C C . SER F 202 ? 0.9995 2.4073 1.8429 -0.2219 -0.3458 0.7683 202 SER E C 9671 O O . SER F 202 ? 1.0132 2.4443 1.8184 -0.2585 -0.3839 0.7774 202 SER E O 9672 C CB . SER F 202 ? 0.9569 2.3971 2.0080 -0.1681 -0.2965 0.7970 202 SER E CB 9673 O OG . SER F 202 ? 0.8920 2.3161 2.0316 -0.1364 -0.2482 0.7797 202 SER E OG 9674 N N . SER F 203 ? 0.9825 2.3560 1.7716 -0.2053 -0.3393 0.7656 203 SER E N 9675 C CA . SER F 203 ? 1.0530 2.4087 1.7252 -0.2305 -0.3752 0.7692 203 SER E CA 9676 C C . SER F 203 ? 1.0639 2.3641 1.6636 -0.2172 -0.3578 0.7388 203 SER E C 9677 O O . SER F 203 ? 1.0431 2.3147 1.6922 -0.1777 -0.3147 0.7290 203 SER E O 9678 C CB . SER F 203 ? 1.1074 2.4859 1.7945 -0.2227 -0.3940 0.8176 203 SER E CB 9679 O OG . SER F 203 ? 1.0779 2.4520 1.8435 -0.1756 -0.3606 0.8361 203 SER E OG 9680 N N . PRO F 204 ? 1.1311 2.3827 1.5970 -0.2495 -0.3782 0.7113 204 PRO E N 9681 C CA . PRO F 204 ? 1.1663 2.3217 1.5380 -0.2378 -0.3478 0.6667 204 PRO E CA 9682 C C . PRO F 204 ? 1.1954 2.3378 1.5816 -0.1979 -0.3301 0.6921 204 PRO E C 9683 O O . PRO F 204 ? 1.2887 2.4341 1.6121 -0.2084 -0.3550 0.7138 204 PRO E O 9684 C CB . PRO F 204 ? 1.2310 2.3562 1.4695 -0.2846 -0.3813 0.6445 204 PRO E CB 9685 C CG . PRO F 204 ? 1.2288 2.4183 1.4914 -0.3224 -0.4192 0.6582 204 PRO E CG 9686 C CD . PRO F 204 ? 1.1908 2.4559 1.5838 -0.2994 -0.4206 0.7098 204 PRO E CD 9687 N N . VAL F 205 ? 1.1116 2.2387 1.5775 -0.1545 -0.2870 0.6889 205 VAL E N 9688 C CA . VAL F 205 ? 1.0584 2.1755 1.5520 -0.1130 -0.2673 0.7140 205 VAL E CA 9689 C C . VAL F 205 ? 1.0526 2.0843 1.4280 -0.1117 -0.2543 0.6820 205 VAL E C 9690 O O . VAL F 205 ? 0.9910 1.9483 1.3105 -0.1150 -0.2292 0.6298 205 VAL E O 9691 C CB . VAL F 205 ? 0.9922 2.1068 1.5970 -0.0684 -0.2208 0.7122 205 VAL E CB 9692 C CG1 . VAL F 205 ? 0.9909 2.0828 1.6127 -0.0255 -0.1979 0.7317 205 VAL E CG1 9693 C CG2 . VAL F 205 ? 0.9733 2.1778 1.7096 -0.0655 -0.2300 0.7487 205 VAL E CG2 9694 N N . THR F 206 ? 1.1022 2.1449 1.4426 -0.1084 -0.2720 0.7144 206 THR E N 9695 C CA . THR F 206 ? 1.0879 2.0548 1.3216 -0.1070 -0.2583 0.6878 206 THR E CA 9696 C C . THR F 206 ? 1.0377 1.9831 1.3177 -0.0569 -0.2242 0.7035 206 THR E C 9697 O O . THR F 206 ? 1.0207 2.0261 1.3896 -0.0328 -0.2305 0.7541 206 THR E O 9698 C CB . THR F 206 ? 1.1545 2.1382 1.2941 -0.1449 -0.2999 0.7073 206 THR E CB 9699 O OG1 . THR F 206 ? 1.2269 2.2792 1.4300 -0.1350 -0.3220 0.7679 206 THR E OG1 9700 C CG2 . THR F 206 ? 1.1596 2.1623 1.2478 -0.1962 -0.3348 0.6912 206 THR E CG2 9701 N N . LYS F 207 ? 1.0480 1.9073 1.2712 -0.0418 -0.1891 0.6604 207 LYS E N 9702 C CA . LYS F 207 ? 1.0184 1.8470 1.2718 0.0038 -0.1559 0.6703 207 LYS E CA 9703 C C . LYS F 207 ? 1.0306 1.7838 1.1700 -0.0029 -0.1453 0.6407 207 LYS E C 9704 O O . LYS F 207 ? 1.0314 1.7129 1.1093 -0.0136 -0.1275 0.5881 207 LYS E O 9705 C CB . LYS F 207 ? 0.9813 1.7784 1.3104 0.0383 -0.1133 0.6470 207 LYS E CB 9706 C CG . LYS F 207 ? 0.9870 1.7612 1.3649 0.0879 -0.0793 0.6621 207 LYS E CG 9707 C CD . LYS F 207 ? 0.9999 1.8555 1.4668 0.1090 -0.0950 0.7259 207 LYS E CD 9708 C CE . LYS F 207 ? 0.9833 1.9032 1.5596 0.1079 -0.0981 0.7412 207 LYS E CE 9709 N NZ . LYS F 207 ? 0.9144 1.7995 1.5494 0.1320 -0.0551 0.7103 207 LYS E NZ 9710 N N . SER F 208 ? 1.0364 1.8057 1.1503 0.0021 -0.1564 0.6750 208 SER E N 9711 C CA . SER F 208 ? 1.0946 1.8001 1.0952 -0.0113 -0.1490 0.6490 208 SER E CA 9712 C C . SER F 208 ? 1.0891 1.7774 1.1004 0.0253 -0.1272 0.6722 208 SER E C 9713 O O . SER F 208 ? 1.0344 1.7578 1.1435 0.0637 -0.1172 0.7084 208 SER E O 9714 C CB . SER F 208 ? 1.0692 1.8047 0.9819 -0.0632 -0.1918 0.6597 208 SER E CB 9715 O OG . SER F 208 ? 1.0965 1.8988 1.0403 -0.0632 -0.2194 0.7180 208 SER E OG 9716 N N . PHE F 209 ? 1.1516 1.7848 1.0618 0.0116 -0.1189 0.6497 209 PHE E N 9717 C CA . PHE F 209 ? 1.1815 1.7963 1.0830 0.0386 -0.1010 0.6704 209 PHE E CA 9718 C C . PHE F 209 ? 1.3506 1.9304 1.1249 0.0018 -0.1082 0.6536 209 PHE E C 9719 O O . PHE F 209 ? 1.3775 1.9431 1.0744 -0.0420 -0.1243 0.6227 209 PHE E O 9720 C CB . PHE F 209 ? 1.0734 1.6219 1.0149 0.0849 -0.0523 0.6421 209 PHE E CB 9721 C CG . PHE F 209 ? 1.0937 1.5509 0.9564 0.0727 -0.0267 0.5773 209 PHE E CG 9722 C CD1 . PHE F 209 ? 1.1088 1.5078 0.8974 0.0731 -0.0063 0.5582 209 PHE E CD1 9723 C CD2 . PHE F 209 ? 1.0696 1.4989 0.9362 0.0599 -0.0230 0.5360 209 PHE E CD2 9724 C CE1 . PHE F 209 ? 1.0960 1.4114 0.8224 0.0622 0.0174 0.4989 209 PHE E CE1 9725 C CE2 . PHE F 209 ? 1.0514 1.3968 0.8534 0.0482 -0.0021 0.4787 209 PHE E CE2 9726 C CZ . PHE F 209 ? 1.0595 1.3482 0.7948 0.0501 0.0183 0.4601 209 PHE E CZ 9727 N N . ASN F 210 ? 1.4632 2.0217 1.2219 0.0183 -0.0929 0.6631 210 ASN E N 9728 C CA . ASN F 210 ? 1.5419 2.0615 1.1820 -0.0143 -0.0925 0.6450 210 ASN E CA 9729 C C . ASN F 210 ? 1.5197 1.9604 1.1252 0.0126 -0.0454 0.6155 210 ASN E C 9730 O O . ASN F 210 ? 1.4561 1.8833 1.1382 0.0601 -0.0197 0.6236 210 ASN E O 9731 C CB . ASN F 210 ? 1.6166 2.1800 1.2555 -0.0286 -0.1197 0.6816 210 ASN E CB 9732 C CG . ASN F 210 ? 1.6625 2.3050 1.3470 -0.0534 -0.1654 0.7145 210 ASN E CG 9733 O OD1 . ASN F 210 ? 1.7317 2.3847 1.3476 -0.1004 -0.1928 0.7041 210 ASN E OD1 9734 N ND2 . ASN F 210 ? 1.6195 2.3167 1.4242 -0.0227 -0.1720 0.7519 210 ASN E ND2 9735 N N . ARG F 211 ? 1.5406 1.9202 1.0426 -0.0189 -0.0321 0.5671 211 ARG E N 9736 C CA . ARG F 211 ? 1.4557 1.7515 0.9301 0.0030 0.0142 0.5271 211 ARG E CA 9737 C C . ARG F 211 ? 1.4154 1.7165 0.8776 0.0200 0.0252 0.5622 211 ARG E C 9738 O O . ARG F 211 ? 1.3554 1.6196 0.8619 0.0636 0.0591 0.5596 211 ARG E O 9739 C CB . ARG F 211 ? 1.4986 1.7293 0.8699 -0.0378 0.0260 0.4655 211 ARG E CB 9740 C CG . ARG F 211 ? 1.4895 1.6354 0.8301 -0.0194 0.0733 0.4258 211 ARG E CG 9741 C CD . ARG F 211 ? 1.5338 1.6166 0.7845 -0.0600 0.0857 0.3631 211 ARG E CD 9742 N NE . ARG F 211 ? 1.6007 1.6484 0.7659 -0.0784 0.1074 0.3502 211 ARG E NE 9743 C CZ . ARG F 211 ? 1.6777 1.7353 0.7413 -0.1319 0.0920 0.3429 211 ARG E CZ 9744 N NH1 . ARG F 211 ? 1.7145 1.8157 0.7486 -0.1722 0.0528 0.3476 211 ARG E NH1 9745 N NH2 . ARG F 211 ? 1.7301 1.7520 0.7189 -0.1473 0.1171 0.3295 211 ARG E NH2 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLU 1 367 ? ? ? A . n A 1 2 ALA 2 368 ? ? ? A . n A 1 3 LYS 3 369 ? ? ? A . n A 1 4 PRO 4 370 ? ? ? A . n A 1 5 SER 5 371 ? ? ? A . n A 1 6 GLY 6 372 ? ? ? A . n A 1 7 SER 7 373 ? ? ? A . n A 1 8 VAL 8 374 ? ? ? A . n A 1 9 VAL 9 375 ? ? ? A . n A 1 10 GLU 10 376 ? ? ? A . n A 1 11 GLN 11 377 ? ? ? A . n A 1 12 ALA 12 378 ? ? ? A . n A 1 13 GLU 13 379 ? ? ? A . n A 1 14 GLY 14 380 ? ? ? A . n A 1 15 VAL 15 381 381 VAL VAL A . n A 1 16 GLU 16 382 382 GLU GLU A . n A 1 17 CYS 17 383 383 CYS CYS A . n A 1 18 ASP 18 384 384 ASP ASP A . n A 1 19 PHE 19 385 385 PHE PHE A . n A 1 20 SER 20 386 386 SER SER A . n A 1 21 PRO 21 387 387 PRO PRO A . n A 1 22 LEU 22 388 388 LEU LEU A . n A 1 23 LEU 23 389 389 LEU LEU A . n A 1 24 SER 24 390 390 SER SER A . n A 1 25 GLY 25 391 391 GLY GLY A . n A 1 26 THR 26 392 392 THR THR A . n A 1 27 PRO 27 393 393 PRO PRO A . n A 1 28 PRO 28 394 394 PRO PRO A . n A 1 29 GLN 29 395 395 GLN GLN A . n A 1 30 VAL 30 396 396 VAL VAL A . n A 1 31 TYR 31 397 397 TYR TYR A . n A 1 32 ASN 32 398 398 ASN ASN A . n A 1 33 PHE 33 399 399 PHE PHE A . n A 1 34 LYS 34 400 400 LYS LYS A . n A 1 35 ARG 35 401 401 ARG ARG A . n A 1 36 LEU 36 402 402 LEU LEU A . n A 1 37 VAL 37 403 403 VAL VAL A . n A 1 38 PHE 38 404 404 PHE PHE A . n A 1 39 THR 39 405 405 THR THR A . n A 1 40 ASN 40 406 406 ASN ASN A . n A 1 41 CYS 41 407 407 CYS CYS A . n A 1 42 ASN 42 408 408 ASN ASN A . n A 1 43 TYR 43 409 409 TYR TYR A . n A 1 44 ASN 44 410 410 ASN ASN A . n A 1 45 LEU 45 411 411 LEU LEU A . n A 1 46 THR 46 412 412 THR THR A . n A 1 47 LYS 47 413 413 LYS LYS A . n A 1 48 LEU 48 414 414 LEU LEU A . n A 1 49 LEU 49 415 415 LEU LEU A . n A 1 50 SER 50 416 416 SER SER A . n A 1 51 LEU 51 417 417 LEU LEU A . n A 1 52 PHE 52 418 418 PHE PHE A . n A 1 53 SER 53 419 419 SER SER A . n A 1 54 VAL 54 420 420 VAL VAL A . n A 1 55 ASN 55 421 421 ASN ASN A . n A 1 56 ASP 56 422 422 ASP ASP A . n A 1 57 PHE 57 423 423 PHE PHE A . n A 1 58 THR 58 424 424 THR THR A . n A 1 59 CYS 59 425 425 CYS CYS A . n A 1 60 SER 60 426 426 SER SER A . n A 1 61 GLN 61 427 427 GLN GLN A . n A 1 62 ILE 62 428 428 ILE ILE A . n A 1 63 SER 63 429 429 SER SER A . n A 1 64 PRO 64 430 430 PRO PRO A . n A 1 65 ALA 65 431 431 ALA ALA A . n A 1 66 ALA 66 432 432 ALA ALA A . n A 1 67 ILE 67 433 433 ILE ILE A . n A 1 68 ALA 68 434 434 ALA ALA A . n A 1 69 SER 69 435 435 SER SER A . n A 1 70 ASN 70 436 436 ASN ASN A . n A 1 71 CYS 71 437 437 CYS CYS A . n A 1 72 TYR 72 438 438 TYR TYR A . n A 1 73 SER 73 439 439 SER SER A . n A 1 74 SER 74 440 440 SER SER A . n A 1 75 LEU 75 441 441 LEU LEU A . n A 1 76 ILE 76 442 442 ILE ILE A . n A 1 77 LEU 77 443 443 LEU LEU A . n A 1 78 ASP 78 444 444 ASP ASP A . n A 1 79 TYR 79 445 445 TYR TYR A . n A 1 80 PHE 80 446 446 PHE PHE A . n A 1 81 SER 81 447 447 SER SER A . n A 1 82 TYR 82 448 448 TYR TYR A . n A 1 83 PRO 83 449 449 PRO PRO A . n A 1 84 LEU 84 450 450 LEU LEU A . n A 1 85 SER 85 451 451 SER SER A . n A 1 86 MET 86 452 452 MET MET A . n A 1 87 LYS 87 453 453 LYS LYS A . n A 1 88 SER 88 454 454 SER SER A . n A 1 89 ASP 89 455 455 ASP ASP A . n A 1 90 LEU 90 456 456 LEU LEU A . n A 1 91 SER 91 457 457 SER SER A . n A 1 92 VAL 92 458 458 VAL VAL A . n A 1 93 SER 93 459 459 SER SER A . n A 1 94 SER 94 460 460 SER SER A . n A 1 95 ALA 95 461 461 ALA ALA A . n A 1 96 GLY 96 462 462 GLY GLY A . n A 1 97 PRO 97 463 463 PRO PRO A . n A 1 98 ILE 98 464 464 ILE ILE A . n A 1 99 SER 99 465 465 SER SER A . n A 1 100 GLN 100 466 466 GLN GLN A . n A 1 101 PHE 101 467 467 PHE PHE A . n A 1 102 ASN 102 468 468 ASN ASN A . n A 1 103 TYR 103 469 469 TYR TYR A . n A 1 104 LYS 104 470 470 LYS LYS A . n A 1 105 GLN 105 471 471 GLN GLN A . n A 1 106 SER 106 472 472 SER SER A . n A 1 107 PHE 107 473 473 PHE PHE A . n A 1 108 SER 108 474 474 SER SER A . n A 1 109 ASN 109 475 475 ASN ASN A . n A 1 110 PRO 110 476 476 PRO PRO A . n A 1 111 THR 111 477 477 THR THR A . n A 1 112 CYS 112 478 478 CYS CYS A . n A 1 113 LEU 113 479 479 LEU LEU A . n A 1 114 ILE 114 480 480 ILE ILE A . n A 1 115 LEU 115 481 481 LEU LEU A . n A 1 116 ALA 116 482 482 ALA ALA A . n A 1 117 THR 117 483 483 THR THR A . n A 1 118 VAL 118 484 484 VAL VAL A . n A 1 119 PRO 119 485 485 PRO PRO A . n A 1 120 HIS 120 486 486 HIS HIS A . n A 1 121 ASN 121 487 487 ASN ASN A . n A 1 122 LEU 122 488 488 LEU LEU A . n A 1 123 THR 123 489 489 THR THR A . n A 1 124 THR 124 490 490 THR THR A . n A 1 125 ILE 125 491 491 ILE ILE A . n A 1 126 THR 126 492 492 THR THR A . n A 1 127 LYS 127 493 493 LYS LYS A . n A 1 128 PRO 128 494 494 PRO PRO A . n A 1 129 LEU 129 495 495 LEU LEU A . n A 1 130 LYS 130 496 496 LYS LYS A . n A 1 131 TYR 131 497 497 TYR TYR A . n A 1 132 SER 132 498 498 SER SER A . n A 1 133 TYR 133 499 499 TYR TYR A . n A 1 134 ILE 134 500 500 ILE ILE A . n A 1 135 ASN 135 501 501 ASN ASN A . n A 1 136 LYS 136 502 502 LYS LYS A . n A 1 137 CYS 137 503 503 CYS CYS A . n A 1 138 SER 138 504 504 SER SER A . n A 1 139 ARG 139 505 505 ARG ARG A . n A 1 140 PHE 140 506 506 PHE PHE A . n A 1 141 LEU 141 507 507 LEU LEU A . n A 1 142 SER 142 508 508 SER SER A . n A 1 143 ASP 143 509 509 ASP ASP A . n A 1 144 ASP 144 510 510 ASP ASP A . n A 1 145 ARG 145 511 511 ARG ARG A . n A 1 146 THR 146 512 512 THR THR A . n A 1 147 GLU 147 513 513 GLU GLU A . n A 1 148 VAL 148 514 514 VAL VAL A . n A 1 149 PRO 149 515 515 PRO PRO A . n A 1 150 GLN 150 516 516 GLN GLN A . n A 1 151 LEU 151 517 517 LEU LEU A . n A 1 152 VAL 152 518 518 VAL VAL A . n A 1 153 ASN 153 519 519 ASN ASN A . n A 1 154 ALA 154 520 520 ALA ALA A . n A 1 155 ASN 155 521 521 ASN ASN A . n A 1 156 GLN 156 522 522 GLN GLN A . n A 1 157 TYR 157 523 523 TYR TYR A . n A 1 158 SER 158 524 524 SER SER A . n A 1 159 PRO 159 525 525 PRO PRO A . n A 1 160 CYS 160 526 526 CYS CYS A . n A 1 161 VAL 161 527 527 VAL VAL A . n A 1 162 SER 162 528 528 SER SER A . n A 1 163 ILE 163 529 529 ILE ILE A . n A 1 164 VAL 164 530 530 VAL VAL A . n A 1 165 PRO 165 531 531 PRO PRO A . n A 1 166 SER 166 532 532 SER SER A . n A 1 167 THR 167 533 533 THR THR A . n A 1 168 VAL 168 534 534 VAL VAL A . n A 1 169 TRP 169 535 535 TRP TRP A . n A 1 170 GLU 170 536 536 GLU GLU A . n A 1 171 ASP 171 537 537 ASP ASP A . n A 1 172 GLY 172 538 538 GLY GLY A . n A 1 173 ASP 173 539 539 ASP ASP A . n A 1 174 TYR 174 540 540 TYR TYR A . n A 1 175 TYR 175 541 541 TYR TYR A . n A 1 176 ARG 176 542 542 ARG ARG A . n A 1 177 LYS 177 543 543 LYS LYS A . n A 1 178 GLN 178 544 544 GLN GLN A . n A 1 179 LEU 179 545 545 LEU LEU A . n A 1 180 SER 180 546 546 SER SER A . n A 1 181 PRO 181 547 547 PRO PRO A . n A 1 182 LEU 182 548 548 LEU LEU A . n A 1 183 GLU 183 549 549 GLU GLU A . n A 1 184 GLY 184 550 550 GLY GLY A . n A 1 185 GLY 185 551 551 GLY GLY A . n A 1 186 GLY 186 552 552 GLY GLY A . n A 1 187 TRP 187 553 553 TRP TRP A . n A 1 188 LEU 188 554 554 LEU LEU A . n A 1 189 VAL 189 555 555 VAL VAL A . n A 1 190 ALA 190 556 556 ALA ALA A . n A 1 191 SER 191 557 557 SER SER A . n A 1 192 GLY 192 558 558 GLY GLY A . n A 1 193 SER 193 559 559 SER SER A . n A 1 194 THR 194 560 560 THR THR A . n A 1 195 VAL 195 561 561 VAL VAL A . n A 1 196 ALA 196 562 562 ALA ALA A . n A 1 197 MET 197 563 563 MET MET A . n A 1 198 THR 198 564 564 THR THR A . n A 1 199 GLU 199 565 565 GLU GLU A . n A 1 200 GLN 200 566 566 GLN GLN A . n A 1 201 LEU 201 567 567 LEU LEU A . n A 1 202 GLN 202 568 568 GLN GLN A . n A 1 203 MET 203 569 569 MET MET A . n A 1 204 GLY 204 570 570 GLY GLY A . n A 1 205 PHE 205 571 571 PHE PHE A . n A 1 206 GLY 206 572 572 GLY GLY A . n A 1 207 ILE 207 573 573 ILE ILE A . n A 1 208 THR 208 574 574 THR THR A . n A 1 209 VAL 209 575 575 VAL VAL A . n A 1 210 GLN 210 576 576 GLN GLN A . n A 1 211 TYR 211 577 577 TYR TYR A . n A 1 212 GLY 212 578 578 GLY GLY A . n A 1 213 THR 213 579 579 THR THR A . n A 1 214 ASP 214 580 580 ASP ASP A . n A 1 215 THR 215 581 581 THR THR A . n A 1 216 ASN 216 582 582 ASN ASN A . n A 1 217 SER 217 583 583 SER SER A . n A 1 218 VAL 218 584 584 VAL VAL A . n A 1 219 CYS 219 585 585 CYS CYS A . n A 1 220 PRO 220 586 586 PRO PRO A . n A 1 221 LYS 221 587 587 LYS LYS A . n A 1 222 LEU 222 588 588 LEU LEU A . n A 1 223 GLU 223 589 589 GLU GLU A . n A 1 224 PHE 224 590 590 PHE PHE A . n A 1 225 ALA 225 591 591 ALA ALA A . n A 1 226 ASN 226 592 ? ? ? A . n A 1 227 ASP 227 593 ? ? ? A . n A 1 228 THR 228 594 ? ? ? A . n A 1 229 LYS 229 595 ? ? ? A . n A 1 230 ILE 230 596 ? ? ? A . n A 1 231 ALA 231 597 ? ? ? A . n A 1 232 SER 232 598 ? ? ? A . n A 1 233 GLN 233 599 ? ? ? A . n A 1 234 LEU 234 600 ? ? ? A . n A 1 235 GLY 235 601 ? ? ? A . n A 1 236 GLY 236 602 ? ? ? A . n A 1 237 SER 237 603 ? ? ? A . n A 1 238 LEU 238 604 ? ? ? A . n A 1 239 GLU 239 605 ? ? ? A . n A 1 240 VAL 240 606 ? ? ? A . n A 1 241 LEU 241 607 ? ? ? A . n A 1 242 PHE 242 608 ? ? ? A . n A 1 243 GLN 243 609 ? ? ? A . n A 1 244 GLY 244 610 ? ? ? A . n A 1 245 PRO 245 611 ? ? ? A . n A 1 246 GLY 246 612 ? ? ? A . n A 1 247 HIS 247 613 ? ? ? A . n A 1 248 HIS 248 614 ? ? ? A . n A 1 249 HIS 249 615 ? ? ? A . n A 1 250 HIS 250 616 ? ? ? A . n A 1 251 HIS 251 617 ? ? ? A . n A 1 252 HIS 252 618 ? ? ? A . n B 2 1 GLN 1 1 1 GLN GLN H . n B 2 2 VAL 2 2 2 VAL VAL H . n B 2 3 GLN 3 3 3 GLN GLN H . n B 2 4 LEU 4 4 4 LEU LEU H . n B 2 5 VAL 5 5 5 VAL VAL H . n B 2 6 GLN 6 6 6 GLN GLN H . n B 2 7 SER 7 7 7 SER SER H . n B 2 8 GLY 8 8 8 GLY GLY H . n B 2 9 ALA 9 9 9 ALA ALA H . n B 2 10 GLU 10 10 10 GLU GLU H . n B 2 11 VAL 11 11 11 VAL VAL H . n B 2 12 LYS 12 12 12 LYS LYS H . n B 2 13 LYS 13 13 13 LYS LYS H . n B 2 14 PRO 14 14 14 PRO PRO H . n B 2 15 GLY 15 15 15 GLY GLY H . n B 2 16 SER 16 16 16 SER SER H . n B 2 17 SER 17 17 17 SER SER H . n B 2 18 VAL 18 18 18 VAL VAL H . n B 2 19 LYS 19 19 19 LYS LYS H . n B 2 20 VAL 20 20 20 VAL VAL H . n B 2 21 SER 21 21 21 SER SER H . n B 2 22 CYS 22 22 22 CYS CYS H . n B 2 23 LYS 23 23 23 LYS LYS H . n B 2 24 ALA 24 24 24 ALA ALA H . n B 2 25 SER 25 25 25 SER SER H . n B 2 26 GLY 26 26 26 GLY GLY H . n B 2 27 GLY 27 27 27 GLY GLY H . n B 2 28 THR 28 28 28 THR THR H . n B 2 29 PHE 29 29 29 PHE PHE H . n B 2 30 SER 30 30 30 SER SER H . n B 2 31 SER 31 31 31 SER SER H . n B 2 32 TYR 32 32 32 TYR TYR H . n B 2 33 ALA 33 33 33 ALA ALA H . n B 2 34 ILE 34 34 34 ILE ILE H . n B 2 35 SER 35 35 35 SER SER H . n B 2 36 TRP 36 36 36 TRP TRP H . n B 2 37 VAL 37 37 37 VAL VAL H . n B 2 38 ARG 38 38 38 ARG ARG H . n B 2 39 GLN 39 39 39 GLN GLN H . n B 2 40 ALA 40 40 40 ALA ALA H . n B 2 41 PRO 41 41 41 PRO PRO H . n B 2 42 GLY 42 42 42 GLY GLY H . n B 2 43 GLN 43 43 43 GLN GLN H . n B 2 44 GLY 44 44 44 GLY GLY H . n B 2 45 LEU 45 45 45 LEU LEU H . n B 2 46 GLU 46 46 46 GLU GLU H . n B 2 47 TRP 47 47 47 TRP TRP H . n B 2 48 MET 48 48 48 MET MET H . n B 2 49 GLY 49 49 49 GLY GLY H . n B 2 50 GLY 50 50 50 GLY GLY H . n B 2 51 ILE 51 51 51 ILE ILE H . n B 2 52 ILE 52 52 52 ILE ILE H . n B 2 53 PRO 53 52 52 PRO PRO H A n B 2 54 ILE 54 53 53 ILE ILE H . n B 2 55 PHE 55 54 54 PHE PHE H . n B 2 56 GLY 56 55 55 GLY GLY H . n B 2 57 THR 57 56 56 THR THR H . n B 2 58 ALA 58 57 57 ALA ALA H . n B 2 59 SER 59 58 58 SER SER H . n B 2 60 TYR 60 59 59 TYR TYR H . n B 2 61 ALA 61 60 60 ALA ALA H . n B 2 62 GLN 62 61 61 GLN GLN H . n B 2 63 LYS 63 62 62 LYS LYS H . n B 2 64 PHE 64 63 63 PHE PHE H . n B 2 65 GLN 65 64 64 GLN GLN H . n B 2 66 GLY 66 65 65 GLY GLY H . n B 2 67 ARG 67 66 66 ARG ARG H . n B 2 68 VAL 68 67 67 VAL VAL H . n B 2 69 THR 69 68 68 THR THR H . n B 2 70 ILE 70 69 69 ILE ILE H . n B 2 71 THR 71 70 70 THR THR H . n B 2 72 ALA 72 71 71 ALA ALA H . n B 2 73 ASP 73 72 72 ASP ASP H . n B 2 74 LYS 74 73 73 LYS LYS H . n B 2 75 SER 75 74 74 SER SER H . n B 2 76 THR 76 75 75 THR THR H . n B 2 77 SER 77 76 76 SER SER H . n B 2 78 THR 78 77 77 THR THR H . n B 2 79 ALA 79 78 78 ALA ALA H . n B 2 80 TYR 80 79 79 TYR TYR H . n B 2 81 MET 81 80 80 MET MET H . n B 2 82 GLU 82 81 81 GLU GLU H . n B 2 83 LEU 83 82 82 LEU LEU H . n B 2 84 SER 84 82 82 SER SER H A n B 2 85 SER 85 82 82 SER SER H B n B 2 86 LEU 86 82 82 LEU LEU H C n B 2 87 ARG 87 83 83 ARG ARG H . n B 2 88 SER 88 84 84 SER SER H . n B 2 89 GLU 89 85 85 GLU GLU H . n B 2 90 ASP 90 86 86 ASP ASP H . n B 2 91 THR 91 87 87 THR THR H . n B 2 92 ALA 92 88 88 ALA ALA H . n B 2 93 VAL 93 89 89 VAL VAL H . n B 2 94 TYR 94 90 90 TYR TYR H . n B 2 95 TYR 95 91 91 TYR TYR H . n B 2 96 CYS 96 92 92 CYS CYS H . n B 2 97 ALA 97 93 93 ALA ALA H . n B 2 98 ARG 98 94 94 ARG ARG H . n B 2 99 VAL 99 95 95 VAL VAL H . n B 2 100 GLY 100 96 96 GLY GLY H . n B 2 101 TYR 101 97 97 TYR TYR H . n B 2 102 CYS 102 98 98 CYS CYS H . n B 2 103 SER 103 99 99 SER SER H . n B 2 104 SER 104 100 100 SER SER H . n B 2 105 THR 105 100 100 THR THR H A n B 2 106 SER 106 100 100 SER SER H B n B 2 107 CYS 107 100 100 CYS CYS H C n B 2 108 ASN 108 100 100 ASN ASN H D n B 2 109 ARG 109 100 100 ARG ARG H E n B 2 110 GLY 110 100 100 GLY GLY H F n B 2 111 ALA 111 100 100 ALA ALA H G n B 2 112 PHE 112 100 100 PHE PHE H H n B 2 113 ASP 113 101 101 ASP ASP H . n B 2 114 ILE 114 102 102 ILE ILE H . n B 2 115 TRP 115 103 103 TRP TRP H . n B 2 116 GLY 116 104 104 GLY GLY H . n B 2 117 GLN 117 105 105 GLN GLN H . n B 2 118 GLY 118 106 106 GLY GLY H . n B 2 119 THR 119 107 107 THR THR H . n B 2 120 MET 120 108 108 MET MET H . n B 2 121 VAL 121 109 109 VAL VAL H . n B 2 122 THR 122 110 110 THR THR H . n B 2 123 VAL 123 111 111 VAL VAL H . n B 2 124 SER 124 112 112 SER SER H . n B 2 125 SER 125 113 113 SER SER H . n B 2 126 ALA 126 114 114 ALA ALA H . n B 2 127 SER 127 115 115 SER SER H . n B 2 128 THR 128 116 116 THR THR H . n B 2 129 LYS 129 117 117 LYS LYS H . n B 2 130 GLY 130 118 118 GLY GLY H . n B 2 131 PRO 131 119 119 PRO PRO H . n B 2 132 SER 132 120 120 SER SER H . n B 2 133 VAL 133 121 121 VAL VAL H . n B 2 134 PHE 134 122 122 PHE PHE H . n B 2 135 PRO 135 123 123 PRO PRO H . n B 2 136 LEU 136 124 124 LEU LEU H . n B 2 137 ALA 137 125 125 ALA ALA H . n B 2 138 PRO 138 126 126 PRO PRO H . n B 2 139 SER 139 127 127 SER SER H . n B 2 140 SER 140 128 128 SER SER H . n B 2 141 LYS 141 129 129 LYS LYS H . n B 2 142 SER 142 130 130 SER SER H . n B 2 143 THR 143 131 131 THR THR H . n B 2 144 SER 144 132 132 SER SER H . n B 2 145 GLY 145 133 133 GLY GLY H . n B 2 146 GLY 146 134 134 GLY GLY H . n B 2 147 THR 147 135 135 THR THR H . n B 2 148 ALA 148 136 136 ALA ALA H . n B 2 149 ALA 149 137 137 ALA ALA H . n B 2 150 LEU 150 138 138 LEU LEU H . n B 2 151 GLY 151 139 139 GLY GLY H . n B 2 152 CYS 152 140 140 CYS CYS H . n B 2 153 LEU 153 141 141 LEU LEU H . n B 2 154 VAL 154 142 142 VAL VAL H . n B 2 155 LYS 155 143 143 LYS LYS H . n B 2 156 ASP 156 144 144 ASP ASP H . n B 2 157 TYR 157 145 145 TYR TYR H . n B 2 158 PHE 158 146 146 PHE PHE H . n B 2 159 PRO 159 147 147 PRO PRO H . n B 2 160 GLU 160 148 148 GLU GLU H . n B 2 161 PRO 161 149 149 PRO PRO H . n B 2 162 VAL 162 150 150 VAL VAL H . n B 2 163 THR 163 151 151 THR THR H . n B 2 164 VAL 164 152 152 VAL VAL H . n B 2 165 SER 165 153 153 SER SER H . n B 2 166 TRP 166 154 154 TRP TRP H . n B 2 167 ASN 167 155 155 ASN ASN H . n B 2 168 SER 168 156 156 SER SER H . n B 2 169 GLY 169 157 157 GLY GLY H . n B 2 170 ALA 170 158 158 ALA ALA H . n B 2 171 LEU 171 159 159 LEU LEU H . n B 2 172 THR 172 160 160 THR THR H . n B 2 173 SER 173 161 161 SER SER H . n B 2 174 GLY 174 162 162 GLY GLY H . n B 2 175 VAL 175 163 163 VAL VAL H . n B 2 176 HIS 176 164 164 HIS HIS H . n B 2 177 THR 177 165 165 THR THR H . n B 2 178 PHE 178 166 166 PHE PHE H . n B 2 179 PRO 179 167 167 PRO PRO H . n B 2 180 ALA 180 168 168 ALA ALA H . n B 2 181 VAL 181 169 169 VAL VAL H . n B 2 182 LEU 182 170 170 LEU LEU H . n B 2 183 GLN 183 171 171 GLN GLN H . n B 2 184 SER 184 172 172 SER SER H . n B 2 185 SER 185 173 173 SER SER H . n B 2 186 GLY 186 174 174 GLY GLY H . n B 2 187 LEU 187 175 175 LEU LEU H . n B 2 188 TYR 188 176 176 TYR TYR H . n B 2 189 SER 189 177 177 SER SER H . n B 2 190 LEU 190 178 178 LEU LEU H . n B 2 191 SER 191 179 179 SER SER H . n B 2 192 SER 192 180 180 SER SER H . n B 2 193 VAL 193 181 181 VAL VAL H . n B 2 194 VAL 194 182 182 VAL VAL H . n B 2 195 THR 195 183 183 THR THR H . n B 2 196 VAL 196 184 184 VAL VAL H . n B 2 197 PRO 197 185 185 PRO PRO H . n B 2 198 SER 198 186 186 SER SER H . n B 2 199 SER 199 187 187 SER SER H . n B 2 200 SER 200 188 188 SER SER H . n B 2 201 LEU 201 189 189 LEU LEU H . n B 2 202 GLY 202 190 190 GLY GLY H . n B 2 203 THR 203 191 191 THR THR H . n B 2 204 GLN 204 192 192 GLN GLN H . n B 2 205 THR 205 193 193 THR THR H . n B 2 206 TYR 206 194 194 TYR TYR H . n B 2 207 ILE 207 195 195 ILE ILE H . n B 2 208 CYS 208 196 196 CYS CYS H . n B 2 209 ASN 209 197 197 ASN ASN H . n B 2 210 VAL 210 198 198 VAL VAL H . n B 2 211 ASN 211 199 199 ASN ASN H . n B 2 212 HIS 212 200 200 HIS HIS H . n B 2 213 LYS 213 201 201 LYS LYS H . n B 2 214 PRO 214 202 202 PRO PRO H . n B 2 215 SER 215 203 203 SER SER H . n B 2 216 ASN 216 204 204 ASN ASN H . n B 2 217 THR 217 205 205 THR THR H . n B 2 218 LYS 218 206 206 LYS LYS H . n B 2 219 VAL 219 207 207 VAL VAL H . n B 2 220 ASP 220 208 208 ASP ASP H . n B 2 221 LYS 221 209 209 LYS LYS H . n B 2 222 LYS 222 210 210 LYS LYS H . n B 2 223 VAL 223 211 211 VAL VAL H . n B 2 224 GLU 224 212 212 GLU GLU H . n B 2 225 PRO 225 213 213 PRO PRO H . n B 2 226 LYS 226 214 214 LYS LYS H . n B 2 227 SER 227 215 215 SER SER H . n B 2 228 CYS 228 216 ? ? ? H . n B 2 229 ASP 229 217 ? ? ? H . n B 2 230 LYS 230 218 ? ? ? H . n B 2 231 THR 231 219 ? ? ? H . n B 2 232 SER 232 220 ? ? ? H . n B 2 233 GLY 233 221 ? ? ? H . n B 2 234 GLN 234 222 ? ? ? H . n B 2 235 ALA 235 223 ? ? ? H . n B 2 236 GLY 236 224 ? ? ? H . n B 2 237 HIS 237 225 ? ? ? H . n B 2 238 HIS 238 226 ? ? ? H . n B 2 239 HIS 239 227 ? ? ? H . n B 2 240 HIS 240 228 ? ? ? H . n B 2 241 HIS 241 229 ? ? ? H . n B 2 242 HIS 242 230 ? ? ? H . n B 2 243 GLY 243 231 ? ? ? H . n B 2 244 ASP 244 232 ? ? ? H . n B 2 245 TYR 245 233 ? ? ? H . n B 2 246 LYS 246 234 ? ? ? H . n B 2 247 ASP 247 235 ? ? ? H . n B 2 248 ASP 248 236 ? ? ? H . n B 2 249 ASP 249 237 ? ? ? H . n B 2 250 ASP 250 238 ? ? ? H . n B 2 251 LYS 251 239 ? ? ? H . n B 2 252 GLY 252 240 ? ? ? H . n C 3 1 ASP 1 1 1 ASP ASP L . n C 3 2 ILE 2 2 2 ILE ILE L . n C 3 3 GLN 3 3 3 GLN GLN L . n C 3 4 LEU 4 4 4 LEU LEU L . n C 3 5 THR 5 5 5 THR THR L . n C 3 6 GLN 6 6 6 GLN GLN L . n C 3 7 SER 7 7 7 SER SER L . n C 3 8 PRO 8 8 8 PRO PRO L . n C 3 9 SER 9 9 9 SER SER L . n C 3 10 SER 10 10 10 SER SER L . n C 3 11 LEU 11 11 11 LEU LEU L . n C 3 12 SER 12 12 12 SER SER L . n C 3 13 ALA 13 13 13 ALA ALA L . n C 3 14 SER 14 14 14 SER SER L . n C 3 15 VAL 15 15 15 VAL VAL L . n C 3 16 GLY 16 16 16 GLY GLY L . n C 3 17 ASP 17 17 17 ASP ASP L . n C 3 18 ARG 18 18 18 ARG ARG L . n C 3 19 VAL 19 19 19 VAL VAL L . n C 3 20 THR 20 20 20 THR THR L . n C 3 21 ILE 21 21 21 ILE ILE L . n C 3 22 THR 22 22 22 THR THR L . n C 3 23 CYS 23 23 23 CYS CYS L . n C 3 24 ARG 24 24 24 ARG ARG L . n C 3 25 ALA 25 25 25 ALA ALA L . n C 3 26 SER 26 26 26 SER SER L . n C 3 27 GLN 27 27 27 GLN GLN L . n C 3 28 GLY 28 28 28 GLY GLY L . n C 3 29 ILE 29 29 29 ILE ILE L . n C 3 30 ARG 30 30 30 ARG ARG L . n C 3 31 ASN 31 31 31 ASN ASN L . n C 3 32 ASP 32 32 32 ASP ASP L . n C 3 33 LEU 33 33 33 LEU LEU L . n C 3 34 GLY 34 34 34 GLY GLY L . n C 3 35 TRP 35 35 35 TRP TRP L . n C 3 36 TYR 36 36 36 TYR TYR L . n C 3 37 GLN 37 37 37 GLN GLN L . n C 3 38 GLN 38 38 38 GLN GLN L . n C 3 39 LYS 39 39 39 LYS LYS L . n C 3 40 PRO 40 40 40 PRO PRO L . n C 3 41 GLY 41 41 41 GLY GLY L . n C 3 42 LYS 42 42 42 LYS LYS L . n C 3 43 ALA 43 43 43 ALA ALA L . n C 3 44 PRO 44 44 44 PRO PRO L . n C 3 45 LYS 45 45 45 LYS LYS L . n C 3 46 LEU 46 46 46 LEU LEU L . n C 3 47 LEU 47 47 47 LEU LEU L . n C 3 48 ILE 48 48 48 ILE ILE L . n C 3 49 TYR 49 49 49 TYR TYR L . n C 3 50 ALA 50 50 50 ALA ALA L . n C 3 51 ALA 51 51 51 ALA ALA L . n C 3 52 SER 52 52 52 SER SER L . n C 3 53 SER 53 53 53 SER SER L . n C 3 54 LEU 54 54 54 LEU LEU L . n C 3 55 GLN 55 55 55 GLN GLN L . n C 3 56 SER 56 56 56 SER SER L . n C 3 57 GLY 57 57 57 GLY GLY L . n C 3 58 VAL 58 58 58 VAL VAL L . n C 3 59 PRO 59 59 59 PRO PRO L . n C 3 60 SER 60 60 60 SER SER L . n C 3 61 ARG 61 61 61 ARG ARG L . n C 3 62 PHE 62 62 62 PHE PHE L . n C 3 63 SER 63 63 63 SER SER L . n C 3 64 GLY 64 64 64 GLY GLY L . n C 3 65 SER 65 65 65 SER SER L . n C 3 66 GLY 66 66 66 GLY GLY L . n C 3 67 SER 67 67 67 SER SER L . n C 3 68 GLY 68 68 68 GLY GLY L . n C 3 69 THR 69 69 69 THR THR L . n C 3 70 ASP 70 70 70 ASP ASP L . n C 3 71 PHE 71 71 71 PHE PHE L . n C 3 72 THR 72 72 72 THR THR L . n C 3 73 LEU 73 73 73 LEU LEU L . n C 3 74 THR 74 74 74 THR THR L . n C 3 75 ILE 75 75 75 ILE ILE L . n C 3 76 SER 76 76 76 SER SER L . n C 3 77 SER 77 77 77 SER SER L . n C 3 78 LEU 78 78 78 LEU LEU L . n C 3 79 GLN 79 79 79 GLN GLN L . n C 3 80 PRO 80 80 80 PRO PRO L . n C 3 81 GLU 81 81 81 GLU GLU L . n C 3 82 ASP 82 82 82 ASP ASP L . n C 3 83 PHE 83 83 83 PHE PHE L . n C 3 84 ALA 84 84 84 ALA ALA L . n C 3 85 THR 85 85 85 THR THR L . n C 3 86 TYR 86 86 86 TYR TYR L . n C 3 87 TYR 87 87 87 TYR TYR L . n C 3 88 CYS 88 88 88 CYS CYS L . n C 3 89 GLN 89 89 89 GLN GLN L . n C 3 90 GLN 90 90 90 GLN GLN L . n C 3 91 LEU 91 91 91 LEU LEU L . n C 3 92 ASN 92 92 92 ASN ASN L . n C 3 93 SER 93 93 93 SER SER L . n C 3 94 TYR 94 94 94 TYR TYR L . n C 3 95 PRO 95 95 95 PRO PRO L . n C 3 96 LEU 96 96 96 LEU LEU L . n C 3 97 THR 97 97 97 THR THR L . n C 3 98 PHE 98 98 98 PHE PHE L . n C 3 99 GLY 99 99 99 GLY GLY L . n C 3 100 GLY 100 100 100 GLY GLY L . n C 3 101 GLY 101 101 101 GLY GLY L . n C 3 102 THR 102 102 102 THR THR L . n C 3 103 LYS 103 103 103 LYS LYS L . n C 3 104 VAL 104 104 104 VAL VAL L . n C 3 105 GLU 105 105 105 GLU GLU L . n C 3 106 ILE 106 106 106 ILE ILE L . n C 3 107 LYS 107 107 107 LYS LYS L . n C 3 108 ARG 108 108 108 ARG ARG L . n C 3 109 THR 109 109 109 THR THR L . n C 3 110 VAL 110 110 110 VAL VAL L . n C 3 111 ALA 111 111 111 ALA ALA L . n C 3 112 ALA 112 112 112 ALA ALA L . n C 3 113 PRO 113 113 113 PRO PRO L . n C 3 114 SER 114 114 114 SER SER L . n C 3 115 VAL 115 115 115 VAL VAL L . n C 3 116 PHE 116 116 116 PHE PHE L . n C 3 117 ILE 117 117 117 ILE ILE L . n C 3 118 PHE 118 118 118 PHE PHE L . n C 3 119 PRO 119 119 119 PRO PRO L . n C 3 120 PRO 120 120 120 PRO PRO L . n C 3 121 SER 121 121 121 SER SER L . n C 3 122 ASP 122 122 122 ASP ASP L . n C 3 123 GLU 123 123 123 GLU GLU L . n C 3 124 GLN 124 124 124 GLN GLN L . n C 3 125 LEU 125 125 125 LEU LEU L . n C 3 126 LYS 126 126 126 LYS LYS L . n C 3 127 SER 127 127 127 SER SER L . n C 3 128 GLY 128 128 128 GLY GLY L . n C 3 129 THR 129 129 129 THR THR L . n C 3 130 ALA 130 130 130 ALA ALA L . n C 3 131 SER 131 131 131 SER SER L . n C 3 132 VAL 132 132 132 VAL VAL L . n C 3 133 VAL 133 133 133 VAL VAL L . n C 3 134 CYS 134 134 134 CYS CYS L . n C 3 135 LEU 135 135 135 LEU LEU L . n C 3 136 LEU 136 136 136 LEU LEU L . n C 3 137 ASN 137 137 137 ASN ASN L . n C 3 138 ASN 138 138 138 ASN ASN L . n C 3 139 PHE 139 139 139 PHE PHE L . n C 3 140 TYR 140 140 140 TYR TYR L . n C 3 141 PRO 141 141 141 PRO PRO L . n C 3 142 ARG 142 142 142 ARG ARG L . n C 3 143 GLU 143 143 143 GLU GLU L . n C 3 144 ALA 144 144 144 ALA ALA L . n C 3 145 LYS 145 145 145 LYS LYS L . n C 3 146 VAL 146 146 146 VAL VAL L . n C 3 147 GLN 147 147 147 GLN GLN L . n C 3 148 TRP 148 148 148 TRP TRP L . n C 3 149 LYS 149 149 149 LYS LYS L . n C 3 150 VAL 150 150 150 VAL VAL L . n C 3 151 ASP 151 151 151 ASP ASP L . n C 3 152 ASN 152 152 152 ASN ASN L . n C 3 153 ALA 153 153 153 ALA ALA L . n C 3 154 LEU 154 154 154 LEU LEU L . n C 3 155 GLN 155 155 155 GLN GLN L . n C 3 156 SER 156 156 156 SER SER L . n C 3 157 GLY 157 157 157 GLY GLY L . n C 3 158 ASN 158 158 158 ASN ASN L . n C 3 159 SER 159 159 159 SER SER L . n C 3 160 GLN 160 160 160 GLN GLN L . n C 3 161 GLU 161 161 161 GLU GLU L . n C 3 162 SER 162 162 162 SER SER L . n C 3 163 VAL 163 163 163 VAL VAL L . n C 3 164 THR 164 164 164 THR THR L . n C 3 165 GLU 165 165 165 GLU GLU L . n C 3 166 GLN 166 166 166 GLN GLN L . n C 3 167 ASP 167 167 167 ASP ASP L . n C 3 168 SER 168 168 168 SER SER L . n C 3 169 LYS 169 169 169 LYS LYS L . n C 3 170 ASP 170 170 170 ASP ASP L . n C 3 171 SER 171 171 171 SER SER L . n C 3 172 THR 172 172 172 THR THR L . n C 3 173 TYR 173 173 173 TYR TYR L . n C 3 174 SER 174 174 174 SER SER L . n C 3 175 LEU 175 175 175 LEU LEU L . n C 3 176 SER 176 176 176 SER SER L . n C 3 177 SER 177 177 177 SER SER L . n C 3 178 THR 178 178 178 THR THR L . n C 3 179 LEU 179 179 179 LEU LEU L . n C 3 180 THR 180 180 180 THR THR L . n C 3 181 LEU 181 181 181 LEU LEU L . n C 3 182 SER 182 182 182 SER SER L . n C 3 183 LYS 183 183 183 LYS LYS L . n C 3 184 ALA 184 184 184 ALA ALA L . n C 3 185 ASP 185 185 185 ASP ASP L . n C 3 186 TYR 186 186 186 TYR TYR L . n C 3 187 GLU 187 187 187 GLU GLU L . n C 3 188 LYS 188 188 188 LYS LYS L . n C 3 189 HIS 189 189 189 HIS HIS L . n C 3 190 LYS 190 190 190 LYS LYS L . n C 3 191 VAL 191 191 191 VAL VAL L . n C 3 192 TYR 192 192 192 TYR TYR L . n C 3 193 ALA 193 193 193 ALA ALA L . n C 3 194 CYS 194 194 194 CYS CYS L . n C 3 195 GLU 195 195 195 GLU GLU L . n C 3 196 VAL 196 196 196 VAL VAL L . n C 3 197 THR 197 197 197 THR THR L . n C 3 198 HIS 198 198 198 HIS HIS L . n C 3 199 GLN 199 199 199 GLN GLN L . n C 3 200 GLY 200 200 200 GLY GLY L . n C 3 201 LEU 201 201 201 LEU LEU L . n C 3 202 SER 202 202 202 SER SER L . n C 3 203 SER 203 203 203 SER SER L . n C 3 204 PRO 204 204 204 PRO PRO L . n C 3 205 VAL 205 205 205 VAL VAL L . n C 3 206 THR 206 206 206 THR THR L . n C 3 207 LYS 207 207 207 LYS LYS L . n C 3 208 SER 208 208 208 SER SER L . n C 3 209 PHE 209 209 209 PHE PHE L . n C 3 210 ASN 210 210 210 ASN ASN L . n C 3 211 ARG 211 211 211 ARG ARG L . n C 3 212 GLY 212 212 212 GLY GLY L . n C 3 213 GLU 213 213 ? ? ? L . n C 3 214 CYS 214 214 ? ? ? L . n D 1 1 GLU 1 367 ? ? ? B . n D 1 2 ALA 2 368 ? ? ? B . n D 1 3 LYS 3 369 ? ? ? B . n D 1 4 PRO 4 370 ? ? ? B . n D 1 5 SER 5 371 ? ? ? B . n D 1 6 GLY 6 372 ? ? ? B . n D 1 7 SER 7 373 ? ? ? B . n D 1 8 VAL 8 374 ? ? ? B . n D 1 9 VAL 9 375 ? ? ? B . n D 1 10 GLU 10 376 ? ? ? B . n D 1 11 GLN 11 377 ? ? ? B . n D 1 12 ALA 12 378 ? ? ? B . n D 1 13 GLU 13 379 ? ? ? B . n D 1 14 GLY 14 380 ? ? ? B . n D 1 15 VAL 15 381 381 VAL VAL B . n D 1 16 GLU 16 382 382 GLU GLU B . n D 1 17 CYS 17 383 383 CYS CYS B . n D 1 18 ASP 18 384 384 ASP ASP B . n D 1 19 PHE 19 385 385 PHE PHE B . n D 1 20 SER 20 386 386 SER SER B . n D 1 21 PRO 21 387 387 PRO PRO B . n D 1 22 LEU 22 388 388 LEU LEU B . n D 1 23 LEU 23 389 389 LEU LEU B . n D 1 24 SER 24 390 390 SER SER B . n D 1 25 GLY 25 391 391 GLY GLY B . n D 1 26 THR 26 392 392 THR THR B . n D 1 27 PRO 27 393 393 PRO PRO B . n D 1 28 PRO 28 394 394 PRO PRO B . n D 1 29 GLN 29 395 395 GLN GLN B . n D 1 30 VAL 30 396 396 VAL VAL B . n D 1 31 TYR 31 397 397 TYR TYR B . n D 1 32 ASN 32 398 398 ASN ASN B . n D 1 33 PHE 33 399 399 PHE PHE B . n D 1 34 LYS 34 400 400 LYS LYS B . n D 1 35 ARG 35 401 401 ARG ARG B . n D 1 36 LEU 36 402 402 LEU LEU B . n D 1 37 VAL 37 403 403 VAL VAL B . n D 1 38 PHE 38 404 404 PHE PHE B . n D 1 39 THR 39 405 405 THR THR B . n D 1 40 ASN 40 406 406 ASN ASN B . n D 1 41 CYS 41 407 407 CYS CYS B . n D 1 42 ASN 42 408 408 ASN ASN B . n D 1 43 TYR 43 409 409 TYR TYR B . n D 1 44 ASN 44 410 410 ASN ASN B . n D 1 45 LEU 45 411 411 LEU LEU B . n D 1 46 THR 46 412 412 THR THR B . n D 1 47 LYS 47 413 413 LYS LYS B . n D 1 48 LEU 48 414 414 LEU LEU B . n D 1 49 LEU 49 415 415 LEU LEU B . n D 1 50 SER 50 416 416 SER SER B . n D 1 51 LEU 51 417 417 LEU LEU B . n D 1 52 PHE 52 418 418 PHE PHE B . n D 1 53 SER 53 419 419 SER SER B . n D 1 54 VAL 54 420 420 VAL VAL B . n D 1 55 ASN 55 421 421 ASN ASN B . n D 1 56 ASP 56 422 422 ASP ASP B . n D 1 57 PHE 57 423 423 PHE PHE B . n D 1 58 THR 58 424 424 THR THR B . n D 1 59 CYS 59 425 425 CYS CYS B . n D 1 60 SER 60 426 426 SER SER B . n D 1 61 GLN 61 427 427 GLN GLN B . n D 1 62 ILE 62 428 428 ILE ILE B . n D 1 63 SER 63 429 429 SER SER B . n D 1 64 PRO 64 430 430 PRO PRO B . n D 1 65 ALA 65 431 431 ALA ALA B . n D 1 66 ALA 66 432 432 ALA ALA B . n D 1 67 ILE 67 433 433 ILE ILE B . n D 1 68 ALA 68 434 434 ALA ALA B . n D 1 69 SER 69 435 435 SER SER B . n D 1 70 ASN 70 436 436 ASN ASN B . n D 1 71 CYS 71 437 437 CYS CYS B . n D 1 72 TYR 72 438 438 TYR TYR B . n D 1 73 SER 73 439 439 SER SER B . n D 1 74 SER 74 440 440 SER SER B . n D 1 75 LEU 75 441 441 LEU LEU B . n D 1 76 ILE 76 442 442 ILE ILE B . n D 1 77 LEU 77 443 443 LEU LEU B . n D 1 78 ASP 78 444 444 ASP ASP B . n D 1 79 TYR 79 445 445 TYR TYR B . n D 1 80 PHE 80 446 446 PHE PHE B . n D 1 81 SER 81 447 447 SER SER B . n D 1 82 TYR 82 448 448 TYR TYR B . n D 1 83 PRO 83 449 449 PRO PRO B . n D 1 84 LEU 84 450 450 LEU LEU B . n D 1 85 SER 85 451 451 SER SER B . n D 1 86 MET 86 452 452 MET MET B . n D 1 87 LYS 87 453 453 LYS LYS B . n D 1 88 SER 88 454 454 SER SER B . n D 1 89 ASP 89 455 455 ASP ASP B . n D 1 90 LEU 90 456 456 LEU LEU B . n D 1 91 SER 91 457 457 SER SER B . n D 1 92 VAL 92 458 458 VAL VAL B . n D 1 93 SER 93 459 459 SER SER B . n D 1 94 SER 94 460 460 SER SER B . n D 1 95 ALA 95 461 461 ALA ALA B . n D 1 96 GLY 96 462 462 GLY GLY B . n D 1 97 PRO 97 463 463 PRO PRO B . n D 1 98 ILE 98 464 464 ILE ILE B . n D 1 99 SER 99 465 465 SER SER B . n D 1 100 GLN 100 466 466 GLN GLN B . n D 1 101 PHE 101 467 467 PHE PHE B . n D 1 102 ASN 102 468 468 ASN ASN B . n D 1 103 TYR 103 469 469 TYR TYR B . n D 1 104 LYS 104 470 470 LYS LYS B . n D 1 105 GLN 105 471 471 GLN GLN B . n D 1 106 SER 106 472 472 SER SER B . n D 1 107 PHE 107 473 473 PHE PHE B . n D 1 108 SER 108 474 474 SER SER B . n D 1 109 ASN 109 475 475 ASN ASN B . n D 1 110 PRO 110 476 476 PRO PRO B . n D 1 111 THR 111 477 477 THR THR B . n D 1 112 CYS 112 478 478 CYS CYS B . n D 1 113 LEU 113 479 479 LEU LEU B . n D 1 114 ILE 114 480 480 ILE ILE B . n D 1 115 LEU 115 481 481 LEU LEU B . n D 1 116 ALA 116 482 482 ALA ALA B . n D 1 117 THR 117 483 483 THR THR B . n D 1 118 VAL 118 484 484 VAL VAL B . n D 1 119 PRO 119 485 485 PRO PRO B . n D 1 120 HIS 120 486 486 HIS HIS B . n D 1 121 ASN 121 487 487 ASN ASN B . n D 1 122 LEU 122 488 488 LEU LEU B . n D 1 123 THR 123 489 489 THR THR B . n D 1 124 THR 124 490 490 THR THR B . n D 1 125 ILE 125 491 491 ILE ILE B . n D 1 126 THR 126 492 492 THR THR B . n D 1 127 LYS 127 493 493 LYS LYS B . n D 1 128 PRO 128 494 494 PRO PRO B . n D 1 129 LEU 129 495 495 LEU LEU B . n D 1 130 LYS 130 496 496 LYS LYS B . n D 1 131 TYR 131 497 497 TYR TYR B . n D 1 132 SER 132 498 498 SER SER B . n D 1 133 TYR 133 499 499 TYR TYR B . n D 1 134 ILE 134 500 500 ILE ILE B . n D 1 135 ASN 135 501 501 ASN ASN B . n D 1 136 LYS 136 502 502 LYS LYS B . n D 1 137 CYS 137 503 503 CYS CYS B . n D 1 138 SER 138 504 504 SER SER B . n D 1 139 ARG 139 505 505 ARG ARG B . n D 1 140 PHE 140 506 506 PHE PHE B . n D 1 141 LEU 141 507 507 LEU LEU B . n D 1 142 SER 142 508 508 SER SER B . n D 1 143 ASP 143 509 509 ASP ASP B . n D 1 144 ASP 144 510 510 ASP ASP B . n D 1 145 ARG 145 511 511 ARG ARG B . n D 1 146 THR 146 512 512 THR THR B . n D 1 147 GLU 147 513 513 GLU GLU B . n D 1 148 VAL 148 514 514 VAL VAL B . n D 1 149 PRO 149 515 515 PRO PRO B . n D 1 150 GLN 150 516 516 GLN GLN B . n D 1 151 LEU 151 517 517 LEU LEU B . n D 1 152 VAL 152 518 518 VAL VAL B . n D 1 153 ASN 153 519 519 ASN ASN B . n D 1 154 ALA 154 520 520 ALA ALA B . n D 1 155 ASN 155 521 521 ASN ASN B . n D 1 156 GLN 156 522 522 GLN GLN B . n D 1 157 TYR 157 523 523 TYR TYR B . n D 1 158 SER 158 524 524 SER SER B . n D 1 159 PRO 159 525 525 PRO PRO B . n D 1 160 CYS 160 526 526 CYS CYS B . n D 1 161 VAL 161 527 527 VAL VAL B . n D 1 162 SER 162 528 528 SER SER B . n D 1 163 ILE 163 529 529 ILE ILE B . n D 1 164 VAL 164 530 530 VAL VAL B . n D 1 165 PRO 165 531 531 PRO PRO B . n D 1 166 SER 166 532 532 SER SER B . n D 1 167 THR 167 533 533 THR THR B . n D 1 168 VAL 168 534 534 VAL VAL B . n D 1 169 TRP 169 535 535 TRP TRP B . n D 1 170 GLU 170 536 536 GLU GLU B . n D 1 171 ASP 171 537 537 ASP ASP B . n D 1 172 GLY 172 538 538 GLY GLY B . n D 1 173 ASP 173 539 539 ASP ASP B . n D 1 174 TYR 174 540 540 TYR TYR B . n D 1 175 TYR 175 541 541 TYR TYR B . n D 1 176 ARG 176 542 542 ARG ARG B . n D 1 177 LYS 177 543 543 LYS LYS B . n D 1 178 GLN 178 544 544 GLN GLN B . n D 1 179 LEU 179 545 545 LEU LEU B . n D 1 180 SER 180 546 546 SER SER B . n D 1 181 PRO 181 547 547 PRO PRO B . n D 1 182 LEU 182 548 548 LEU LEU B . n D 1 183 GLU 183 549 549 GLU GLU B . n D 1 184 GLY 184 550 550 GLY GLY B . n D 1 185 GLY 185 551 551 GLY GLY B . n D 1 186 GLY 186 552 552 GLY GLY B . n D 1 187 TRP 187 553 553 TRP TRP B . n D 1 188 LEU 188 554 554 LEU LEU B . n D 1 189 VAL 189 555 555 VAL VAL B . n D 1 190 ALA 190 556 556 ALA ALA B . n D 1 191 SER 191 557 557 SER SER B . n D 1 192 GLY 192 558 558 GLY GLY B . n D 1 193 SER 193 559 559 SER SER B . n D 1 194 THR 194 560 560 THR THR B . n D 1 195 VAL 195 561 561 VAL VAL B . n D 1 196 ALA 196 562 562 ALA ALA B . n D 1 197 MET 197 563 563 MET MET B . n D 1 198 THR 198 564 564 THR THR B . n D 1 199 GLU 199 565 565 GLU GLU B . n D 1 200 GLN 200 566 566 GLN GLN B . n D 1 201 LEU 201 567 567 LEU LEU B . n D 1 202 GLN 202 568 568 GLN GLN B . n D 1 203 MET 203 569 569 MET MET B . n D 1 204 GLY 204 570 570 GLY GLY B . n D 1 205 PHE 205 571 571 PHE PHE B . n D 1 206 GLY 206 572 572 GLY GLY B . n D 1 207 ILE 207 573 573 ILE ILE B . n D 1 208 THR 208 574 574 THR THR B . n D 1 209 VAL 209 575 575 VAL VAL B . n D 1 210 GLN 210 576 576 GLN GLN B . n D 1 211 TYR 211 577 577 TYR TYR B . n D 1 212 GLY 212 578 578 GLY GLY B . n D 1 213 THR 213 579 579 THR THR B . n D 1 214 ASP 214 580 580 ASP ASP B . n D 1 215 THR 215 581 581 THR THR B . n D 1 216 ASN 216 582 582 ASN ASN B . n D 1 217 SER 217 583 583 SER SER B . n D 1 218 VAL 218 584 584 VAL VAL B . n D 1 219 CYS 219 585 585 CYS CYS B . n D 1 220 PRO 220 586 586 PRO PRO B . n D 1 221 LYS 221 587 587 LYS LYS B . n D 1 222 LEU 222 588 588 LEU LEU B . n D 1 223 GLU 223 589 589 GLU GLU B . n D 1 224 PHE 224 590 590 PHE PHE B . n D 1 225 ALA 225 591 591 ALA ALA B . n D 1 226 ASN 226 592 ? ? ? B . n D 1 227 ASP 227 593 ? ? ? B . n D 1 228 THR 228 594 ? ? ? B . n D 1 229 LYS 229 595 ? ? ? B . n D 1 230 ILE 230 596 ? ? ? B . n D 1 231 ALA 231 597 ? ? ? B . n D 1 232 SER 232 598 ? ? ? B . n D 1 233 GLN 233 599 ? ? ? B . n D 1 234 LEU 234 600 ? ? ? B . n D 1 235 GLY 235 601 ? ? ? B . n D 1 236 GLY 236 602 ? ? ? B . n D 1 237 SER 237 603 ? ? ? B . n D 1 238 LEU 238 604 ? ? ? B . n D 1 239 GLU 239 605 ? ? ? B . n D 1 240 VAL 240 606 ? ? ? B . n D 1 241 LEU 241 607 ? ? ? B . n D 1 242 PHE 242 608 ? ? ? B . n D 1 243 GLN 243 609 ? ? ? B . n D 1 244 GLY 244 610 ? ? ? B . n D 1 245 PRO 245 611 ? ? ? B . n D 1 246 GLY 246 612 ? ? ? B . n D 1 247 HIS 247 613 ? ? ? B . n D 1 248 HIS 248 614 ? ? ? B . n D 1 249 HIS 249 615 ? ? ? B . n D 1 250 HIS 250 616 ? ? ? B . n D 1 251 HIS 251 617 ? ? ? B . n D 1 252 HIS 252 618 ? ? ? B . n E 2 1 GLN 1 1 1 GLN GLN D . n E 2 2 VAL 2 2 2 VAL VAL D . n E 2 3 GLN 3 3 3 GLN GLN D . n E 2 4 LEU 4 4 4 LEU LEU D . n E 2 5 VAL 5 5 5 VAL VAL D . n E 2 6 GLN 6 6 6 GLN GLN D . n E 2 7 SER 7 7 7 SER SER D . n E 2 8 GLY 8 8 8 GLY GLY D . n E 2 9 ALA 9 9 9 ALA ALA D . n E 2 10 GLU 10 10 10 GLU GLU D . n E 2 11 VAL 11 11 11 VAL VAL D . n E 2 12 LYS 12 12 12 LYS LYS D . n E 2 13 LYS 13 13 13 LYS LYS D . n E 2 14 PRO 14 14 14 PRO PRO D . n E 2 15 GLY 15 15 15 GLY GLY D . n E 2 16 SER 16 16 16 SER SER D . n E 2 17 SER 17 17 17 SER SER D . n E 2 18 VAL 18 18 18 VAL VAL D . n E 2 19 LYS 19 19 19 LYS LYS D . n E 2 20 VAL 20 20 20 VAL VAL D . n E 2 21 SER 21 21 21 SER SER D . n E 2 22 CYS 22 22 22 CYS CYS D . n E 2 23 LYS 23 23 23 LYS LYS D . n E 2 24 ALA 24 24 24 ALA ALA D . n E 2 25 SER 25 25 25 SER SER D . n E 2 26 GLY 26 26 26 GLY GLY D . n E 2 27 GLY 27 27 27 GLY GLY D . n E 2 28 THR 28 28 28 THR THR D . n E 2 29 PHE 29 29 29 PHE PHE D . n E 2 30 SER 30 30 30 SER SER D . n E 2 31 SER 31 31 31 SER SER D . n E 2 32 TYR 32 32 32 TYR TYR D . n E 2 33 ALA 33 33 33 ALA ALA D . n E 2 34 ILE 34 34 34 ILE ILE D . n E 2 35 SER 35 35 35 SER SER D . n E 2 36 TRP 36 36 36 TRP TRP D . n E 2 37 VAL 37 37 37 VAL VAL D . n E 2 38 ARG 38 38 38 ARG ARG D . n E 2 39 GLN 39 39 39 GLN GLN D . n E 2 40 ALA 40 40 40 ALA ALA D . n E 2 41 PRO 41 41 41 PRO PRO D . n E 2 42 GLY 42 42 42 GLY GLY D . n E 2 43 GLN 43 43 43 GLN GLN D . n E 2 44 GLY 44 44 44 GLY GLY D . n E 2 45 LEU 45 45 45 LEU LEU D . n E 2 46 GLU 46 46 46 GLU GLU D . n E 2 47 TRP 47 47 47 TRP TRP D . n E 2 48 MET 48 48 48 MET MET D . n E 2 49 GLY 49 49 49 GLY GLY D . n E 2 50 GLY 50 50 50 GLY GLY D . n E 2 51 ILE 51 51 51 ILE ILE D . n E 2 52 ILE 52 52 52 ILE ILE D . n E 2 53 PRO 53 52 52 PRO PRO D A n E 2 54 ILE 54 53 53 ILE ILE D . n E 2 55 PHE 55 54 54 PHE PHE D . n E 2 56 GLY 56 55 55 GLY GLY D . n E 2 57 THR 57 56 56 THR THR D . n E 2 58 ALA 58 57 57 ALA ALA D . n E 2 59 SER 59 58 58 SER SER D . n E 2 60 TYR 60 59 59 TYR TYR D . n E 2 61 ALA 61 60 60 ALA ALA D . n E 2 62 GLN 62 61 61 GLN GLN D . n E 2 63 LYS 63 62 62 LYS LYS D . n E 2 64 PHE 64 63 63 PHE PHE D . n E 2 65 GLN 65 64 64 GLN GLN D . n E 2 66 GLY 66 65 65 GLY GLY D . n E 2 67 ARG 67 66 66 ARG ARG D . n E 2 68 VAL 68 67 67 VAL VAL D . n E 2 69 THR 69 68 68 THR THR D . n E 2 70 ILE 70 69 69 ILE ILE D . n E 2 71 THR 71 70 70 THR THR D . n E 2 72 ALA 72 71 71 ALA ALA D . n E 2 73 ASP 73 72 72 ASP ASP D . n E 2 74 LYS 74 73 73 LYS LYS D . n E 2 75 SER 75 74 74 SER SER D . n E 2 76 THR 76 75 75 THR THR D . n E 2 77 SER 77 76 76 SER SER D . n E 2 78 THR 78 77 77 THR THR D . n E 2 79 ALA 79 78 78 ALA ALA D . n E 2 80 TYR 80 79 79 TYR TYR D . n E 2 81 MET 81 80 80 MET MET D . n E 2 82 GLU 82 81 81 GLU GLU D . n E 2 83 LEU 83 82 82 LEU LEU D . n E 2 84 SER 84 82 82 SER SER D A n E 2 85 SER 85 82 82 SER SER D B n E 2 86 LEU 86 82 82 LEU LEU D C n E 2 87 ARG 87 83 83 ARG ARG D . n E 2 88 SER 88 84 84 SER SER D . n E 2 89 GLU 89 85 85 GLU GLU D . n E 2 90 ASP 90 86 86 ASP ASP D . n E 2 91 THR 91 87 87 THR THR D . n E 2 92 ALA 92 88 88 ALA ALA D . n E 2 93 VAL 93 89 89 VAL VAL D . n E 2 94 TYR 94 90 90 TYR TYR D . n E 2 95 TYR 95 91 91 TYR TYR D . n E 2 96 CYS 96 92 92 CYS CYS D . n E 2 97 ALA 97 93 93 ALA ALA D . n E 2 98 ARG 98 94 94 ARG ARG D . n E 2 99 VAL 99 95 95 VAL VAL D . n E 2 100 GLY 100 96 96 GLY GLY D . n E 2 101 TYR 101 97 97 TYR TYR D . n E 2 102 CYS 102 98 98 CYS CYS D . n E 2 103 SER 103 99 99 SER SER D . n E 2 104 SER 104 100 100 SER SER D . n E 2 105 THR 105 100 100 THR THR D A n E 2 106 SER 106 100 100 SER SER D B n E 2 107 CYS 107 100 100 CYS CYS D C n E 2 108 ASN 108 100 100 ASN ASN D D n E 2 109 ARG 109 100 100 ARG ARG D E n E 2 110 GLY 110 100 100 GLY GLY D F n E 2 111 ALA 111 100 100 ALA ALA D G n E 2 112 PHE 112 100 100 PHE PHE D H n E 2 113 ASP 113 101 101 ASP ASP D . n E 2 114 ILE 114 102 102 ILE ILE D . n E 2 115 TRP 115 103 103 TRP TRP D . n E 2 116 GLY 116 104 104 GLY GLY D . n E 2 117 GLN 117 105 105 GLN GLN D . n E 2 118 GLY 118 106 106 GLY GLY D . n E 2 119 THR 119 107 107 THR THR D . n E 2 120 MET 120 108 108 MET MET D . n E 2 121 VAL 121 109 109 VAL VAL D . n E 2 122 THR 122 110 110 THR THR D . n E 2 123 VAL 123 111 111 VAL VAL D . n E 2 124 SER 124 112 112 SER SER D . n E 2 125 SER 125 113 113 SER SER D . n E 2 126 ALA 126 114 114 ALA ALA D . n E 2 127 SER 127 115 115 SER SER D . n E 2 128 THR 128 116 116 THR THR D . n E 2 129 LYS 129 117 117 LYS LYS D . n E 2 130 GLY 130 118 118 GLY GLY D . n E 2 131 PRO 131 119 119 PRO PRO D . n E 2 132 SER 132 120 120 SER SER D . n E 2 133 VAL 133 121 121 VAL VAL D . n E 2 134 PHE 134 122 122 PHE PHE D . n E 2 135 PRO 135 123 123 PRO PRO D . n E 2 136 LEU 136 124 124 LEU LEU D . n E 2 137 ALA 137 125 125 ALA ALA D . n E 2 138 PRO 138 126 126 PRO PRO D . n E 2 139 SER 139 127 ? ? ? D . n E 2 140 SER 140 128 ? ? ? D . n E 2 141 LYS 141 129 ? ? ? D . n E 2 142 SER 142 130 ? ? ? D . n E 2 143 THR 143 131 ? ? ? D . n E 2 144 SER 144 132 ? ? ? D . n E 2 145 GLY 145 133 ? ? ? D . n E 2 146 GLY 146 134 ? ? ? D . n E 2 147 THR 147 135 135 THR THR D . n E 2 148 ALA 148 136 136 ALA ALA D . n E 2 149 ALA 149 137 137 ALA ALA D . n E 2 150 LEU 150 138 138 LEU LEU D . n E 2 151 GLY 151 139 139 GLY GLY D . n E 2 152 CYS 152 140 140 CYS CYS D . n E 2 153 LEU 153 141 141 LEU LEU D . n E 2 154 VAL 154 142 142 VAL VAL D . n E 2 155 LYS 155 143 143 LYS LYS D . n E 2 156 ASP 156 144 144 ASP ASP D . n E 2 157 TYR 157 145 145 TYR TYR D . n E 2 158 PHE 158 146 146 PHE PHE D . n E 2 159 PRO 159 147 147 PRO PRO D . n E 2 160 GLU 160 148 148 GLU GLU D . n E 2 161 PRO 161 149 149 PRO PRO D . n E 2 162 VAL 162 150 150 VAL VAL D . n E 2 163 THR 163 151 151 THR THR D . n E 2 164 VAL 164 152 152 VAL VAL D . n E 2 165 SER 165 153 153 SER SER D . n E 2 166 TRP 166 154 154 TRP TRP D . n E 2 167 ASN 167 155 155 ASN ASN D . n E 2 168 SER 168 156 156 SER SER D . n E 2 169 GLY 169 157 157 GLY GLY D . n E 2 170 ALA 170 158 158 ALA ALA D . n E 2 171 LEU 171 159 159 LEU LEU D . n E 2 172 THR 172 160 160 THR THR D . n E 2 173 SER 173 161 161 SER SER D . n E 2 174 GLY 174 162 162 GLY GLY D . n E 2 175 VAL 175 163 163 VAL VAL D . n E 2 176 HIS 176 164 164 HIS HIS D . n E 2 177 THR 177 165 165 THR THR D . n E 2 178 PHE 178 166 166 PHE PHE D . n E 2 179 PRO 179 167 167 PRO PRO D . n E 2 180 ALA 180 168 168 ALA ALA D . n E 2 181 VAL 181 169 169 VAL VAL D . n E 2 182 LEU 182 170 170 LEU LEU D . n E 2 183 GLN 183 171 171 GLN GLN D . n E 2 184 SER 184 172 172 SER SER D . n E 2 185 SER 185 173 173 SER SER D . n E 2 186 GLY 186 174 174 GLY GLY D . n E 2 187 LEU 187 175 175 LEU LEU D . n E 2 188 TYR 188 176 176 TYR TYR D . n E 2 189 SER 189 177 177 SER SER D . n E 2 190 LEU 190 178 178 LEU LEU D . n E 2 191 SER 191 179 179 SER SER D . n E 2 192 SER 192 180 180 SER SER D . n E 2 193 VAL 193 181 181 VAL VAL D . n E 2 194 VAL 194 182 182 VAL VAL D . n E 2 195 THR 195 183 183 THR THR D . n E 2 196 VAL 196 184 184 VAL VAL D . n E 2 197 PRO 197 185 185 PRO PRO D . n E 2 198 SER 198 186 186 SER SER D . n E 2 199 SER 199 187 187 SER SER D . n E 2 200 SER 200 188 188 SER SER D . n E 2 201 LEU 201 189 189 LEU LEU D . n E 2 202 GLY 202 190 190 GLY GLY D . n E 2 203 THR 203 191 191 THR THR D . n E 2 204 GLN 204 192 192 GLN GLN D . n E 2 205 THR 205 193 193 THR THR D . n E 2 206 TYR 206 194 194 TYR TYR D . n E 2 207 ILE 207 195 195 ILE ILE D . n E 2 208 CYS 208 196 196 CYS CYS D . n E 2 209 ASN 209 197 197 ASN ASN D . n E 2 210 VAL 210 198 198 VAL VAL D . n E 2 211 ASN 211 199 199 ASN ASN D . n E 2 212 HIS 212 200 200 HIS HIS D . n E 2 213 LYS 213 201 201 LYS LYS D . n E 2 214 PRO 214 202 202 PRO PRO D . n E 2 215 SER 215 203 203 SER SER D . n E 2 216 ASN 216 204 204 ASN ASN D . n E 2 217 THR 217 205 205 THR THR D . n E 2 218 LYS 218 206 206 LYS LYS D . n E 2 219 VAL 219 207 207 VAL VAL D . n E 2 220 ASP 220 208 208 ASP ASP D . n E 2 221 LYS 221 209 209 LYS LYS D . n E 2 222 LYS 222 210 210 LYS LYS D . n E 2 223 VAL 223 211 211 VAL VAL D . n E 2 224 GLU 224 212 212 GLU GLU D . n E 2 225 PRO 225 213 213 PRO PRO D . n E 2 226 LYS 226 214 214 LYS LYS D . n E 2 227 SER 227 215 ? ? ? D . n E 2 228 CYS 228 216 ? ? ? D . n E 2 229 ASP 229 217 ? ? ? D . n E 2 230 LYS 230 218 ? ? ? D . n E 2 231 THR 231 219 ? ? ? D . n E 2 232 SER 232 220 ? ? ? D . n E 2 233 GLY 233 221 ? ? ? D . n E 2 234 GLN 234 222 ? ? ? D . n E 2 235 ALA 235 223 ? ? ? D . n E 2 236 GLY 236 224 ? ? ? D . n E 2 237 HIS 237 225 ? ? ? D . n E 2 238 HIS 238 226 ? ? ? D . n E 2 239 HIS 239 227 ? ? ? D . n E 2 240 HIS 240 228 ? ? ? D . n E 2 241 HIS 241 229 ? ? ? D . n E 2 242 HIS 242 230 ? ? ? D . n E 2 243 GLY 243 231 ? ? ? D . n E 2 244 ASP 244 232 ? ? ? D . n E 2 245 TYR 245 233 ? ? ? D . n E 2 246 LYS 246 234 ? ? ? D . n E 2 247 ASP 247 235 ? ? ? D . n E 2 248 ASP 248 236 ? ? ? D . n E 2 249 ASP 249 237 ? ? ? D . n E 2 250 ASP 250 238 ? ? ? D . n E 2 251 LYS 251 239 ? ? ? D . n E 2 252 GLY 252 240 ? ? ? D . n F 3 1 ASP 1 1 1 ASP ASP E . n F 3 2 ILE 2 2 2 ILE ILE E . n F 3 3 GLN 3 3 3 GLN GLN E . n F 3 4 LEU 4 4 4 LEU LEU E . n F 3 5 THR 5 5 5 THR THR E . n F 3 6 GLN 6 6 6 GLN GLN E . n F 3 7 SER 7 7 7 SER SER E . n F 3 8 PRO 8 8 8 PRO PRO E . n F 3 9 SER 9 9 9 SER SER E . n F 3 10 SER 10 10 10 SER SER E . n F 3 11 LEU 11 11 11 LEU LEU E . n F 3 12 SER 12 12 12 SER SER E . n F 3 13 ALA 13 13 13 ALA ALA E . n F 3 14 SER 14 14 14 SER SER E . n F 3 15 VAL 15 15 15 VAL VAL E . n F 3 16 GLY 16 16 16 GLY GLY E . n F 3 17 ASP 17 17 17 ASP ASP E . n F 3 18 ARG 18 18 18 ARG ARG E . n F 3 19 VAL 19 19 19 VAL VAL E . n F 3 20 THR 20 20 20 THR THR E . n F 3 21 ILE 21 21 21 ILE ILE E . n F 3 22 THR 22 22 22 THR THR E . n F 3 23 CYS 23 23 23 CYS CYS E . n F 3 24 ARG 24 24 24 ARG ARG E . n F 3 25 ALA 25 25 25 ALA ALA E . n F 3 26 SER 26 26 26 SER SER E . n F 3 27 GLN 27 27 27 GLN GLN E . n F 3 28 GLY 28 28 28 GLY GLY E . n F 3 29 ILE 29 29 29 ILE ILE E . n F 3 30 ARG 30 30 30 ARG ARG E . n F 3 31 ASN 31 31 31 ASN ASN E . n F 3 32 ASP 32 32 32 ASP ASP E . n F 3 33 LEU 33 33 33 LEU LEU E . n F 3 34 GLY 34 34 34 GLY GLY E . n F 3 35 TRP 35 35 35 TRP TRP E . n F 3 36 TYR 36 36 36 TYR TYR E . n F 3 37 GLN 37 37 37 GLN GLN E . n F 3 38 GLN 38 38 38 GLN GLN E . n F 3 39 LYS 39 39 39 LYS LYS E . n F 3 40 PRO 40 40 40 PRO PRO E . n F 3 41 GLY 41 41 41 GLY GLY E . n F 3 42 LYS 42 42 42 LYS LYS E . n F 3 43 ALA 43 43 43 ALA ALA E . n F 3 44 PRO 44 44 44 PRO PRO E . n F 3 45 LYS 45 45 45 LYS LYS E . n F 3 46 LEU 46 46 46 LEU LEU E . n F 3 47 LEU 47 47 47 LEU LEU E . n F 3 48 ILE 48 48 48 ILE ILE E . n F 3 49 TYR 49 49 49 TYR TYR E . n F 3 50 ALA 50 50 50 ALA ALA E . n F 3 51 ALA 51 51 51 ALA ALA E . n F 3 52 SER 52 52 52 SER SER E . n F 3 53 SER 53 53 53 SER SER E . n F 3 54 LEU 54 54 54 LEU LEU E . n F 3 55 GLN 55 55 55 GLN GLN E . n F 3 56 SER 56 56 56 SER SER E . n F 3 57 GLY 57 57 57 GLY GLY E . n F 3 58 VAL 58 58 58 VAL VAL E . n F 3 59 PRO 59 59 59 PRO PRO E . n F 3 60 SER 60 60 60 SER SER E . n F 3 61 ARG 61 61 61 ARG ARG E . n F 3 62 PHE 62 62 62 PHE PHE E . n F 3 63 SER 63 63 63 SER SER E . n F 3 64 GLY 64 64 64 GLY GLY E . n F 3 65 SER 65 65 65 SER SER E . n F 3 66 GLY 66 66 66 GLY GLY E . n F 3 67 SER 67 67 67 SER SER E . n F 3 68 GLY 68 68 68 GLY GLY E . n F 3 69 THR 69 69 69 THR THR E . n F 3 70 ASP 70 70 70 ASP ASP E . n F 3 71 PHE 71 71 71 PHE PHE E . n F 3 72 THR 72 72 72 THR THR E . n F 3 73 LEU 73 73 73 LEU LEU E . n F 3 74 THR 74 74 74 THR THR E . n F 3 75 ILE 75 75 75 ILE ILE E . n F 3 76 SER 76 76 76 SER SER E . n F 3 77 SER 77 77 77 SER SER E . n F 3 78 LEU 78 78 78 LEU LEU E . n F 3 79 GLN 79 79 79 GLN GLN E . n F 3 80 PRO 80 80 80 PRO PRO E . n F 3 81 GLU 81 81 81 GLU GLU E . n F 3 82 ASP 82 82 82 ASP ASP E . n F 3 83 PHE 83 83 83 PHE PHE E . n F 3 84 ALA 84 84 84 ALA ALA E . n F 3 85 THR 85 85 85 THR THR E . n F 3 86 TYR 86 86 86 TYR TYR E . n F 3 87 TYR 87 87 87 TYR TYR E . n F 3 88 CYS 88 88 88 CYS CYS E . n F 3 89 GLN 89 89 89 GLN GLN E . n F 3 90 GLN 90 90 90 GLN GLN E . n F 3 91 LEU 91 91 91 LEU LEU E . n F 3 92 ASN 92 92 92 ASN ASN E . n F 3 93 SER 93 93 93 SER SER E . n F 3 94 TYR 94 94 94 TYR TYR E . n F 3 95 PRO 95 95 95 PRO PRO E . n F 3 96 LEU 96 96 96 LEU LEU E . n F 3 97 THR 97 97 97 THR THR E . n F 3 98 PHE 98 98 98 PHE PHE E . n F 3 99 GLY 99 99 99 GLY GLY E . n F 3 100 GLY 100 100 100 GLY GLY E . n F 3 101 GLY 101 101 101 GLY GLY E . n F 3 102 THR 102 102 102 THR THR E . n F 3 103 LYS 103 103 103 LYS LYS E . n F 3 104 VAL 104 104 104 VAL VAL E . n F 3 105 GLU 105 105 105 GLU GLU E . n F 3 106 ILE 106 106 106 ILE ILE E . n F 3 107 LYS 107 107 107 LYS LYS E . n F 3 108 ARG 108 108 108 ARG ARG E . n F 3 109 THR 109 109 109 THR THR E . n F 3 110 VAL 110 110 110 VAL VAL E . n F 3 111 ALA 111 111 111 ALA ALA E . n F 3 112 ALA 112 112 112 ALA ALA E . n F 3 113 PRO 113 113 113 PRO PRO E . n F 3 114 SER 114 114 114 SER SER E . n F 3 115 VAL 115 115 115 VAL VAL E . n F 3 116 PHE 116 116 116 PHE PHE E . n F 3 117 ILE 117 117 117 ILE ILE E . n F 3 118 PHE 118 118 118 PHE PHE E . n F 3 119 PRO 119 119 119 PRO PRO E . n F 3 120 PRO 120 120 120 PRO PRO E . n F 3 121 SER 121 121 121 SER SER E . n F 3 122 ASP 122 122 122 ASP ASP E . n F 3 123 GLU 123 123 123 GLU GLU E . n F 3 124 GLN 124 124 124 GLN GLN E . n F 3 125 LEU 125 125 125 LEU LEU E . n F 3 126 LYS 126 126 126 LYS LYS E . n F 3 127 SER 127 127 127 SER SER E . n F 3 128 GLY 128 128 128 GLY GLY E . n F 3 129 THR 129 129 129 THR THR E . n F 3 130 ALA 130 130 130 ALA ALA E . n F 3 131 SER 131 131 131 SER SER E . n F 3 132 VAL 132 132 132 VAL VAL E . n F 3 133 VAL 133 133 133 VAL VAL E . n F 3 134 CYS 134 134 134 CYS CYS E . n F 3 135 LEU 135 135 135 LEU LEU E . n F 3 136 LEU 136 136 136 LEU LEU E . n F 3 137 ASN 137 137 137 ASN ASN E . n F 3 138 ASN 138 138 138 ASN ASN E . n F 3 139 PHE 139 139 139 PHE PHE E . n F 3 140 TYR 140 140 140 TYR TYR E . n F 3 141 PRO 141 141 141 PRO PRO E . n F 3 142 ARG 142 142 142 ARG ARG E . n F 3 143 GLU 143 143 143 GLU GLU E . n F 3 144 ALA 144 144 144 ALA ALA E . n F 3 145 LYS 145 145 145 LYS LYS E . n F 3 146 VAL 146 146 146 VAL VAL E . n F 3 147 GLN 147 147 147 GLN GLN E . n F 3 148 TRP 148 148 148 TRP TRP E . n F 3 149 LYS 149 149 149 LYS LYS E . n F 3 150 VAL 150 150 150 VAL VAL E . n F 3 151 ASP 151 151 ? ? ? E . n F 3 152 ASN 152 152 ? ? ? E . n F 3 153 ALA 153 153 ? ? ? E . n F 3 154 LEU 154 154 ? ? ? E . n F 3 155 GLN 155 155 155 GLN GLN E . n F 3 156 SER 156 156 156 SER SER E . n F 3 157 GLY 157 157 157 GLY GLY E . n F 3 158 ASN 158 158 158 ASN ASN E . n F 3 159 SER 159 159 159 SER SER E . n F 3 160 GLN 160 160 160 GLN GLN E . n F 3 161 GLU 161 161 161 GLU GLU E . n F 3 162 SER 162 162 162 SER SER E . n F 3 163 VAL 163 163 163 VAL VAL E . n F 3 164 THR 164 164 164 THR THR E . n F 3 165 GLU 165 165 165 GLU GLU E . n F 3 166 GLN 166 166 166 GLN GLN E . n F 3 167 ASP 167 167 167 ASP ASP E . n F 3 168 SER 168 168 168 SER SER E . n F 3 169 LYS 169 169 169 LYS LYS E . n F 3 170 ASP 170 170 170 ASP ASP E . n F 3 171 SER 171 171 171 SER SER E . n F 3 172 THR 172 172 172 THR THR E . n F 3 173 TYR 173 173 173 TYR TYR E . n F 3 174 SER 174 174 174 SER SER E . n F 3 175 LEU 175 175 175 LEU LEU E . n F 3 176 SER 176 176 176 SER SER E . n F 3 177 SER 177 177 177 SER SER E . n F 3 178 THR 178 178 178 THR THR E . n F 3 179 LEU 179 179 179 LEU LEU E . n F 3 180 THR 180 180 180 THR THR E . n F 3 181 LEU 181 181 181 LEU LEU E . n F 3 182 SER 182 182 182 SER SER E . n F 3 183 LYS 183 183 183 LYS LYS E . n F 3 184 ALA 184 184 184 ALA ALA E . n F 3 185 ASP 185 185 185 ASP ASP E . n F 3 186 TYR 186 186 186 TYR TYR E . n F 3 187 GLU 187 187 187 GLU GLU E . n F 3 188 LYS 188 188 188 LYS LYS E . n F 3 189 HIS 189 189 189 HIS HIS E . n F 3 190 LYS 190 190 190 LYS LYS E . n F 3 191 VAL 191 191 191 VAL VAL E . n F 3 192 TYR 192 192 192 TYR TYR E . n F 3 193 ALA 193 193 193 ALA ALA E . n F 3 194 CYS 194 194 194 CYS CYS E . n F 3 195 GLU 195 195 195 GLU GLU E . n F 3 196 VAL 196 196 196 VAL VAL E . n F 3 197 THR 197 197 197 THR THR E . n F 3 198 HIS 198 198 198 HIS HIS E . n F 3 199 GLN 199 199 199 GLN GLN E . n F 3 200 GLY 200 200 200 GLY GLY E . n F 3 201 LEU 201 201 201 LEU LEU E . n F 3 202 SER 202 202 202 SER SER E . n F 3 203 SER 203 203 203 SER SER E . n F 3 204 PRO 204 204 204 PRO PRO E . n F 3 205 VAL 205 205 205 VAL VAL E . n F 3 206 THR 206 206 206 THR THR E . n F 3 207 LYS 207 207 207 LYS LYS E . n F 3 208 SER 208 208 208 SER SER E . n F 3 209 PHE 209 209 209 PHE PHE E . n F 3 210 ASN 210 210 210 ASN ASN E . n F 3 211 ARG 211 211 211 ARG ARG E . n F 3 212 GLY 212 212 ? ? ? E . n F 3 213 GLU 213 213 ? ? ? E . n F 3 214 CYS 214 214 ? ? ? E . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code G 4 NAG 1 701 910 NAG NAG A . H 4 NAG 1 702 987 NAG NAG A . I 5 GOL 1 500 500 GOL GOL L . J 5 GOL 1 501 501 GOL GOL L . K 4 NAG 1 701 910 NAG NAG B . L 4 NAG 1 702 987 NAG NAG B . M 6 HOH 1 801 39 HOH HOH A . M 6 HOH 2 802 4 HOH HOH A . M 6 HOH 3 803 56 HOH HOH A . M 6 HOH 4 804 140 HOH HOH A . M 6 HOH 5 805 44 HOH HOH A . M 6 HOH 6 806 88 HOH HOH A . M 6 HOH 7 807 25 HOH HOH A . M 6 HOH 8 808 148 HOH HOH A . M 6 HOH 9 809 90 HOH HOH A . M 6 HOH 10 810 108 HOH HOH A . M 6 HOH 11 811 56 HOH HOH A . M 6 HOH 12 812 134 HOH HOH A . M 6 HOH 13 813 136 HOH HOH A . M 6 HOH 14 814 173 HOH HOH A . M 6 HOH 15 815 10 HOH HOH A . M 6 HOH 16 816 13 HOH HOH A . M 6 HOH 17 817 15 HOH HOH A . M 6 HOH 18 818 16 HOH HOH A . M 6 HOH 19 819 23 HOH HOH A . M 6 HOH 20 820 24 HOH HOH A . M 6 HOH 21 821 27 HOH HOH A . M 6 HOH 22 822 35 HOH HOH A . M 6 HOH 23 823 49 HOH HOH A . M 6 HOH 24 824 51 HOH HOH A . M 6 HOH 25 825 55 HOH HOH A . M 6 HOH 26 826 57 HOH HOH A . M 6 HOH 27 827 65 HOH HOH A . M 6 HOH 28 828 67 HOH HOH A . M 6 HOH 29 829 68 HOH HOH A . M 6 HOH 30 830 69 HOH HOH A . M 6 HOH 31 831 77 HOH HOH A . M 6 HOH 32 832 82 HOH HOH A . M 6 HOH 33 833 84 HOH HOH A . M 6 HOH 34 834 94 HOH HOH A . M 6 HOH 35 835 95 HOH HOH A . M 6 HOH 36 836 97 HOH HOH A . M 6 HOH 37 837 99 HOH HOH A . M 6 HOH 38 838 143 HOH HOH A . M 6 HOH 39 839 162 HOH HOH A . M 6 HOH 40 840 167 HOH HOH A . M 6 HOH 41 841 170 HOH HOH A . M 6 HOH 42 842 57 HOH HOH A . M 6 HOH 43 843 58 HOH HOH A . M 6 HOH 44 844 59 HOH HOH A . M 6 HOH 45 845 60 HOH HOH A . M 6 HOH 46 846 61 HOH HOH A . M 6 HOH 47 847 62 HOH HOH A . M 6 HOH 48 848 64 HOH HOH A . N 6 HOH 1 301 7 HOH HOH H . N 6 HOH 2 302 125 HOH HOH H . N 6 HOH 3 303 85 HOH HOH H . N 6 HOH 4 304 116 HOH HOH H . N 6 HOH 5 305 163 HOH HOH H . N 6 HOH 6 306 38 HOH HOH H . N 6 HOH 7 307 11 HOH HOH H . N 6 HOH 8 308 123 HOH HOH H . N 6 HOH 9 309 10 HOH HOH H . N 6 HOH 10 310 1 HOH HOH H . N 6 HOH 11 311 2 HOH HOH H . N 6 HOH 12 312 7 HOH HOH H . N 6 HOH 13 313 14 HOH HOH H . N 6 HOH 14 314 17 HOH HOH H . N 6 HOH 15 315 28 HOH HOH H . N 6 HOH 16 316 32 HOH HOH H . N 6 HOH 17 317 36 HOH HOH H . N 6 HOH 18 318 37 HOH HOH H . N 6 HOH 19 319 39 HOH HOH H . N 6 HOH 20 320 40 HOH HOH H . N 6 HOH 21 321 48 HOH HOH H . N 6 HOH 22 322 52 HOH HOH H . N 6 HOH 23 323 60 HOH HOH H . N 6 HOH 24 324 61 HOH HOH H . N 6 HOH 25 325 70 HOH HOH H . N 6 HOH 26 326 74 HOH HOH H . N 6 HOH 27 327 75 HOH HOH H . N 6 HOH 28 328 79 HOH HOH H . N 6 HOH 29 329 86 HOH HOH H . N 6 HOH 30 330 92 HOH HOH H . N 6 HOH 31 331 100 HOH HOH H . N 6 HOH 32 332 103 HOH HOH H . N 6 HOH 33 333 107 HOH HOH H . N 6 HOH 34 334 114 HOH HOH H . N 6 HOH 35 335 115 HOH HOH H . N 6 HOH 36 336 118 HOH HOH H . N 6 HOH 37 337 124 HOH HOH H . N 6 HOH 38 338 126 HOH HOH H . N 6 HOH 39 339 127 HOH HOH H . N 6 HOH 40 340 133 HOH HOH H . N 6 HOH 41 341 151 HOH HOH H . N 6 HOH 42 342 154 HOH HOH H . N 6 HOH 43 343 5 HOH HOH H . N 6 HOH 44 344 6 HOH HOH H . N 6 HOH 45 345 8 HOH HOH H . N 6 HOH 46 346 11 HOH HOH H . N 6 HOH 47 347 12 HOH HOH H . N 6 HOH 48 348 15 HOH HOH H . N 6 HOH 49 349 16 HOH HOH H . N 6 HOH 50 350 49 HOH HOH H . N 6 HOH 51 351 50 HOH HOH H . N 6 HOH 52 352 51 HOH HOH H . N 6 HOH 53 353 52 HOH HOH H . N 6 HOH 54 354 55 HOH HOH H . N 6 HOH 55 355 65 HOH HOH H . N 6 HOH 56 356 66 HOH HOH H . O 6 HOH 1 601 158 HOH HOH L . O 6 HOH 2 602 78 HOH HOH L . O 6 HOH 3 603 73 HOH HOH L . O 6 HOH 4 604 98 HOH HOH L . O 6 HOH 5 605 157 HOH HOH L . O 6 HOH 6 606 106 HOH HOH L . O 6 HOH 7 607 43 HOH HOH L . O 6 HOH 8 608 2 HOH HOH L . O 6 HOH 9 609 117 HOH HOH L . O 6 HOH 10 610 155 HOH HOH L . O 6 HOH 11 611 110 HOH HOH L . O 6 HOH 12 612 30 HOH HOH L . O 6 HOH 13 613 111 HOH HOH L . O 6 HOH 14 614 21 HOH HOH L . O 6 HOH 15 615 171 HOH HOH L . O 6 HOH 16 616 67 HOH HOH L . O 6 HOH 17 617 44 HOH HOH L . O 6 HOH 18 618 139 HOH HOH L . O 6 HOH 19 619 46 HOH HOH L . O 6 HOH 20 620 22 HOH HOH L . O 6 HOH 21 621 132 HOH HOH L . O 6 HOH 22 622 3 HOH HOH L . O 6 HOH 23 623 5 HOH HOH L . O 6 HOH 24 624 6 HOH HOH L . O 6 HOH 25 625 12 HOH HOH L . O 6 HOH 26 626 19 HOH HOH L . O 6 HOH 27 627 20 HOH HOH L . O 6 HOH 28 628 22 HOH HOH L . O 6 HOH 29 629 26 HOH HOH L . O 6 HOH 30 630 29 HOH HOH L . O 6 HOH 31 631 33 HOH HOH L . O 6 HOH 32 632 34 HOH HOH L . O 6 HOH 33 633 46 HOH HOH L . O 6 HOH 34 634 47 HOH HOH L . O 6 HOH 35 635 50 HOH HOH L . O 6 HOH 36 636 58 HOH HOH L . O 6 HOH 37 637 66 HOH HOH L . O 6 HOH 38 638 71 HOH HOH L . O 6 HOH 39 639 80 HOH HOH L . O 6 HOH 40 640 81 HOH HOH L . O 6 HOH 41 641 87 HOH HOH L . O 6 HOH 42 642 93 HOH HOH L . O 6 HOH 43 643 96 HOH HOH L . O 6 HOH 44 644 101 HOH HOH L . O 6 HOH 45 645 120 HOH HOH L . O 6 HOH 46 646 135 HOH HOH L . O 6 HOH 47 647 142 HOH HOH L . O 6 HOH 48 648 145 HOH HOH L . O 6 HOH 49 649 146 HOH HOH L . O 6 HOH 50 650 150 HOH HOH L . O 6 HOH 51 651 152 HOH HOH L . O 6 HOH 52 652 159 HOH HOH L . O 6 HOH 53 653 164 HOH HOH L . O 6 HOH 54 654 166 HOH HOH L . O 6 HOH 55 655 168 HOH HOH L . O 6 HOH 56 656 172 HOH HOH L . O 6 HOH 57 657 1 HOH HOH L . O 6 HOH 58 658 3 HOH HOH L . O 6 HOH 59 659 4 HOH HOH L . O 6 HOH 60 660 9 HOH HOH L . O 6 HOH 61 661 13 HOH HOH L . O 6 HOH 62 662 14 HOH HOH L . O 6 HOH 63 663 17 HOH HOH L . O 6 HOH 64 664 18 HOH HOH L . O 6 HOH 65 665 19 HOH HOH L . O 6 HOH 66 666 20 HOH HOH L . O 6 HOH 67 667 23 HOH HOH L . O 6 HOH 68 668 24 HOH HOH L . O 6 HOH 69 669 25 HOH HOH L . O 6 HOH 70 670 26 HOH HOH L . O 6 HOH 71 671 27 HOH HOH L . O 6 HOH 72 672 38 HOH HOH L . O 6 HOH 73 673 41 HOH HOH L . O 6 HOH 74 674 42 HOH HOH L . O 6 HOH 75 675 43 HOH HOH L . O 6 HOH 76 676 47 HOH HOH L . O 6 HOH 77 677 48 HOH HOH L . O 6 HOH 78 678 63 HOH HOH L . O 6 HOH 79 679 68 HOH HOH L . P 6 HOH 1 801 42 HOH HOH B . P 6 HOH 2 802 89 HOH HOH B . P 6 HOH 3 803 31 HOH HOH B . P 6 HOH 4 804 169 HOH HOH B . P 6 HOH 5 805 102 HOH HOH B . P 6 HOH 6 806 9 HOH HOH B . P 6 HOH 7 807 128 HOH HOH B . P 6 HOH 8 808 72 HOH HOH B . P 6 HOH 9 809 36 HOH HOH B . P 6 HOH 10 810 40 HOH HOH B . P 6 HOH 11 811 105 HOH HOH B . P 6 HOH 12 812 45 HOH HOH B . P 6 HOH 13 813 53 HOH HOH B . P 6 HOH 14 814 54 HOH HOH B . P 6 HOH 15 815 59 HOH HOH B . P 6 HOH 16 816 63 HOH HOH B . P 6 HOH 17 817 83 HOH HOH B . P 6 HOH 18 818 109 HOH HOH B . P 6 HOH 19 819 112 HOH HOH B . P 6 HOH 20 820 113 HOH HOH B . P 6 HOH 21 821 119 HOH HOH B . P 6 HOH 22 822 121 HOH HOH B . P 6 HOH 23 823 141 HOH HOH B . P 6 HOH 24 824 144 HOH HOH B . P 6 HOH 25 825 147 HOH HOH B . P 6 HOH 26 826 156 HOH HOH B . P 6 HOH 27 827 165 HOH HOH B . P 6 HOH 28 828 35 HOH HOH B . P 6 HOH 29 829 37 HOH HOH B . P 6 HOH 30 830 54 HOH HOH B . P 6 HOH 31 831 69 HOH HOH B . Q 6 HOH 1 301 131 HOH HOH D . Q 6 HOH 2 302 41 HOH HOH D . Q 6 HOH 3 303 45 HOH HOH D . Q 6 HOH 4 304 62 HOH HOH D . Q 6 HOH 5 305 64 HOH HOH D . Q 6 HOH 6 306 153 HOH HOH D . Q 6 HOH 7 307 160 HOH HOH D . Q 6 HOH 8 308 161 HOH HOH D . Q 6 HOH 9 309 28 HOH HOH D . Q 6 HOH 10 310 30 HOH HOH D . Q 6 HOH 11 311 53 HOH HOH D . R 6 HOH 1 301 91 HOH HOH E . R 6 HOH 2 302 18 HOH HOH E . R 6 HOH 3 303 76 HOH HOH E . R 6 HOH 4 304 129 HOH HOH E . R 6 HOH 5 305 137 HOH HOH E . R 6 HOH 6 306 138 HOH HOH E . R 6 HOH 7 307 29 HOH HOH E . R 6 HOH 8 308 31 HOH HOH E . R 6 HOH 9 309 32 HOH HOH E . R 6 HOH 10 310 33 HOH HOH E . R 6 HOH 11 311 34 HOH HOH E . # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA trimeric 3 2 author_and_software_defined_assembly PISA trimeric 3 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,C,G,H,I,J,M,N,O 2 1 D,E,F,K,L,P,Q,R # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 6850 ? 1 MORE -24 ? 1 'SSA (A^2)' 28660 ? 2 'ABSA (A^2)' 6080 ? 2 MORE -20 ? 2 'SSA (A^2)' 28570 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2015-08-26 2 'Structure model' 1 1 2015-09-23 3 'Structure model' 1 2 2017-11-22 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Derived calculations' 3 3 'Structure model' 'Refinement description' # 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 3 'Structure model' pdbx_struct_oper_list 2 3 'Structure model' software # _pdbx_audit_revision_item.ordinal 1 _pdbx_audit_revision_item.revision_ordinal 3 _pdbx_audit_revision_item.data_content_type 'Structure model' _pdbx_audit_revision_item.item '_pdbx_struct_oper_list.symmetry_operation' # loop_ _pdbx_refine_tls.id _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[1][1]_esd _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][2]_esd _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[1][3]_esd _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[2][2]_esd _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.T[2][3]_esd _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[3][3]_esd _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[1][1]_esd _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][2]_esd _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[1][3]_esd _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[2][2]_esd _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.L[2][3]_esd _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[3][3]_esd _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][1]_esd _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][2]_esd _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[1][3]_esd _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][1]_esd _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][2]_esd _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][3]_esd _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][1]_esd _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][2]_esd _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[3][3]_esd 1 'X-RAY DIFFRACTION' ? refined 11.3605 93.8430 58.5108 0.3443 ? -0.0578 ? 0.1114 ? 0.3861 ? -0.0722 ? 0.3925 ? 4.3742 ? -1.5417 ? -1.4211 ? 2.0473 ? 0.9116 ? 2.7189 ? 0.0759 ? -0.1716 ? 0.0994 ? 0.0410 ? 0.1561 ? -0.0589 ? -0.4030 ? 0.0976 ? -0.2004 ? 2 'X-RAY DIFFRACTION' ? refined 27.5357 78.0268 57.9318 0.3123 ? -0.1146 ? 0.0985 ? 0.4985 ? -0.0677 ? 0.4224 ? 3.7932 ? -2.7461 ? 1.1161 ? 4.0719 ? -0.8794 ? 2.3849 ? 0.0171 ? -0.3997 ? -0.3016 ? 0.3996 ? 0.1109 ? 0.3713 ? 0.0926 ? -0.0858 ? -0.1097 ? 3 'X-RAY DIFFRACTION' ? refined 19.2069 89.6117 60.6101 0.3406 ? -0.1233 ? 0.0976 ? 0.3537 ? -0.0621 ? 0.3822 ? 4.1084 ? -2.3133 ? 0.3956 ? 1.8696 ? -0.0981 ? 1.1654 ? -0.0804 ? -0.1027 ? 0.2523 ? 0.3458 ? 0.0722 ? -0.0024 ? -0.1092 ? 0.0130 ? 0.0200 ? 4 'X-RAY DIFFRACTION' ? refined 54.9952 -11.4981 118.5089 0.4971 ? 0.0364 ? -0.0650 ? 0.5817 ? -0.0030 ? 0.5645 ? 4.4019 ? -3.4062 ? 3.4523 ? 6.0270 ? -3.5661 ? 3.0885 ? 0.5095 ? 0.1014 ? -0.8723 ? -0.4229 ? 0.3112 ? 0.8313 ? 0.2835 ? -0.8334 ? -0.8607 ? 5 'X-RAY DIFFRACTION' ? refined 64.7869 -16.4298 115.9232 0.3874 ? 0.0249 ? -0.1104 ? 0.5090 ? -0.0841 ? 0.4221 ? 1.6150 ? -2.2848 ? -0.2051 ? 5.0430 ? -3.1759 ? 6.5547 ? 0.3841 ? 0.2930 ? -0.2135 ? -0.5275 ? -0.1058 ? 0.1703 ? 0.5118 ? 0.4439 ? -0.2801 ? 6 'X-RAY DIFFRACTION' ? refined 74.4185 -2.8376 110.6664 0.7869 ? 0.1711 ? -0.1064 ? 0.7833 ? 0.0412 ? 0.7085 ? 9.8435 ? 2.3618 ? -5.4694 ? 9.4485 ? -3.6728 ? 3.7948 ? -0.3360 ? -1.1164 ? -0.5457 ? 0.7571 ? 0.3739 ? -2.0032 ? 0.7404 ? 1.0440 ? -0.0695 ? 7 'X-RAY DIFFRACTION' ? refined 68.1952 -10.0732 116.6740 0.3113 ? -0.0511 ? -0.0165 ? 0.4567 ? 0.0262 ? 0.3140 ? 5.6958 ? -4.9528 ? 2.2477 ? 6.0623 ? -5.4420 ? 8.2808 ? 0.2749 ? -0.7060 ? -0.2023 ? 0.0665 ? -0.3550 ? -0.3960 ? -0.6682 ? -0.0738 ? 0.1062 ? 8 'X-RAY DIFFRACTION' ? refined 52.7392 -14.0482 102.3274 0.7066 ? 0.0854 ? -0.3323 ? 0.8042 ? -0.0266 ? 0.6007 ? 8.5078 ? 3.6776 ? -1.0880 ? 5.0952 ? -0.1947 ? 2.9856 ? -0.1734 ? -0.0179 ? -0.7535 ? 0.0025 ? 0.6314 ? 0.0861 ? -0.2428 ? -0.4396 ? -0.3279 ? 9 'X-RAY DIFFRACTION' ? refined 69.4841 9.4313 111.6984 0.9287 ? 0.0007 ? 0.0613 ? 0.4542 ? -0.0584 ? 0.4474 ? 8.8818 ? 3.2531 ? 1.9183 ? 4.7195 ? 1.8667 ? 5.4630 ? 0.4140 ? -0.0755 ? 0.8513 ? 0.1112 ? -0.1658 ? 0.0719 ? -1.0472 ? 0.4317 ? -0.1413 ? 10 'X-RAY DIFFRACTION' ? refined 63.1150 11.8533 106.2483 1.1611 ? 0.0736 ? 0.1085 ? 0.5329 ? 0.0863 ? 0.4638 ? 5.8545 ? -0.4251 ? -2.6825 ? 8.9803 ? -0.2729 ? 1.2083 ? 0.7267 ? -0.1017 ? 0.3736 ? -1.3285 ? -0.2167 ? 0.0432 ? -1.9724 ? -0.8661 ? -0.5101 ? 11 'X-RAY DIFFRACTION' ? refined 61.6572 -12.6662 108.9283 0.5683 ? 0.0475 ? -0.1218 ? 0.3220 ? -0.0339 ? 0.3139 ? 5.0731 ? -0.8202 ? -0.3012 ? 4.5016 ? -1.7350 ? 0.7645 ? 0.0471 ? 0.3189 ? -0.2118 ? -1.0335 ? -0.3005 ? 0.6011 ? 0.0911 ? -0.3639 ? 0.2361 ? 12 'X-RAY DIFFRACTION' ? refined 58.9162 -22.2699 132.0814 0.5112 ? 0.0028 ? -0.0388 ? 0.6348 ? 0.0072 ? 0.6223 ? 4.4862 ? 4.4839 ? 5.0483 ? 4.5717 ? 5.6651 ? 9.4420 ? 0.4010 ? -1.4241 ? -0.3317 ? 0.4712 ? -1.1094 ? 0.9297 ? 0.8089 ? -0.3037 ? 0.8207 ? 13 'X-RAY DIFFRACTION' ? refined 38.5265 55.7147 38.4166 0.2869 ? -0.0677 ? 0.0949 ? 0.3625 ? 0.0426 ? 0.4625 ? 8.1208 ? -1.9982 ? 4.7886 ? 3.8882 ? 1.3687 ? 8.6338 ? -0.1037 ? -0.5383 ? -0.1613 ? 0.3103 ? -0.0203 ? 0.3278 ? 0.3696 ? -0.5295 ? 0.0233 ? 14 'X-RAY DIFFRACTION' ? refined 36.7256 67.5950 40.9502 0.1648 ? -0.0341 ? 0.0188 ? 0.4721 ? -0.0335 ? 0.4128 ? 4.7507 ? -1.6560 ? -4.4265 ? 3.5492 ? 0.4693 ? 3.9101 ? -0.0254 ? 0.1933 ? -0.3933 ? 0.1082 ? 0.0007 ? 0.3472 ? -0.1637 ? -0.7050 ? 0.0204 ? 15 'X-RAY DIFFRACTION' ? refined 30.3410 62.1284 37.8550 0.2396 ? -0.0285 ? 0.0478 ? 0.5496 ? -0.0994 ? 0.5302 ? 5.1056 ? -0.5787 ? 0.8972 ? 6.5576 ? -1.1848 ? 4.4123 ? -0.0311 ? 0.3685 ? -0.3211 ? 0.3799 ? 0.0382 ? 0.7122 ? 0.0066 ? -1.0613 ? 0.0158 ? 16 'X-RAY DIFFRACTION' ? refined 41.9803 62.0559 33.8864 0.2426 ? -0.0721 ? 0.0011 ? 0.4831 ? -0.0276 ? 0.4357 ? 0.1473 ? -0.9247 ? -0.3443 ? 3.6914 ? 2.8400 ? 3.0007 ? -0.0603 ? -0.1070 ? -0.0296 ? -0.0473 ? -0.1337 ? 0.3665 ? 0.0071 ? -0.1569 ? 0.2327 ? 17 'X-RAY DIFFRACTION' ? refined 60.3804 47.1815 17.2007 0.3003 ? 0.0110 ? 0.0194 ? 0.2395 ? 0.0346 ? 0.4106 ? 8.0450 ? -1.4684 ? -0.5215 ? 5.4962 ? -0.0911 ? 6.0567 ? 0.2446 ? 0.3157 ? -0.3309 ? -0.4337 ? -0.3172 ? -0.6740 ? -0.0431 ? 0.4256 ? 0.0373 ? 18 'X-RAY DIFFRACTION' ? refined 61.8822 52.5533 21.9429 0.2352 ? -0.0621 ? -0.0476 ? 0.3148 ? -0.0472 ? 0.3868 ? 2.6845 ? 0.0850 ? -3.7155 ? 7.9397 ? 0.0556 ? 6.7085 ? 0.3037 ? -0.5110 ? 0.0568 ? -0.0235 ? -0.4040 ? -0.8709 ? -0.3709 ? 0.4361 ? 0.1129 ? 19 'X-RAY DIFFRACTION' ? refined 59.3698 45.9177 19.1125 0.2792 ? 0.0533 ? 0.0445 ? 0.3001 ? 0.0151 ? 0.3680 ? 8.4173 ? -0.8699 ? -0.5144 ? 5.2287 ? 0.4105 ? 5.0815 ? 0.0536 ? -0.3214 ? -0.6369 ? -0.0147 ? -0.0873 ? -0.3081 ? 0.3227 ? 0.4454 ? 0.0034 ? 20 'X-RAY DIFFRACTION' ? refined 59.0154 38.2340 18.5642 0.4202 ? 0.0947 ? 0.0394 ? 0.4558 ? 0.0688 ? 0.7056 ? 3.2836 ? 0.2941 ? -3.3481 ? 7.0265 ? 0.4126 ? 7.2719 ? 0.4817 ? 0.4385 ? -1.1213 ? -0.7452 ? -0.1689 ? -0.1488 ? 0.3329 ? -0.0769 ? -0.1493 ? 21 'X-RAY DIFFRACTION' ? refined 54.1700 80.2308 27.5039 0.3870 ? -0.0893 ? 0.0309 ? 0.3480 ? 0.0173 ? 0.3806 ? 5.1711 ? -3.9061 ? -1.3981 ? 4.1894 ? 1.0916 ? 2.5700 ? 0.2740 ? 1.5310 ? 1.0448 ? -0.2992 ? -0.1330 ? -0.3696 ? -0.3458 ? 0.0421 ? -0.0712 ? 22 'X-RAY DIFFRACTION' ? refined 47.8790 82.5001 34.8695 0.2917 ? -0.0468 ? -0.0174 ? 0.4427 ? -0.0551 ? 0.3295 ? 7.8032 ? -4.0932 ? -1.4372 ? 9.3930 ? -1.8612 ? 3.4926 ? -0.1159 ? 0.1928 ? 0.7303 ? 0.1315 ? 0.2963 ? -0.2457 ? -0.4629 ? -0.0746 ? -0.1696 ? 23 'X-RAY DIFFRACTION' ? refined 54.1587 78.1470 39.2687 0.1736 ? 0.0457 ? 0.0353 ? 0.3906 ? -0.0297 ? 0.3726 ? 2.7411 ? 2.3295 ? 0.5751 ? 2.6471 ? 1.1101 ? 5.7897 ? 0.1058 ? -0.4327 ? 0.3113 ? 0.2474 ? 0.1306 ? -0.0602 ? -0.1123 ? 0.2511 ? -0.2531 ? 24 'X-RAY DIFFRACTION' ? refined 57.4745 74.5388 33.3471 0.2309 ? -0.0599 ? 0.0373 ? 0.3158 ? 0.0051 ? 0.3397 ? 7.8756 ? -1.8191 ? 0.1204 ? 7.5525 ? 1.0300 ? 5.3660 ? 0.1259 ? 0.3648 ? -0.7638 ? -0.1389 ? 0.0836 ? -0.1594 ? -0.1150 ? 0.3239 ? -0.2684 ? 25 'X-RAY DIFFRACTION' ? refined 40.2747 77.9640 34.6643 0.2757 ? 0.0432 ? 0.0096 ? 0.3386 ? 0.0704 ? 0.3005 ? 2.8370 ? -1.0662 ? -3.5183 ? 3.2709 ? 3.7464 ? 5.9391 ? -0.2561 ? -0.3608 ? -0.1295 ? 0.4148 ? 0.0200 ? -0.4069 ? 0.5648 ? 0.4959 ? 0.2376 ? 26 'X-RAY DIFFRACTION' ? refined 66.5012 70.5765 19.3208 0.4112 ? -0.0928 ? 0.1384 ? 0.5193 ? -0.0343 ? 0.4665 ? 9.4630 ? -6.2686 ? -0.0609 ? 2.0522 ? 5.1856 ? 4.7167 ? 0.0013 ? 0.1793 ? 1.1832 ? -0.4123 ? 0.5408 ? -0.8763 ? 0.2309 ? -0.0064 ? -0.3853 ? 27 'X-RAY DIFFRACTION' ? refined 58.9829 44.1744 6.8966 0.6644 ? -0.0240 ? 0.0653 ? 0.4494 ? -0.1018 ? 0.4464 ? 5.3146 ? 5.4053 ? 0.2606 ? 5.2497 ? -0.3180 ? 2.6419 ? -0.0628 ? -0.1731 ? -0.7019 ? -0.6827 ? -0.0955 ? -0.3657 ? 0.9276 ? -0.2602 ? 0.2032 ? 28 'X-RAY DIFFRACTION' ? refined 57.6486 58.5708 6.2217 0.3115 ? -0.0044 ? 0.0114 ? 0.3383 ? 0.0329 ? 0.3914 ? 8.1294 ? 4.3109 ? 5.5798 ? 6.6200 ? 6.5247 ? 7.4288 ? -0.0919 ? 0.4748 ? 0.2117 ? -0.4892 ? 0.0475 ? 0.1482 ? -0.4780 ? 0.0869 ? 0.0471 ? 29 'X-RAY DIFFRACTION' ? refined 58.5722 54.6484 7.4335 0.2884 ? 0.0238 ? 0.0246 ? 0.3487 ? 0.0486 ? 0.3225 ? 5.7710 ? 2.4011 ? 1.2781 ? 8.2936 ? 3.1799 ? 4.5301 ? -0.2292 ? 0.0631 ? -0.0451 ? -0.9080 ? 0.0811 ? -0.0323 ? -0.0996 ? -0.4067 ? 0.1607 ? 30 'X-RAY DIFFRACTION' ? refined 65.8767 58.2982 1.1813 0.6711 ? -0.0592 ? -0.0086 ? 0.4712 ? 0.0204 ? 0.3113 ? 7.1827 ? 4.4343 ? 2.6689 ? 5.5542 ? 6.6699 ? 2.3893 ? -0.2702 ? 0.7149 ? -0.0302 ? -0.3433 ? 0.6960 ? 0.3069 ? 0.1015 ? 0.3802 ? -0.4682 ? 31 'X-RAY DIFFRACTION' ? refined 73.1892 25.8336 88.3473 0.7587 ? 0.1870 ? 0.1047 ? 0.7527 ? 0.1915 ? 0.4372 ? 5.7987 ? 1.2299 ? -2.4463 ? 6.8533 ? 1.3347 ? 8.1055 ? 0.4992 ? -0.0626 ? -0.0748 ? 0.2004 ? -0.8731 ? -0.5604 ? 0.0927 ? 0.9430 ? 0.2818 ? 32 'X-RAY DIFFRACTION' ? refined 70.0405 15.7875 87.5977 0.9947 ? 0.2534 ? 0.1462 ? 0.7136 ? -0.0085 ? 0.5012 ? 5.2692 ? -0.1653 ? -1.3179 ? 4.4486 ? -3.3876 ? 3.1078 ? 0.1802 ? 1.1727 ? -0.3191 ? -1.3969 ? -0.8345 ? -0.5908 ? 1.1618 ? 0.9437 ? 0.5967 ? 33 'X-RAY DIFFRACTION' ? refined 71.0394 21.7725 85.9982 0.5955 ? 0.1525 ? 0.0701 ? 0.7579 ? 0.0935 ? 0.5388 ? 5.6271 ? -1.1393 ? -0.6491 ? 6.9775 ? -5.6919 ? 7.7245 ? 0.6313 ? 0.1351 ? -0.2357 ? -0.4117 ? -0.4977 ? 0.1467 ? 0.2718 ? 0.6500 ? -0.0510 ? 34 'X-RAY DIFFRACTION' ? refined 69.5535 28.2990 80.0653 0.7826 ? 0.1234 ? 0.1528 ? 0.6990 ? 0.0938 ? 0.4929 ? 0.3246 ? 0.6348 ? -1.1837 ? 3.8693 ? -2.6539 ? 5.7414 ? -0.3615 ? -0.1763 ? -0.1923 ? -0.2028 ? -0.4876 ? -0.3838 ? 1.0487 ? 0.9659 ? 0.8529 ? 35 'X-RAY DIFFRACTION' ? refined 69.3995 45.7589 61.5532 0.8675 ? -0.0853 ? 0.1666 ? 0.5366 ? 0.0392 ? 0.5094 ? 9.2895 ? -6.6820 ? -1.3576 ? 8.7899 ? 0.1556 ? 7.3254 ? 0.2069 ? -0.2196 ? 0.5384 ? -0.3083 ? 0.0646 ? -0.3989 ? 0.2359 ? 0.5464 ? -0.2358 ? 36 'X-RAY DIFFRACTION' ? refined 67.0213 47.1794 66.6054 0.7117 ? 0.0146 ? 0.0285 ? 0.6709 ? 0.0865 ? 0.4226 ? 6.0349 ? -1.9996 ? -3.3235 ? 8.8910 ? 3.6815 ? 6.3688 ? 0.1401 ? 0.5878 ? 0.3833 ? 0.1874 ? -0.4201 ? 0.0481 ? -0.2721 ? -0.0309 ? 0.3067 ? 37 'X-RAY DIFFRACTION' ? refined 75.0096 52.6752 65.0059 1.0858 ? -0.1060 ? -0.0882 ? 0.8890 ? 0.0227 ? 0.6898 ? 9.8930 ? -5.3370 ? 3.1672 ? 8.8431 ? -5.9271 ? 4.2755 ? 0.0264 ? -0.2281 ? 0.6673 ? 0.9713 ? -0.2345 ? -0.0394 ? -1.1995 ? 0.7640 ? 0.0657 ? 38 'X-RAY DIFFRACTION' ? refined 45.4696 26.9867 80.3850 0.8212 ? 0.0644 ? 0.0209 ? 1.0105 ? -0.0113 ? 0.8545 ? 3.0855 ? 1.7471 ? -0.6331 ? 9.5126 ? -2.4256 ? 2.6836 ? -0.4289 ? 0.2502 ? 0.2443 ? 1.2065 ? 1.0289 ? 0.3711 ? 0.0451 ? -1.3722 ? -0.5240 ? 39 'X-RAY DIFFRACTION' ? refined 48.5276 20.6208 87.7424 0.8758 ? -0.0921 ? -0.0081 ? 0.8982 ? 0.0863 ? 0.9372 ? 4.8458 ? 0.7862 ? 2.1085 ? 6.6837 ? -2.6936 ? 2.3373 ? -0.3086 ? 0.1331 ? -0.7615 ? -1.0737 ? 0.5841 ? 1.1548 ? 0.7164 ? -0.6903 ? -0.3074 ? 40 'X-RAY DIFFRACTION' ? refined 49.4922 28.5576 91.8369 0.8336 ? 0.2701 ? 0.2662 ? 0.8730 ? 0.1303 ? 0.8222 ? 9.1732 ? 0.2148 ? 0.1523 ? 4.3596 ? -5.6145 ? 8.5303 ? -0.1019 ? -1.1993 ? 0.2074 ? 0.5053 ? 0.8831 ? 1.1740 ? -1.0294 ? -1.4694 ? -0.8672 ? 41 'X-RAY DIFFRACTION' ? refined 49.8609 32.9407 85.5806 0.9156 ? 0.2070 ? 0.2355 ? 0.7719 ? 0.1996 ? 1.0744 ? 5.5421 ? -7.2519 ? -0.8071 ? 9.5997 ? 1.7736 ? 7.7966 ? 0.4744 ? 0.1217 ? 0.8969 ? 0.6493 ? 0.3839 ? 0.8066 ? -1.9417 ? -1.2721 ? -0.8220 ? 42 'X-RAY DIFFRACTION' ? refined 56.3005 16.6124 86.3483 0.9514 ? 0.0059 ? -0.0282 ? 0.6091 ? -0.1123 ? 0.7702 ? 7.0140 ? -1.9213 ? 3.7442 ? 5.4763 ? -0.1607 ? 7.6889 ? -0.0870 ? -0.8703 ? 0.8489 ? -0.7773 ? -0.3768 ? 0.1388 ? 1.6450 ? -0.8936 ? 0.4191 ? 43 'X-RAY DIFFRACTION' ? refined 45.5102 42.2865 71.7968 0.9377 ? 0.3404 ? 0.1298 ? 1.3717 ? 0.6943 ? 1.2338 ? 2.9799 ? 2.4747 ? 2.2537 ? 2.0649 ? 1.8562 ? 1.6743 ? 0.7539 ? -0.3625 ? 2.3318 ? -0.6652 ? 0.3095 ? 0.5968 ? 0.2673 ? -0.9561 ? -1.1353 ? 44 'X-RAY DIFFRACTION' ? refined 60.3545 43.5203 55.8970 0.6763 ? -0.1004 ? -0.1186 ? 0.9831 ? 0.2103 ? 0.5499 ? 6.8814 ? 0.2018 ? -3.7721 ? 5.5628 ? -4.2753 ? 8.8137 ? -0.4473 ? 0.4531 ? 0.6228 ? -0.6592 ? 1.0797 ? 0.5369 ? 0.8653 ? -1.1160 ? -0.6033 ? 45 'X-RAY DIFFRACTION' ? refined 56.3846 40.6652 65.7702 0.6612 ? -0.0799 ? 0.0164 ? 0.7307 ? 0.1912 ? 0.9003 ? 7.8600 ? -2.9998 ? 0.4676 ? 8.3578 ? -5.1862 ? 3.4288 ? -0.6816 ? -0.1880 ? 0.0139 ? 0.2685 ? 0.9637 ? 0.9351 ? 0.0222 ? -0.3603 ? -0.3090 ? 46 'X-RAY DIFFRACTION' ? refined 58.5249 42.1965 49.1918 1.0335 ? -0.1056 ? -0.1085 ? 1.4618 ? 0.4112 ? 0.7663 ? 2.3316 ? 2.4059 ? 0.1477 ? 3.4748 ? -0.3489 ? 0.2712 ? -0.1272 ? 1.8105 ? 0.7113 ? -1.3890 ? 0.7380 ? 0.7746 ? 0.7417 ? -1.6844 ? -0.7652 ? # loop_ _pdbx_refine_tls_group.id _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 1 'X-RAY DIFFRACTION' 1 ? ? A 0 ? ? A 0 ? ;chain 'A' and (resid 381 through 496 ) ; 2 'X-RAY DIFFRACTION' 2 ? ? A 0 ? ? A 0 ? ;chain 'A' and (resid 497 through 538 ) ; 3 'X-RAY DIFFRACTION' 3 ? ? A 0 ? ? A 0 ? ;chain 'A' and (resid 539 through 591 ) ; 4 'X-RAY DIFFRACTION' 4 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 381 through 410 ) ; 5 'X-RAY DIFFRACTION' 5 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 411 through 455 ) ; 6 'X-RAY DIFFRACTION' 6 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 456 through 467 ) ; 7 'X-RAY DIFFRACTION' 7 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 468 through 484 ) ; 8 'X-RAY DIFFRACTION' 8 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 485 through 496 ) ; 9 'X-RAY DIFFRACTION' 9 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 497 through 528 ) ; 10 'X-RAY DIFFRACTION' 10 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 529 through 561 ) ; 11 'X-RAY DIFFRACTION' 11 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 562 through 576 ) ; 12 'X-RAY DIFFRACTION' 12 ? ? B 0 ? ? B 0 ? ;chain 'B' and (resid 577 through 591 ) ; 13 'X-RAY DIFFRACTION' 13 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 1 through 25 ) ; 14 'X-RAY DIFFRACTION' 14 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 26 through 60 ) ; 15 'X-RAY DIFFRACTION' 15 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 61 through 83 ) ; 16 'X-RAY DIFFRACTION' 16 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 84 through 123 ) ; 17 'X-RAY DIFFRACTION' 17 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 124 through 157 ) ; 18 'X-RAY DIFFRACTION' 18 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 158 through 169 ) ; 19 'X-RAY DIFFRACTION' 19 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 170 through 202 ) ; 20 'X-RAY DIFFRACTION' 20 ? ? H 0 ? ? H 0 ? ;chain 'H' and (resid 203 through 227 ) ; 21 'X-RAY DIFFRACTION' 21 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 1 through 18 ) ; 22 'X-RAY DIFFRACTION' 22 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 19 through 38 ) ; 23 'X-RAY DIFFRACTION' 23 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 39 through 75 ) ; 24 'X-RAY DIFFRACTION' 24 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 76 through 90 ) ; 25 'X-RAY DIFFRACTION' 25 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 91 through 102 ) ; 26 'X-RAY DIFFRACTION' 26 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 103 through 113 ) ; 27 'X-RAY DIFFRACTION' 27 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 114 through 128 ) ; 28 'X-RAY DIFFRACTION' 28 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 129 through 163 ) ; 29 'X-RAY DIFFRACTION' 29 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 164 through 197 ) ; 30 'X-RAY DIFFRACTION' 30 ? ? L 0 ? ? L 0 ? ;chain 'L' and (resid 198 through 213 ) ; 31 'X-RAY DIFFRACTION' 31 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 1 through 40 ) ; 32 'X-RAY DIFFRACTION' 32 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 41 through 73 ) ; 33 'X-RAY DIFFRACTION' 33 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 74 through 99 ) ; 34 'X-RAY DIFFRACTION' 34 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 100 through 123 ) ; 35 'X-RAY DIFFRACTION' 35 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 124 through 147 ) ; 36 'X-RAY DIFFRACTION' 36 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 148 through 189 ) ; 37 'X-RAY DIFFRACTION' 37 ? ? D 0 ? ? D 0 ? ;chain 'D' and (resid 190 through 228 ) ; 38 'X-RAY DIFFRACTION' 38 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 1 through 18 ) ; 39 'X-RAY DIFFRACTION' 39 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 19 through 38 ) ; 40 'X-RAY DIFFRACTION' 40 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 39 through 75 ) ; 41 'X-RAY DIFFRACTION' 41 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 76 through 90 ) ; 42 'X-RAY DIFFRACTION' 42 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 91 through 102 ) ; 43 'X-RAY DIFFRACTION' 43 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 103 through 113 ) ; 44 'X-RAY DIFFRACTION' 44 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 114 through 150 ) ; 45 'X-RAY DIFFRACTION' 45 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 155 through 174 ) ; 46 'X-RAY DIFFRACTION' 46 ? ? E 0 ? ? E 0 ? ;chain 'E' and (resid 175 through 213 ) ; # _phasing.method MR # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(phenix.refine: dev_1702)' 1 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 3 ? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.15 4 ? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot ? ? ? . 5 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? SCALEPACK ? ? ? . 6 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 SG D CYS 140 ? ? CB D CYS 196 ? ? 2.04 2 1 SG H CYS 140 ? ? CB H CYS 196 ? ? 2.10 3 1 O H HOH 332 ? ? O H HOH 356 ? ? 2.17 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 SER A 435 ? ? -145.81 19.87 2 1 MET A 452 ? ? -96.07 30.05 3 1 LEU A 456 ? ? -91.81 40.26 4 1 ALA A 461 ? ? -98.54 46.45 5 1 ASN A 468 ? ? -106.40 -72.21 6 1 LEU A 488 ? ? -110.00 70.38 7 1 ARG A 511 ? ? -136.71 -67.01 8 1 GLU A 549 ? ? -95.81 30.02 9 1 SER H 30 ? ? 53.65 -125.30 10 1 ASP H 144 ? ? 60.69 61.38 11 1 THR H 191 ? ? -130.06 -51.88 12 1 ARG L 30 ? ? 56.28 -116.80 13 1 ALA L 51 ? ? 69.03 -39.46 14 1 ALA L 84 ? ? -163.51 -166.39 15 1 ASN L 152 ? ? 59.79 15.14 16 1 ARG L 211 ? ? -60.84 93.39 17 1 SER B 435 ? ? -146.45 14.56 18 1 LEU B 456 ? ? -92.13 59.00 19 1 ASN B 468 ? ? -98.33 -62.55 20 1 CYS D 22 ? ? -152.16 86.74 21 1 SER D 30 ? ? 54.24 -125.59 22 1 ARG D 66 ? ? -125.93 -50.21 23 1 SER D 100 ? ? -88.46 41.89 24 1 THR D 100 A ? -158.75 -49.02 25 1 ASP D 144 ? ? 60.92 85.06 26 1 PRO D 147 ? ? -96.95 -156.77 27 1 ASP D 208 ? ? -108.99 76.48 28 1 ARG E 30 ? ? 56.41 -118.07 29 1 ASN E 31 ? ? -109.83 41.72 30 1 ASP E 32 ? ? -119.98 70.79 31 1 PRO E 40 ? ? -54.86 108.04 32 1 SER E 52 ? ? -155.85 -26.05 33 1 THR E 69 ? ? -141.03 -8.31 34 1 PRO E 80 ? ? -49.07 -11.95 35 1 ASN E 92 ? ? -73.75 -72.66 36 1 ASN E 138 ? ? 45.99 70.28 37 1 SER E 156 ? ? 65.86 151.98 38 1 ASP E 170 ? ? -142.84 -2.57 39 1 PRO E 204 ? ? -59.50 92.67 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A GLU 367 ? A GLU 1 2 1 Y 1 A ALA 368 ? A ALA 2 3 1 Y 1 A LYS 369 ? A LYS 3 4 1 Y 1 A PRO 370 ? A PRO 4 5 1 Y 1 A SER 371 ? A SER 5 6 1 Y 1 A GLY 372 ? A GLY 6 7 1 Y 1 A SER 373 ? A SER 7 8 1 Y 1 A VAL 374 ? A VAL 8 9 1 Y 1 A VAL 375 ? A VAL 9 10 1 Y 1 A GLU 376 ? A GLU 10 11 1 Y 1 A GLN 377 ? A GLN 11 12 1 Y 1 A ALA 378 ? A ALA 12 13 1 Y 1 A GLU 379 ? A GLU 13 14 1 Y 1 A GLY 380 ? A GLY 14 15 1 Y 1 A ASN 592 ? A ASN 226 16 1 Y 1 A ASP 593 ? A ASP 227 17 1 Y 1 A THR 594 ? A THR 228 18 1 Y 1 A LYS 595 ? A LYS 229 19 1 Y 1 A ILE 596 ? A ILE 230 20 1 Y 1 A ALA 597 ? A ALA 231 21 1 Y 1 A SER 598 ? A SER 232 22 1 Y 1 A GLN 599 ? A GLN 233 23 1 Y 1 A LEU 600 ? A LEU 234 24 1 Y 1 A GLY 601 ? A GLY 235 25 1 Y 1 A GLY 602 ? A GLY 236 26 1 Y 1 A SER 603 ? A SER 237 27 1 Y 1 A LEU 604 ? A LEU 238 28 1 Y 1 A GLU 605 ? A GLU 239 29 1 Y 1 A VAL 606 ? A VAL 240 30 1 Y 1 A LEU 607 ? A LEU 241 31 1 Y 1 A PHE 608 ? A PHE 242 32 1 Y 1 A GLN 609 ? A GLN 243 33 1 Y 1 A GLY 610 ? A GLY 244 34 1 Y 1 A PRO 611 ? A PRO 245 35 1 Y 1 A GLY 612 ? A GLY 246 36 1 Y 1 A HIS 613 ? A HIS 247 37 1 Y 1 A HIS 614 ? A HIS 248 38 1 Y 1 A HIS 615 ? A HIS 249 39 1 Y 1 A HIS 616 ? A HIS 250 40 1 Y 1 A HIS 617 ? A HIS 251 41 1 Y 1 A HIS 618 ? A HIS 252 42 1 Y 1 H CYS 216 ? B CYS 228 43 1 Y 1 H ASP 217 ? B ASP 229 44 1 Y 1 H LYS 218 ? B LYS 230 45 1 Y 1 H THR 219 ? B THR 231 46 1 Y 1 H SER 220 ? B SER 232 47 1 Y 1 H GLY 221 ? B GLY 233 48 1 Y 1 H GLN 222 ? B GLN 234 49 1 Y 1 H ALA 223 ? B ALA 235 50 1 Y 1 H GLY 224 ? B GLY 236 51 1 Y 1 H HIS 225 ? B HIS 237 52 1 Y 1 H HIS 226 ? B HIS 238 53 1 Y 1 H HIS 227 ? B HIS 239 54 1 Y 1 H HIS 228 ? B HIS 240 55 1 Y 1 H HIS 229 ? B HIS 241 56 1 Y 1 H HIS 230 ? B HIS 242 57 1 Y 1 H GLY 231 ? B GLY 243 58 1 Y 1 H ASP 232 ? B ASP 244 59 1 Y 1 H TYR 233 ? B TYR 245 60 1 Y 1 H LYS 234 ? B LYS 246 61 1 Y 1 H ASP 235 ? B ASP 247 62 1 Y 1 H ASP 236 ? B ASP 248 63 1 Y 1 H ASP 237 ? B ASP 249 64 1 Y 1 H ASP 238 ? B ASP 250 65 1 Y 1 H LYS 239 ? B LYS 251 66 1 Y 1 H GLY 240 ? B GLY 252 67 1 Y 1 L GLU 213 ? C GLU 213 68 1 Y 1 L CYS 214 ? C CYS 214 69 1 Y 1 B GLU 367 ? D GLU 1 70 1 Y 1 B ALA 368 ? D ALA 2 71 1 Y 1 B LYS 369 ? D LYS 3 72 1 Y 1 B PRO 370 ? D PRO 4 73 1 Y 1 B SER 371 ? D SER 5 74 1 Y 1 B GLY 372 ? D GLY 6 75 1 Y 1 B SER 373 ? D SER 7 76 1 Y 1 B VAL 374 ? D VAL 8 77 1 Y 1 B VAL 375 ? D VAL 9 78 1 Y 1 B GLU 376 ? D GLU 10 79 1 Y 1 B GLN 377 ? D GLN 11 80 1 Y 1 B ALA 378 ? D ALA 12 81 1 Y 1 B GLU 379 ? D GLU 13 82 1 Y 1 B GLY 380 ? D GLY 14 83 1 Y 1 B ASN 592 ? D ASN 226 84 1 Y 1 B ASP 593 ? D ASP 227 85 1 Y 1 B THR 594 ? D THR 228 86 1 Y 1 B LYS 595 ? D LYS 229 87 1 Y 1 B ILE 596 ? D ILE 230 88 1 Y 1 B ALA 597 ? D ALA 231 89 1 Y 1 B SER 598 ? D SER 232 90 1 Y 1 B GLN 599 ? D GLN 233 91 1 Y 1 B LEU 600 ? D LEU 234 92 1 Y 1 B GLY 601 ? D GLY 235 93 1 Y 1 B GLY 602 ? D GLY 236 94 1 Y 1 B SER 603 ? D SER 237 95 1 Y 1 B LEU 604 ? D LEU 238 96 1 Y 1 B GLU 605 ? D GLU 239 97 1 Y 1 B VAL 606 ? D VAL 240 98 1 Y 1 B LEU 607 ? D LEU 241 99 1 Y 1 B PHE 608 ? D PHE 242 100 1 Y 1 B GLN 609 ? D GLN 243 101 1 Y 1 B GLY 610 ? D GLY 244 102 1 Y 1 B PRO 611 ? D PRO 245 103 1 Y 1 B GLY 612 ? D GLY 246 104 1 Y 1 B HIS 613 ? D HIS 247 105 1 Y 1 B HIS 614 ? D HIS 248 106 1 Y 1 B HIS 615 ? D HIS 249 107 1 Y 1 B HIS 616 ? D HIS 250 108 1 Y 1 B HIS 617 ? D HIS 251 109 1 Y 1 B HIS 618 ? D HIS 252 110 1 Y 1 D SER 127 ? E SER 139 111 1 Y 1 D SER 128 ? E SER 140 112 1 Y 1 D LYS 129 ? E LYS 141 113 1 Y 1 D SER 130 ? E SER 142 114 1 Y 1 D THR 131 ? E THR 143 115 1 Y 1 D SER 132 ? E SER 144 116 1 Y 1 D GLY 133 ? E GLY 145 117 1 Y 1 D GLY 134 ? E GLY 146 118 1 Y 1 D SER 215 ? E SER 227 119 1 Y 1 D CYS 216 ? E CYS 228 120 1 Y 1 D ASP 217 ? E ASP 229 121 1 Y 1 D LYS 218 ? E LYS 230 122 1 Y 1 D THR 219 ? E THR 231 123 1 Y 1 D SER 220 ? E SER 232 124 1 Y 1 D GLY 221 ? E GLY 233 125 1 Y 1 D GLN 222 ? E GLN 234 126 1 Y 1 D ALA 223 ? E ALA 235 127 1 Y 1 D GLY 224 ? E GLY 236 128 1 Y 1 D HIS 225 ? E HIS 237 129 1 Y 1 D HIS 226 ? E HIS 238 130 1 Y 1 D HIS 227 ? E HIS 239 131 1 Y 1 D HIS 228 ? E HIS 240 132 1 Y 1 D HIS 229 ? E HIS 241 133 1 Y 1 D HIS 230 ? E HIS 242 134 1 Y 1 D GLY 231 ? E GLY 243 135 1 Y 1 D ASP 232 ? E ASP 244 136 1 Y 1 D TYR 233 ? E TYR 245 137 1 Y 1 D LYS 234 ? E LYS 246 138 1 Y 1 D ASP 235 ? E ASP 247 139 1 Y 1 D ASP 236 ? E ASP 248 140 1 Y 1 D ASP 237 ? E ASP 249 141 1 Y 1 D ASP 238 ? E ASP 250 142 1 Y 1 D LYS 239 ? E LYS 251 143 1 Y 1 D GLY 240 ? E GLY 252 144 1 Y 1 E ASP 151 ? F ASP 151 145 1 Y 1 E ASN 152 ? F ASN 152 146 1 Y 1 E ALA 153 ? F ALA 153 147 1 Y 1 E LEU 154 ? F LEU 154 148 1 Y 1 E GLY 212 ? F GLY 212 149 1 Y 1 E GLU 213 ? F GLU 213 150 1 Y 1 E CYS 214 ? F CYS 214 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 4 N-ACETYL-D-GLUCOSAMINE NAG 5 GLYCEROL GOL 6 water HOH #