data_28000 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 28000 _Entry.Title ; Structural basis for client recognition and activity of Hsp40 chaperones ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-08-16 _Entry.Accession_date 2019-08-16 _Entry.Last_release_date 2019-08-19 _Entry.Original_release_date 2019-08-19 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 yajun jiang . . . . 28000 2 paolo rossi . . . . 28000 3 charalampos kalodimos . G. . . 28000 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 28000 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 217 28000 '1H chemical shifts' 217 28000 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2019-11-07 . original BMRB . 28000 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27998 'DnaJB1 SBD' 28000 BMRB 27999 'Sis1 SBD' 28000 BMRB 28001 'CbpA SBD' 28000 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 28000 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 31604242 _Citation.Full_citation . _Citation.Title ; Structural basis for client recognition and activity of Hsp40 chaperones ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Science _Citation.Journal_name_full . _Citation.Journal_volume 365 _Citation.Journal_issue 6459 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1313 _Citation.Page_last 1319 _Citation.Year 2019 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yajun Jiang . . . . 28000 1 2 Paolo Rossi . . . . 28000 1 3 Charalampos Kalodimos . G. . . 28000 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 28000 _Assembly.ID 1 _Assembly.Name Ydj1_SBD _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Ydj1_SBD 1 $Ydj1-SBD A . yes native no no . . . 28000 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Ydj1-SBD _Entity.Sf_category entity _Entity.Sf_framecode Ydj1-SBD _Entity.Entry_ID 28000 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Ydj1-SBD _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; RGKDIKHEISASLEELYKGR TAKLALNKQILCKECEGRGG KKGAVKKCTSCNGQGIKFVT RQMGPMIQRFQTECDVCHGT GDIIDPKDRCKSCNGKKVEN ERKILEVHVEPGMKDGQRIV FKGEADQAPDVIPGDVVFIV SERPHKSFKRDGDDLVYEAE IDLLTAIAGGEFALEHVSGD WLKVGIVPGEVIAPGMRKVI EGKGMPIPKYGGYGNLIIKF TIKDPENHFTSEENLKKLEE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 240 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 112 ARG . 28000 1 2 113 GLY . 28000 1 3 114 LYS . 28000 1 4 115 ASP . 28000 1 5 116 ILE . 28000 1 6 117 LYS . 28000 1 7 118 HIS . 28000 1 8 119 GLU . 28000 1 9 120 ILE . 28000 1 10 121 SER . 28000 1 11 122 ALA . 28000 1 12 123 SER . 28000 1 13 124 LEU . 28000 1 14 125 GLU . 28000 1 15 126 GLU . 28000 1 16 127 LEU . 28000 1 17 128 TYR . 28000 1 18 129 LYS . 28000 1 19 130 GLY . 28000 1 20 131 ARG . 28000 1 21 132 THR . 28000 1 22 133 ALA . 28000 1 23 134 LYS . 28000 1 24 135 LEU . 28000 1 25 136 ALA . 28000 1 26 137 LEU . 28000 1 27 138 ASN . 28000 1 28 139 LYS . 28000 1 29 140 GLN . 28000 1 30 141 ILE . 28000 1 31 142 LEU . 28000 1 32 143 CYS . 28000 1 33 144 LYS . 28000 1 34 145 GLU . 28000 1 35 146 CYS . 28000 1 36 147 GLU . 28000 1 37 148 GLY . 28000 1 38 149 ARG . 28000 1 39 150 GLY . 28000 1 40 151 GLY . 28000 1 41 152 LYS . 28000 1 42 153 LYS . 28000 1 43 154 GLY . 28000 1 44 155 ALA . 28000 1 45 156 VAL . 28000 1 46 157 LYS . 28000 1 47 158 LYS . 28000 1 48 159 CYS . 28000 1 49 160 THR . 28000 1 50 161 SER . 28000 1 51 162 CYS . 28000 1 52 163 ASN . 28000 1 53 164 GLY . 28000 1 54 165 GLN . 28000 1 55 166 GLY . 28000 1 56 167 ILE . 28000 1 57 168 LYS . 28000 1 58 169 PHE . 28000 1 59 170 VAL . 28000 1 60 171 THR . 28000 1 61 172 ARG . 28000 1 62 173 GLN . 28000 1 63 174 MET . 28000 1 64 175 GLY . 28000 1 65 176 PRO . 28000 1 66 177 MET . 28000 1 67 178 ILE . 28000 1 68 179 GLN . 28000 1 69 180 ARG . 28000 1 70 181 PHE . 28000 1 71 182 GLN . 28000 1 72 183 THR . 28000 1 73 184 GLU . 28000 1 74 185 CYS . 28000 1 75 186 ASP . 28000 1 76 187 VAL . 28000 1 77 188 CYS . 28000 1 78 189 HIS . 28000 1 79 190 GLY . 28000 1 80 191 THR . 28000 1 81 192 GLY . 28000 1 82 193 ASP . 28000 1 83 194 ILE . 28000 1 84 195 ILE . 28000 1 85 196 ASP . 28000 1 86 197 PRO . 28000 1 87 198 LYS . 28000 1 88 199 ASP . 28000 1 89 200 ARG . 28000 1 90 201 CYS . 28000 1 91 202 LYS . 28000 1 92 203 SER . 28000 1 93 204 CYS . 28000 1 94 205 ASN . 28000 1 95 206 GLY . 28000 1 96 207 LYS . 28000 1 97 208 LYS . 28000 1 98 209 VAL . 28000 1 99 210 GLU . 28000 1 100 211 ASN . 28000 1 101 212 GLU . 28000 1 102 213 ARG . 28000 1 103 214 LYS . 28000 1 104 215 ILE . 28000 1 105 216 LEU . 28000 1 106 217 GLU . 28000 1 107 218 VAL . 28000 1 108 219 HIS . 28000 1 109 220 VAL . 28000 1 110 221 GLU . 28000 1 111 222 PRO . 28000 1 112 223 GLY . 28000 1 113 224 MET . 28000 1 114 225 LYS . 28000 1 115 226 ASP . 28000 1 116 227 GLY . 28000 1 117 228 GLN . 28000 1 118 229 ARG . 28000 1 119 230 ILE . 28000 1 120 231 VAL . 28000 1 121 232 PHE . 28000 1 122 233 LYS . 28000 1 123 234 GLY . 28000 1 124 235 GLU . 28000 1 125 236 ALA . 28000 1 126 237 ASP . 28000 1 127 238 GLN . 28000 1 128 239 ALA . 28000 1 129 240 PRO . 28000 1 130 241 ASP . 28000 1 131 242 VAL . 28000 1 132 243 ILE . 28000 1 133 244 PRO . 28000 1 134 245 GLY . 28000 1 135 246 ASP . 28000 1 136 247 VAL . 28000 1 137 248 VAL . 28000 1 138 249 PHE . 28000 1 139 250 ILE . 28000 1 140 251 VAL . 28000 1 141 252 SER . 28000 1 142 253 GLU . 28000 1 143 254 ARG . 28000 1 144 255 PRO . 28000 1 145 256 HIS . 28000 1 146 257 LYS . 28000 1 147 258 SER . 28000 1 148 259 PHE . 28000 1 149 260 LYS . 28000 1 150 261 ARG . 28000 1 151 262 ASP . 28000 1 152 263 GLY . 28000 1 153 264 ASP . 28000 1 154 265 ASP . 28000 1 155 266 LEU . 28000 1 156 267 VAL . 28000 1 157 268 TYR . 28000 1 158 269 GLU . 28000 1 159 270 ALA . 28000 1 160 271 GLU . 28000 1 161 272 ILE . 28000 1 162 273 ASP . 28000 1 163 274 LEU . 28000 1 164 275 LEU . 28000 1 165 276 THR . 28000 1 166 277 ALA . 28000 1 167 278 ILE . 28000 1 168 279 ALA . 28000 1 169 280 GLY . 28000 1 170 281 GLY . 28000 1 171 282 GLU . 28000 1 172 283 PHE . 28000 1 173 284 ALA . 28000 1 174 285 LEU . 28000 1 175 286 GLU . 28000 1 176 287 HIS . 28000 1 177 288 VAL . 28000 1 178 289 SER . 28000 1 179 290 GLY . 28000 1 180 291 ASP . 28000 1 181 292 TRP . 28000 1 182 293 LEU . 28000 1 183 294 LYS . 28000 1 184 295 VAL . 28000 1 185 296 GLY . 28000 1 186 297 ILE . 28000 1 187 298 VAL . 28000 1 188 299 PRO . 28000 1 189 300 GLY . 28000 1 190 301 GLU . 28000 1 191 302 VAL . 28000 1 192 303 ILE . 28000 1 193 304 ALA . 28000 1 194 305 PRO . 28000 1 195 306 GLY . 28000 1 196 307 MET . 28000 1 197 308 ARG . 28000 1 198 309 LYS . 28000 1 199 310 VAL . 28000 1 200 311 ILE . 28000 1 201 312 GLU . 28000 1 202 313 GLY . 28000 1 203 314 LYS . 28000 1 204 315 GLY . 28000 1 205 316 MET . 28000 1 206 317 PRO . 28000 1 207 318 ILE . 28000 1 208 319 PRO . 28000 1 209 320 LYS . 28000 1 210 321 TYR . 28000 1 211 322 GLY . 28000 1 212 323 GLY . 28000 1 213 324 TYR . 28000 1 214 325 GLY . 28000 1 215 326 ASN . 28000 1 216 327 LEU . 28000 1 217 328 ILE . 28000 1 218 329 ILE . 28000 1 219 330 LYS . 28000 1 220 331 PHE . 28000 1 221 332 THR . 28000 1 222 333 ILE . 28000 1 223 334 LYS . 28000 1 224 335 ASP . 28000 1 225 336 PRO . 28000 1 226 337 GLU . 28000 1 227 338 ASN . 28000 1 228 339 HIS . 28000 1 229 340 PHE . 28000 1 230 341 THR . 28000 1 231 342 SER . 28000 1 232 343 GLU . 28000 1 233 344 GLU . 28000 1 234 345 ASN . 28000 1 235 346 LEU . 28000 1 236 347 LYS . 28000 1 237 348 LYS . 28000 1 238 349 LEU . 28000 1 239 350 GLU . 28000 1 240 351 GLU . 28000 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ARG 1 1 28000 1 . GLY 2 2 28000 1 . LYS 3 3 28000 1 . ASP 4 4 28000 1 . ILE 5 5 28000 1 . LYS 6 6 28000 1 . HIS 7 7 28000 1 . GLU 8 8 28000 1 . ILE 9 9 28000 1 . SER 10 10 28000 1 . ALA 11 11 28000 1 . SER 12 12 28000 1 . LEU 13 13 28000 1 . GLU 14 14 28000 1 . GLU 15 15 28000 1 . LEU 16 16 28000 1 . TYR 17 17 28000 1 . LYS 18 18 28000 1 . GLY 19 19 28000 1 . ARG 20 20 28000 1 . THR 21 21 28000 1 . ALA 22 22 28000 1 . LYS 23 23 28000 1 . LEU 24 24 28000 1 . ALA 25 25 28000 1 . LEU 26 26 28000 1 . ASN 27 27 28000 1 . LYS 28 28 28000 1 . GLN 29 29 28000 1 . ILE 30 30 28000 1 . LEU 31 31 28000 1 . CYS 32 32 28000 1 . LYS 33 33 28000 1 . GLU 34 34 28000 1 . CYS 35 35 28000 1 . GLU 36 36 28000 1 . GLY 37 37 28000 1 . ARG 38 38 28000 1 . GLY 39 39 28000 1 . GLY 40 40 28000 1 . LYS 41 41 28000 1 . LYS 42 42 28000 1 . GLY 43 43 28000 1 . ALA 44 44 28000 1 . VAL 45 45 28000 1 . LYS 46 46 28000 1 . LYS 47 47 28000 1 . CYS 48 48 28000 1 . THR 49 49 28000 1 . SER 50 50 28000 1 . CYS 51 51 28000 1 . ASN 52 52 28000 1 . GLY 53 53 28000 1 . GLN 54 54 28000 1 . GLY 55 55 28000 1 . ILE 56 56 28000 1 . LYS 57 57 28000 1 . PHE 58 58 28000 1 . VAL 59 59 28000 1 . THR 60 60 28000 1 . ARG 61 61 28000 1 . GLN 62 62 28000 1 . MET 63 63 28000 1 . GLY 64 64 28000 1 . PRO 65 65 28000 1 . MET 66 66 28000 1 . ILE 67 67 28000 1 . GLN 68 68 28000 1 . ARG 69 69 28000 1 . PHE 70 70 28000 1 . GLN 71 71 28000 1 . THR 72 72 28000 1 . GLU 73 73 28000 1 . CYS 74 74 28000 1 . ASP 75 75 28000 1 . VAL 76 76 28000 1 . CYS 77 77 28000 1 . HIS 78 78 28000 1 . GLY 79 79 28000 1 . THR 80 80 28000 1 . GLY 81 81 28000 1 . ASP 82 82 28000 1 . ILE 83 83 28000 1 . ILE 84 84 28000 1 . ASP 85 85 28000 1 . PRO 86 86 28000 1 . LYS 87 87 28000 1 . ASP 88 88 28000 1 . ARG 89 89 28000 1 . CYS 90 90 28000 1 . LYS 91 91 28000 1 . SER 92 92 28000 1 . CYS 93 93 28000 1 . ASN 94 94 28000 1 . GLY 95 95 28000 1 . LYS 96 96 28000 1 . LYS 97 97 28000 1 . VAL 98 98 28000 1 . GLU 99 99 28000 1 . ASN 100 100 28000 1 . GLU 101 101 28000 1 . ARG 102 102 28000 1 . LYS 103 103 28000 1 . ILE 104 104 28000 1 . LEU 105 105 28000 1 . GLU 106 106 28000 1 . VAL 107 107 28000 1 . HIS 108 108 28000 1 . VAL 109 109 28000 1 . GLU 110 110 28000 1 . PRO 111 111 28000 1 . GLY 112 112 28000 1 . MET 113 113 28000 1 . LYS 114 114 28000 1 . ASP 115 115 28000 1 . GLY 116 116 28000 1 . GLN 117 117 28000 1 . ARG 118 118 28000 1 . ILE 119 119 28000 1 . VAL 120 120 28000 1 . PHE 121 121 28000 1 . LYS 122 122 28000 1 . GLY 123 123 28000 1 . GLU 124 124 28000 1 . ALA 125 125 28000 1 . ASP 126 126 28000 1 . GLN 127 127 28000 1 . ALA 128 128 28000 1 . PRO 129 129 28000 1 . ASP 130 130 28000 1 . VAL 131 131 28000 1 . ILE 132 132 28000 1 . PRO 133 133 28000 1 . GLY 134 134 28000 1 . ASP 135 135 28000 1 . VAL 136 136 28000 1 . VAL 137 137 28000 1 . PHE 138 138 28000 1 . ILE 139 139 28000 1 . VAL 140 140 28000 1 . SER 141 141 28000 1 . GLU 142 142 28000 1 . ARG 143 143 28000 1 . PRO 144 144 28000 1 . HIS 145 145 28000 1 . LYS 146 146 28000 1 . SER 147 147 28000 1 . PHE 148 148 28000 1 . LYS 149 149 28000 1 . ARG 150 150 28000 1 . ASP 151 151 28000 1 . GLY 152 152 28000 1 . ASP 153 153 28000 1 . ASP 154 154 28000 1 . LEU 155 155 28000 1 . VAL 156 156 28000 1 . TYR 157 157 28000 1 . GLU 158 158 28000 1 . ALA 159 159 28000 1 . GLU 160 160 28000 1 . ILE 161 161 28000 1 . ASP 162 162 28000 1 . LEU 163 163 28000 1 . LEU 164 164 28000 1 . THR 165 165 28000 1 . ALA 166 166 28000 1 . ILE 167 167 28000 1 . ALA 168 168 28000 1 . GLY 169 169 28000 1 . GLY 170 170 28000 1 . GLU 171 171 28000 1 . PHE 172 172 28000 1 . ALA 173 173 28000 1 . LEU 174 174 28000 1 . GLU 175 175 28000 1 . HIS 176 176 28000 1 . VAL 177 177 28000 1 . SER 178 178 28000 1 . GLY 179 179 28000 1 . ASP 180 180 28000 1 . TRP 181 181 28000 1 . LEU 182 182 28000 1 . LYS 183 183 28000 1 . VAL 184 184 28000 1 . GLY 185 185 28000 1 . ILE 186 186 28000 1 . VAL 187 187 28000 1 . PRO 188 188 28000 1 . GLY 189 189 28000 1 . GLU 190 190 28000 1 . VAL 191 191 28000 1 . ILE 192 192 28000 1 . ALA 193 193 28000 1 . PRO 194 194 28000 1 . GLY 195 195 28000 1 . MET 196 196 28000 1 . ARG 197 197 28000 1 . LYS 198 198 28000 1 . VAL 199 199 28000 1 . ILE 200 200 28000 1 . GLU 201 201 28000 1 . GLY 202 202 28000 1 . LYS 203 203 28000 1 . GLY 204 204 28000 1 . MET 205 205 28000 1 . PRO 206 206 28000 1 . ILE 207 207 28000 1 . PRO 208 208 28000 1 . LYS 209 209 28000 1 . TYR 210 210 28000 1 . GLY 211 211 28000 1 . GLY 212 212 28000 1 . TYR 213 213 28000 1 . GLY 214 214 28000 1 . ASN 215 215 28000 1 . LEU 216 216 28000 1 . ILE 217 217 28000 1 . ILE 218 218 28000 1 . LYS 219 219 28000 1 . PHE 220 220 28000 1 . THR 221 221 28000 1 . ILE 222 222 28000 1 . LYS 223 223 28000 1 . ASP 224 224 28000 1 . PRO 225 225 28000 1 . GLU 226 226 28000 1 . ASN 227 227 28000 1 . HIS 228 228 28000 1 . PHE 229 229 28000 1 . THR 230 230 28000 1 . SER 231 231 28000 1 . GLU 232 232 28000 1 . GLU 233 233 28000 1 . ASN 234 234 28000 1 . LEU 235 235 28000 1 . LYS 236 236 28000 1 . LYS 237 237 28000 1 . LEU 238 238 28000 1 . GLU 239 239 28000 1 . GLU 240 240 28000 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 28000 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Ydj1-SBD . 4932 organism . 'Saccharomyces cerevisiae' "baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . 28000 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 28000 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Ydj1-SBD . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pet16b . . . 28000 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 28000 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Ydj1-SBD '[U-13C; U-15N; U-2H]' . . 1 $Ydj1-SBD . . 400 . . uM . . . . 28000 1 2 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 28000 1 3 'potassium chloride' 'natural abundance' . . . . . . 75 . . mM . . . . 28000 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 28000 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 28000 1 pH 7 . pH 28000 1 pressure 1 . atm 28000 1 temperature 298 . K 28000 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 28000 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 28000 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 28000 1 stop_ save_ save_PINE _Software.Sf_category software _Software.Sf_framecode PINE _Software.Entry_ID 28000 _Software.ID 2 _Software.Type . _Software.Name PINE _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 28000 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 28000 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 28000 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 28000 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 28000 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 28000 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 4 '3D HNCOCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 5 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 6 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28000 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 28000 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 28000 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 28000 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 28000 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . 28000 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 28000 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 28000 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ARG H H 1 8.418 0.00 . . . . . . . 112 ARG H . 28000 1 2 . 1 1 1 1 ARG N N 15 123.675 0.00 . . . . . . . 112 ARG N . 28000 1 3 . 1 1 2 2 GLY H H 1 9.121 0.00 . . . . . . . 113 GLY H . 28000 1 4 . 1 1 2 2 GLY N N 15 115.650 0.00 . . . . . . . 113 GLY N . 28000 1 5 . 1 1 3 3 LYS H H 1 8.136 0.00 . . . . . . . 114 LYS H . 28000 1 6 . 1 1 3 3 LYS N N 15 118.920 0.00 . . . . . . . 114 LYS N . 28000 1 7 . 1 1 4 4 ASP H H 1 7.138 0.00 . . . . . . . 115 ASP H . 28000 1 8 . 1 1 4 4 ASP N N 15 115.707 0.00 . . . . . . . 115 ASP N . 28000 1 9 . 1 1 6 6 LYS H H 1 8.204 0.00 . . . . . . . 117 LYS H . 28000 1 10 . 1 1 6 6 LYS N N 15 126.708 0.00 . . . . . . . 117 LYS N . 28000 1 11 . 1 1 7 7 HIS H H 1 8.771 0.00 . . . . . . . 118 HIS H . 28000 1 12 . 1 1 7 7 HIS N N 15 123.751 0.00 . . . . . . . 118 HIS N . 28000 1 13 . 1 1 8 8 GLU H H 1 8.643 0.00 . . . . . . . 119 GLU H . 28000 1 14 . 1 1 8 8 GLU N N 15 124.154 0.00 . . . . . . . 119 GLU N . 28000 1 15 . 1 1 9 9 ILE H H 1 8.903 0.00 . . . . . . . 120 ILE H . 28000 1 16 . 1 1 9 9 ILE N N 15 124.550 0.00 . . . . . . . 120 ILE N . 28000 1 17 . 1 1 10 10 SER H H 1 8.544 0.00 . . . . . . . 121 SER H . 28000 1 18 . 1 1 10 10 SER N N 15 123.112 0.00 . . . . . . . 121 SER N . 28000 1 19 . 1 1 11 11 ALA H H 1 8.917 0.00 . . . . . . . 122 ALA H . 28000 1 20 . 1 1 11 11 ALA N N 15 129.829 0.00 . . . . . . . 122 ALA N . 28000 1 21 . 1 1 12 12 SER H H 1 8.666 0.00 . . . . . . . 123 SER H . 28000 1 22 . 1 1 12 12 SER N N 15 117.754 0.00 . . . . . . . 123 SER N . 28000 1 23 . 1 1 13 13 LEU H H 1 9.881 0.00 . . . . . . . 124 LEU H . 28000 1 24 . 1 1 13 13 LEU N N 15 120.308 0.00 . . . . . . . 124 LEU N . 28000 1 25 . 1 1 14 14 GLU H H 1 9.633 0.00 . . . . . . . 125 GLU H . 28000 1 26 . 1 1 14 14 GLU N N 15 118.672 0.00 . . . . . . . 125 GLU N . 28000 1 27 . 1 1 15 15 GLU H H 1 7.689 0.00 . . . . . . . 126 GLU H . 28000 1 28 . 1 1 15 15 GLU N N 15 121.016 0.00 . . . . . . . 126 GLU N . 28000 1 29 . 1 1 16 16 LEU H H 1 8.311 0.00 . . . . . . . 127 LEU H . 28000 1 30 . 1 1 16 16 LEU N N 15 118.031 0.00 . . . . . . . 127 LEU N . 28000 1 31 . 1 1 17 17 TYR H H 1 8.249 0.00 . . . . . . . 128 TYR H . 28000 1 32 . 1 1 17 17 TYR N N 15 122.096 0.00 . . . . . . . 128 TYR N . 28000 1 33 . 1 1 18 18 LYS H H 1 7.308 0.00 . . . . . . . 129 LYS H . 28000 1 34 . 1 1 18 18 LYS N N 15 114.248 0.00 . . . . . . . 129 LYS N . 28000 1 35 . 1 1 19 19 GLY H H 1 8.045 0.00 . . . . . . . 130 GLY H . 28000 1 36 . 1 1 19 19 GLY N N 15 109.952 0.00 . . . . . . . 130 GLY N . 28000 1 37 . 1 1 20 20 ARG H H 1 8.517 0.00 . . . . . . . 131 ARG H . 28000 1 38 . 1 1 20 20 ARG N N 15 117.668 0.00 . . . . . . . 131 ARG N . 28000 1 39 . 1 1 21 21 THR H H 1 8.745 0.00 . . . . . . . 132 THR H . 28000 1 40 . 1 1 21 21 THR N N 15 121.706 0.00 . . . . . . . 132 THR N . 28000 1 41 . 1 1 22 22 ALA H H 1 8.992 0.00 . . . . . . . 133 ALA H . 28000 1 42 . 1 1 22 22 ALA N N 15 131.629 0.00 . . . . . . . 133 ALA N . 28000 1 43 . 1 1 23 23 LYS H H 1 8.320 0.00 . . . . . . . 134 LYS H . 28000 1 44 . 1 1 23 23 LYS N N 15 122.189 0.00 . . . . . . . 134 LYS N . 28000 1 45 . 1 1 24 24 LEU H H 1 8.384 0.22 . . . . . . . 135 LEU H . 28000 1 46 . 1 1 24 24 LEU N N 15 125.773 1.43 . . . . . . . 135 LEU N . 28000 1 47 . 1 1 25 25 ALA H H 1 8.261 0.00 . . . . . . . 136 ALA H . 28000 1 48 . 1 1 25 25 ALA N N 15 125.392 0.00 . . . . . . . 136 ALA N . 28000 1 49 . 1 1 26 26 LEU H H 1 8.577 0.46 . . . . . . . 137 LEU H . 28000 1 50 . 1 1 26 26 LEU N N 15 123.843 1.85 . . . . . . . 137 LEU N . 28000 1 51 . 1 1 27 27 ASN H H 1 8.393 0.12 . . . . . . . 138 ASN H . 28000 1 52 . 1 1 27 27 ASN N N 15 121.559 2.21 . . . . . . . 138 ASN N . 28000 1 53 . 1 1 28 28 LYS H H 1 8.175 0.00 . . . . . . . 139 LYS H . 28000 1 54 . 1 1 28 28 LYS N N 15 121.563 0.00 . . . . . . . 139 LYS N . 28000 1 55 . 1 1 30 30 ILE H H 1 8.863 0.00 . . . . . . . 141 ILE H . 28000 1 56 . 1 1 30 30 ILE N N 15 121.276 0.00 . . . . . . . 141 ILE N . 28000 1 57 . 1 1 31 31 LEU H H 1 8.052 0.00 . . . . . . . 142 LEU H . 28000 1 58 . 1 1 31 31 LEU N N 15 125.930 0.00 . . . . . . . 142 LEU N . 28000 1 59 . 1 1 33 33 LYS H H 1 8.823 0.00 . . . . . . . 144 LYS H . 28000 1 60 . 1 1 33 33 LYS N N 15 129.373 0.00 . . . . . . . 144 LYS N . 28000 1 61 . 1 1 34 34 GLU H H 1 8.610 0.00 . . . . . . . 145 GLU H . 28000 1 62 . 1 1 34 34 GLU N N 15 122.885 0.00 . . . . . . . 145 GLU N . 28000 1 63 . 1 1 37 37 GLY H H 1 8.268 0.00 . . . . . . . 148 GLY H . 28000 1 64 . 1 1 37 37 GLY N N 15 106.942 0.00 . . . . . . . 148 GLY N . 28000 1 65 . 1 1 38 38 ARG H H 1 7.923 0.00 . . . . . . . 149 ARG H . 28000 1 66 . 1 1 38 38 ARG N N 15 120.066 0.00 . . . . . . . 149 ARG N . 28000 1 67 . 1 1 39 39 GLY H H 1 8.827 0.00 . . . . . . . 150 GLY H . 28000 1 68 . 1 1 39 39 GLY N N 15 117.488 0.00 . . . . . . . 150 GLY N . 28000 1 69 . 1 1 40 40 GLY H H 1 8.215 0.00 . . . . . . . 151 GLY H . 28000 1 70 . 1 1 40 40 GLY N N 15 109.094 0.00 . . . . . . . 151 GLY N . 28000 1 71 . 1 1 41 41 LYS H H 1 7.854 0.00 . . . . . . . 152 LYS H . 28000 1 72 . 1 1 41 41 LYS N N 15 121.528 0.00 . . . . . . . 152 LYS N . 28000 1 73 . 1 1 42 42 LYS H H 1 8.196 0.00 . . . . . . . 153 LYS H . 28000 1 74 . 1 1 42 42 LYS N N 15 121.372 0.00 . . . . . . . 153 LYS N . 28000 1 75 . 1 1 43 43 GLY H H 1 8.327 0.00 . . . . . . . 154 GLY H . 28000 1 76 . 1 1 43 43 GLY N N 15 107.870 0.00 . . . . . . . 154 GLY N . 28000 1 77 . 1 1 44 44 ALA H H 1 7.893 0.00 . . . . . . . 155 ALA H . 28000 1 78 . 1 1 44 44 ALA N N 15 122.386 0.00 . . . . . . . 155 ALA N . 28000 1 79 . 1 1 45 45 VAL H H 1 7.425 0.00 . . . . . . . 156 VAL H . 28000 1 80 . 1 1 45 45 VAL N N 15 118.815 0.00 . . . . . . . 156 VAL N . 28000 1 81 . 1 1 46 46 LYS H H 1 8.359 0.00 . . . . . . . 157 LYS H . 28000 1 82 . 1 1 46 46 LYS N N 15 127.625 0.00 . . . . . . . 157 LYS N . 28000 1 83 . 1 1 47 47 LYS H H 1 8.310 0.00 . . . . . . . 158 LYS H . 28000 1 84 . 1 1 47 47 LYS N N 15 122.090 0.00 . . . . . . . 158 LYS N . 28000 1 85 . 1 1 48 48 CYS H H 1 8.332 0.00 . . . . . . . 159 CYS H . 28000 1 86 . 1 1 48 48 CYS N N 15 126.750 0.00 . . . . . . . 159 CYS N . 28000 1 87 . 1 1 49 49 THR H H 1 7.982 0.00 . . . . . . . 160 THR H . 28000 1 88 . 1 1 49 49 THR N N 15 120.596 0.00 . . . . . . . 160 THR N . 28000 1 89 . 1 1 50 50 SER H H 1 8.907 0.00 . . . . . . . 161 SER H . 28000 1 90 . 1 1 50 50 SER N N 15 122.169 0.00 . . . . . . . 161 SER N . 28000 1 91 . 1 1 51 51 CYS H H 1 7.557 0.00 . . . . . . . 162 CYS H . 28000 1 92 . 1 1 51 51 CYS N N 15 115.823 0.00 . . . . . . . 162 CYS N . 28000 1 93 . 1 1 52 52 ASN H H 1 7.748 0.00 . . . . . . . 163 ASN H . 28000 1 94 . 1 1 52 52 ASN N N 15 122.489 0.00 . . . . . . . 163 ASN N . 28000 1 95 . 1 1 53 53 GLY H H 1 8.460 0.00 . . . . . . . 164 GLY H . 28000 1 96 . 1 1 53 53 GLY N N 15 107.113 0.00 . . . . . . . 164 GLY N . 28000 1 97 . 1 1 54 54 GLN H H 1 7.832 0.00 . . . . . . . 165 GLN H . 28000 1 98 . 1 1 54 54 GLN N N 15 118.892 0.00 . . . . . . . 165 GLN N . 28000 1 99 . 1 1 55 55 GLY H H 1 9.926 0.00 . . . . . . . 166 GLY H . 28000 1 100 . 1 1 55 55 GLY N N 15 112.317 0.00 . . . . . . . 166 GLY N . 28000 1 101 . 1 1 56 56 ILE H H 1 6.663 0.00 . . . . . . . 167 ILE H . 28000 1 102 . 1 1 56 56 ILE N N 15 116.401 0.00 . . . . . . . 167 ILE N . 28000 1 103 . 1 1 57 57 LYS H H 1 8.736 0.00 . . . . . . . 168 LYS H . 28000 1 104 . 1 1 57 57 LYS N N 15 122.811 0.00 . . . . . . . 168 LYS N . 28000 1 105 . 1 1 58 58 PHE H H 1 8.591 0.00 . . . . . . . 169 PHE H . 28000 1 106 . 1 1 58 58 PHE N N 15 120.729 0.00 . . . . . . . 169 PHE N . 28000 1 107 . 1 1 59 59 VAL H H 1 8.832 0.00 . . . . . . . 170 VAL H . 28000 1 108 . 1 1 59 59 VAL N N 15 122.423 0.00 . . . . . . . 170 VAL N . 28000 1 109 . 1 1 60 60 THR H H 1 8.286 0.00 . . . . . . . 171 THR H . 28000 1 110 . 1 1 60 60 THR N N 15 117.857 0.00 . . . . . . . 171 THR N . 28000 1 111 . 1 1 61 61 ARG H H 1 8.989 0.00 . . . . . . . 172 ARG H . 28000 1 112 . 1 1 61 61 ARG N N 15 124.161 0.00 . . . . . . . 172 ARG N . 28000 1 113 . 1 1 62 62 GLN H H 1 8.720 0.00 . . . . . . . 173 GLN H . 28000 1 114 . 1 1 62 62 GLN N N 15 124.821 0.00 . . . . . . . 173 GLN N . 28000 1 115 . 1 1 63 63 MET H H 1 8.770 0.00 . . . . . . . 174 MET H . 28000 1 116 . 1 1 63 63 MET N N 15 128.601 0.00 . . . . . . . 174 MET N . 28000 1 117 . 1 1 66 66 MET H H 1 7.540 0.00 . . . . . . . 177 MET H . 28000 1 118 . 1 1 66 66 MET N N 15 119.594 0.00 . . . . . . . 177 MET N . 28000 1 119 . 1 1 67 67 ILE H H 1 8.300 0.00 . . . . . . . 178 ILE H . 28000 1 120 . 1 1 67 67 ILE N N 15 123.398 0.00 . . . . . . . 178 ILE N . 28000 1 121 . 1 1 68 68 GLN H H 1 8.724 0.00 . . . . . . . 179 GLN H . 28000 1 122 . 1 1 68 68 GLN N N 15 126.838 0.00 . . . . . . . 179 GLN N . 28000 1 123 . 1 1 69 69 ARG H H 1 8.394 0.00 . . . . . . . 180 ARG H . 28000 1 124 . 1 1 69 69 ARG N N 15 123.818 0.00 . . . . . . . 180 ARG N . 28000 1 125 . 1 1 70 70 PHE H H 1 8.970 0.00 . . . . . . . 181 PHE H . 28000 1 126 . 1 1 70 70 PHE N N 15 123.434 0.00 . . . . . . . 181 PHE N . 28000 1 127 . 1 1 71 71 GLN H H 1 8.611 0.00 . . . . . . . 182 GLN H . 28000 1 128 . 1 1 71 71 GLN N N 15 121.620 0.00 . . . . . . . 182 GLN N . 28000 1 129 . 1 1 72 72 THR H H 1 8.599 0.00 . . . . . . . 183 THR H . 28000 1 130 . 1 1 72 72 THR N N 15 118.018 0.00 . . . . . . . 183 THR N . 28000 1 131 . 1 1 73 73 GLU H H 1 8.247 0.00 . . . . . . . 184 GLU H . 28000 1 132 . 1 1 73 73 GLU N N 15 123.982 0.00 . . . . . . . 184 GLU N . 28000 1 133 . 1 1 74 74 CYS H H 1 7.997 0.00 . . . . . . . 185 CYS H . 28000 1 134 . 1 1 74 74 CYS N N 15 127.380 0.00 . . . . . . . 185 CYS N . 28000 1 135 . 1 1 75 75 ASP H H 1 8.664 0.00 . . . . . . . 186 ASP H . 28000 1 136 . 1 1 75 75 ASP N N 15 127.755 0.00 . . . . . . . 186 ASP N . 28000 1 137 . 1 1 76 76 VAL H H 1 8.614 0.00 . . . . . . . 187 VAL H . 28000 1 138 . 1 1 76 76 VAL N N 15 124.174 0.00 . . . . . . . 187 VAL N . 28000 1 139 . 1 1 77 77 CYS H H 1 7.578 0.00 . . . . . . . 188 CYS H . 28000 1 140 . 1 1 77 77 CYS N N 15 116.264 0.00 . . . . . . . 188 CYS N . 28000 1 141 . 1 1 78 78 HIS H H 1 7.380 0.00 . . . . . . . 189 HIS H . 28000 1 142 . 1 1 78 78 HIS N N 15 120.226 0.00 . . . . . . . 189 HIS N . 28000 1 143 . 1 1 79 79 GLY H H 1 7.999 0.00 . . . . . . . 190 GLY H . 28000 1 144 . 1 1 79 79 GLY N N 15 104.849 0.00 . . . . . . . 190 GLY N . 28000 1 145 . 1 1 80 80 THR H H 1 7.649 0.00 . . . . . . . 191 THR H . 28000 1 146 . 1 1 80 80 THR N N 15 111.438 0.00 . . . . . . . 191 THR N . 28000 1 147 . 1 1 81 81 GLY H H 1 9.487 0.00 . . . . . . . 192 GLY H . 28000 1 148 . 1 1 81 81 GLY N N 15 115.253 0.00 . . . . . . . 192 GLY N . 28000 1 149 . 1 1 82 82 ASP H H 1 8.070 0.00 . . . . . . . 193 ASP H . 28000 1 150 . 1 1 82 82 ASP N N 15 121.198 0.00 . . . . . . . 193 ASP N . 28000 1 151 . 1 1 83 83 ILE H H 1 8.999 0.00 . . . . . . . 194 ILE H . 28000 1 152 . 1 1 83 83 ILE N N 15 119.091 0.00 . . . . . . . 194 ILE N . 28000 1 153 . 1 1 84 84 ILE H H 1 8.128 0.00 . . . . . . . 195 ILE H . 28000 1 154 . 1 1 84 84 ILE N N 15 125.613 0.00 . . . . . . . 195 ILE N . 28000 1 155 . 1 1 85 85 ASP H H 1 9.317 0.00 . . . . . . . 196 ASP H . 28000 1 156 . 1 1 85 85 ASP N N 15 131.981 0.00 . . . . . . . 196 ASP N . 28000 1 157 . 1 1 87 87 LYS H H 1 8.681 0.00 . . . . . . . 198 LYS H . 28000 1 158 . 1 1 87 87 LYS N N 15 116.455 0.00 . . . . . . . 198 LYS N . 28000 1 159 . 1 1 88 88 ASP H H 1 8.074 0.00 . . . . . . . 199 ASP H . 28000 1 160 . 1 1 88 88 ASP N N 15 118.681 0.00 . . . . . . . 199 ASP N . 28000 1 161 . 1 1 89 89 ARG H H 1 7.038 0.00 . . . . . . . 200 ARG H . 28000 1 162 . 1 1 89 89 ARG N N 15 121.453 0.00 . . . . . . . 200 ARG N . 28000 1 163 . 1 1 90 90 CYS H H 1 8.043 0.00 . . . . . . . 201 CYS H . 28000 1 164 . 1 1 90 90 CYS N N 15 128.655 0.00 . . . . . . . 201 CYS N . 28000 1 165 . 1 1 91 91 LYS H H 1 8.948 0.00 . . . . . . . 202 LYS H . 28000 1 166 . 1 1 91 91 LYS N N 15 129.698 0.00 . . . . . . . 202 LYS N . 28000 1 167 . 1 1 92 92 SER H H 1 8.863 0.00 . . . . . . . 203 SER H . 28000 1 168 . 1 1 92 92 SER N N 15 118.954 0.00 . . . . . . . 203 SER N . 28000 1 169 . 1 1 95 95 GLY H H 1 8.232 0.00 . . . . . . . 206 GLY H . 28000 1 170 . 1 1 95 95 GLY N N 15 109.423 0.00 . . . . . . . 206 GLY N . 28000 1 171 . 1 1 96 96 LYS H H 1 8.111 0.00 . . . . . . . 207 LYS H . 28000 1 172 . 1 1 96 96 LYS N N 15 119.030 0.00 . . . . . . . 207 LYS N . 28000 1 173 . 1 1 97 97 LYS H H 1 8.407 0.07 . . . . . . . 208 LYS H . 28000 1 174 . 1 1 97 97 LYS N N 15 121.642 0.53 . . . . . . . 208 LYS N . 28000 1 175 . 1 1 99 99 GLU H H 1 8.495 0.00 . . . . . . . 210 GLU H . 28000 1 176 . 1 1 99 99 GLU N N 15 125.795 0.00 . . . . . . . 210 GLU N . 28000 1 177 . 1 1 100 100 ASN H H 1 8.482 0.00 . . . . . . . 211 ASN H . 28000 1 178 . 1 1 100 100 ASN N N 15 119.715 0.00 . . . . . . . 211 ASN N . 28000 1 179 . 1 1 101 101 GLU H H 1 8.750 0.32 . . . . . . . 212 GLU H . 28000 1 180 . 1 1 101 101 GLU N N 15 123.755 1.27 . . . . . . . 212 GLU N . 28000 1 181 . 1 1 102 102 ARG H H 1 8.417 0.00 . . . . . . . 213 ARG H . 28000 1 182 . 1 1 102 102 ARG N N 15 127.261 0.00 . . . . . . . 213 ARG N . 28000 1 183 . 1 1 103 103 LYS H H 1 8.422 0.48 . . . . . . . 214 LYS H . 28000 1 184 . 1 1 103 103 LYS N N 15 129.111 0.07 . . . . . . . 214 LYS N . 28000 1 185 . 1 1 104 104 ILE H H 1 8.417 0.00 . . . . . . . 215 ILE H . 28000 1 186 . 1 1 104 104 ILE N N 15 125.028 0.00 . . . . . . . 215 ILE N . 28000 1 187 . 1 1 105 105 LEU H H 1 8.843 0.00 . . . . . . . 216 LEU H . 28000 1 188 . 1 1 105 105 LEU N N 15 129.502 0.00 . . . . . . . 216 LEU N . 28000 1 189 . 1 1 106 106 GLU H H 1 8.287 0.00 . . . . . . . 217 GLU H . 28000 1 190 . 1 1 106 106 GLU N N 15 122.771 0.00 . . . . . . . 217 GLU N . 28000 1 191 . 1 1 107 107 VAL H H 1 8.771 0.00 . . . . . . . 218 VAL H . 28000 1 192 . 1 1 107 107 VAL N N 15 126.627 0.00 . . . . . . . 218 VAL N . 28000 1 193 . 1 1 108 108 HIS H H 1 9.007 0.00 . . . . . . . 219 HIS H . 28000 1 194 . 1 1 108 108 HIS N N 15 127.199 0.00 . . . . . . . 219 HIS N . 28000 1 195 . 1 1 109 109 VAL H H 1 8.811 0.00 . . . . . . . 220 VAL H . 28000 1 196 . 1 1 109 109 VAL N N 15 128.232 0.00 . . . . . . . 220 VAL N . 28000 1 197 . 1 1 110 110 GLU H H 1 7.489 0.00 . . . . . . . 221 GLU H . 28000 1 198 . 1 1 110 110 GLU N N 15 129.806 0.00 . . . . . . . 221 GLU N . 28000 1 199 . 1 1 112 112 GLY H H 1 9.373 0.00 . . . . . . . 223 GLY H . 28000 1 200 . 1 1 112 112 GLY N N 15 110.857 0.00 . . . . . . . 223 GLY N . 28000 1 201 . 1 1 113 113 MET H H 1 7.594 0.00 . . . . . . . 224 MET H . 28000 1 202 . 1 1 113 113 MET N N 15 119.536 0.00 . . . . . . . 224 MET N . 28000 1 203 . 1 1 114 114 LYS H H 1 7.964 0.00 . . . . . . . 225 LYS H . 28000 1 204 . 1 1 114 114 LYS N N 15 118.964 0.00 . . . . . . . 225 LYS N . 28000 1 205 . 1 1 115 115 ASP H H 1 8.691 0.00 . . . . . . . 226 ASP H . 28000 1 206 . 1 1 115 115 ASP N N 15 118.874 0.00 . . . . . . . 226 ASP N . 28000 1 207 . 1 1 116 116 GLY H H 1 9.308 0.00 . . . . . . . 227 GLY H . 28000 1 208 . 1 1 116 116 GLY N N 15 116.026 0.00 . . . . . . . 227 GLY N . 28000 1 209 . 1 1 117 117 GLN H H 1 8.108 0.00 . . . . . . . 228 GLN H . 28000 1 210 . 1 1 117 117 GLN N N 15 122.407 0.00 . . . . . . . 228 GLN N . 28000 1 211 . 1 1 118 118 ARG H H 1 8.309 0.00 . . . . . . . 229 ARG H . 28000 1 212 . 1 1 118 118 ARG N N 15 121.802 0.00 . . . . . . . 229 ARG N . 28000 1 213 . 1 1 119 119 ILE H H 1 9.573 0.00 . . . . . . . 230 ILE H . 28000 1 214 . 1 1 119 119 ILE N N 15 127.222 0.00 . . . . . . . 230 ILE N . 28000 1 215 . 1 1 120 120 VAL H H 1 8.540 0.00 . . . . . . . 231 VAL H . 28000 1 216 . 1 1 120 120 VAL N N 15 127.044 0.00 . . . . . . . 231 VAL N . 28000 1 217 . 1 1 121 121 PHE H H 1 9.754 0.00 . . . . . . . 232 PHE H . 28000 1 218 . 1 1 121 121 PHE N N 15 129.734 0.00 . . . . . . . 232 PHE N . 28000 1 219 . 1 1 122 122 LYS H H 1 8.667 0.00 . . . . . . . 233 LYS H . 28000 1 220 . 1 1 122 122 LYS N N 15 126.820 0.00 . . . . . . . 233 LYS N . 28000 1 221 . 1 1 123 123 GLY H H 1 9.713 0.00 . . . . . . . 234 GLY H . 28000 1 222 . 1 1 123 123 GLY N N 15 114.158 0.00 . . . . . . . 234 GLY N . 28000 1 223 . 1 1 124 124 GLU H H 1 6.671 0.00 . . . . . . . 235 GLU H . 28000 1 224 . 1 1 124 124 GLU N N 15 117.858 0.00 . . . . . . . 235 GLU N . 28000 1 225 . 1 1 125 125 ALA H H 1 7.826 0.00 . . . . . . . 236 ALA H . 28000 1 226 . 1 1 125 125 ALA N N 15 120.441 0.00 . . . . . . . 236 ALA N . 28000 1 227 . 1 1 127 127 GLN H H 1 7.913 0.00 . . . . . . . 238 GLN H . 28000 1 228 . 1 1 127 127 GLN N N 15 128.107 0.00 . . . . . . . 238 GLN N . 28000 1 229 . 1 1 128 128 ALA H H 1 8.316 0.00 . . . . . . . 239 ALA H . 28000 1 230 . 1 1 128 128 ALA N N 15 127.366 0.00 . . . . . . . 239 ALA N . 28000 1 231 . 1 1 130 130 ASP H H 1 8.668 0.00 . . . . . . . 241 ASP H . 28000 1 232 . 1 1 130 130 ASP N N 15 116.637 0.00 . . . . . . . 241 ASP N . 28000 1 233 . 1 1 131 131 VAL H H 1 7.435 0.00 . . . . . . . 242 VAL H . 28000 1 234 . 1 1 131 131 VAL N N 15 117.876 0.00 . . . . . . . 242 VAL N . 28000 1 235 . 1 1 132 132 ILE H H 1 8.620 0.00 . . . . . . . 243 ILE H . 28000 1 236 . 1 1 132 132 ILE N N 15 130.387 0.00 . . . . . . . 243 ILE N . 28000 1 237 . 1 1 134 134 GLY H H 1 8.970 0.00 . . . . . . . 245 GLY H . 28000 1 238 . 1 1 134 134 GLY N N 15 108.235 0.00 . . . . . . . 245 GLY N . 28000 1 239 . 1 1 135 135 ASP H H 1 8.836 0.00 . . . . . . . 246 ASP H . 28000 1 240 . 1 1 135 135 ASP N N 15 118.946 0.00 . . . . . . . 246 ASP N . 28000 1 241 . 1 1 136 136 VAL H H 1 8.154 0.00 . . . . . . . 247 VAL H . 28000 1 242 . 1 1 136 136 VAL N N 15 120.620 0.00 . . . . . . . 247 VAL N . 28000 1 243 . 1 1 137 137 VAL H H 1 9.076 0.00 . . . . . . . 248 VAL H . 28000 1 244 . 1 1 137 137 VAL N N 15 129.508 0.00 . . . . . . . 248 VAL N . 28000 1 245 . 1 1 138 138 PHE H H 1 9.341 0.00 . . . . . . . 249 PHE H . 28000 1 246 . 1 1 138 138 PHE N N 15 125.666 0.00 . . . . . . . 249 PHE N . 28000 1 247 . 1 1 139 139 ILE H H 1 8.668 0.00 . . . . . . . 250 ILE H . 28000 1 248 . 1 1 139 139 ILE N N 15 122.852 0.00 . . . . . . . 250 ILE N . 28000 1 249 . 1 1 140 140 VAL H H 1 8.833 0.00 . . . . . . . 251 VAL H . 28000 1 250 . 1 1 140 140 VAL N N 15 129.504 0.00 . . . . . . . 251 VAL N . 28000 1 251 . 1 1 141 141 SER H H 1 8.856 0.00 . . . . . . . 252 SER H . 28000 1 252 . 1 1 141 141 SER N N 15 125.753 0.00 . . . . . . . 252 SER N . 28000 1 253 . 1 1 142 142 GLU H H 1 9.122 0.00 . . . . . . . 253 GLU H . 28000 1 254 . 1 1 142 142 GLU N N 15 129.496 0.00 . . . . . . . 253 GLU N . 28000 1 255 . 1 1 143 143 ARG H H 1 8.675 0.00 . . . . . . . 254 ARG H . 28000 1 256 . 1 1 143 143 ARG N N 15 129.539 0.00 . . . . . . . 254 ARG N . 28000 1 257 . 1 1 145 145 HIS H H 1 9.153 0.00 . . . . . . . 256 HIS H . 28000 1 258 . 1 1 145 145 HIS N N 15 127.523 0.00 . . . . . . . 256 HIS N . 28000 1 259 . 1 1 146 146 LYS H H 1 7.953 0.10 . . . . . . . 257 LYS H . 28000 1 260 . 1 1 146 146 LYS N N 15 123.019 2.39 . . . . . . . 257 LYS N . 28000 1 261 . 1 1 148 148 PHE H H 1 8.877 0.00 . . . . . . . 259 PHE H . 28000 1 262 . 1 1 148 148 PHE N N 15 123.926 0.00 . . . . . . . 259 PHE N . 28000 1 263 . 1 1 149 149 LYS H H 1 8.692 0.00 . . . . . . . 260 LYS H . 28000 1 264 . 1 1 149 149 LYS N N 15 119.907 0.00 . . . . . . . 260 LYS N . 28000 1 265 . 1 1 150 150 ARG H H 1 9.118 0.00 . . . . . . . 261 ARG H . 28000 1 266 . 1 1 150 150 ARG N N 15 125.561 0.00 . . . . . . . 261 ARG N . 28000 1 267 . 1 1 151 151 ASP H H 1 8.636 0.00 . . . . . . . 262 ASP H . 28000 1 268 . 1 1 151 151 ASP N N 15 129.859 0.00 . . . . . . . 262 ASP N . 28000 1 269 . 1 1 152 152 GLY H H 1 8.867 0.00 . . . . . . . 263 GLY H . 28000 1 270 . 1 1 152 152 GLY N N 15 114.557 0.00 . . . . . . . 263 GLY N . 28000 1 271 . 1 1 153 153 ASP H H 1 9.164 0.00 . . . . . . . 264 ASP H . 28000 1 272 . 1 1 153 153 ASP N N 15 129.258 0.00 . . . . . . . 264 ASP N . 28000 1 273 . 1 1 154 154 ASP H H 1 8.176 0.00 . . . . . . . 265 ASP H . 28000 1 274 . 1 1 154 154 ASP N N 15 121.796 0.00 . . . . . . . 265 ASP N . 28000 1 275 . 1 1 155 155 LEU H H 1 8.625 0.00 . . . . . . . 266 LEU H . 28000 1 276 . 1 1 155 155 LEU N N 15 118.745 0.00 . . . . . . . 266 LEU N . 28000 1 277 . 1 1 156 156 VAL H H 1 9.249 0.00 . . . . . . . 267 VAL H . 28000 1 278 . 1 1 156 156 VAL N N 15 121.768 0.00 . . . . . . . 267 VAL N . 28000 1 279 . 1 1 157 157 TYR H H 1 9.328 0.00 . . . . . . . 268 TYR H . 28000 1 280 . 1 1 157 157 TYR N N 15 131.403 0.00 . . . . . . . 268 TYR N . 28000 1 281 . 1 1 158 158 GLU H H 1 7.772 0.00 . . . . . . . 269 GLU H . 28000 1 282 . 1 1 158 158 GLU N N 15 128.158 0.00 . . . . . . . 269 GLU N . 28000 1 283 . 1 1 159 159 ALA H H 1 8.399 0.00 . . . . . . . 270 ALA H . 28000 1 284 . 1 1 159 159 ALA N N 15 128.179 0.00 . . . . . . . 270 ALA N . 28000 1 285 . 1 1 160 160 GLU H H 1 8.190 0.00 . . . . . . . 271 GLU H . 28000 1 286 . 1 1 160 160 GLU N N 15 123.538 0.00 . . . . . . . 271 GLU N . 28000 1 287 . 1 1 161 161 ILE H H 1 8.638 0.00 . . . . . . . 272 ILE H . 28000 1 288 . 1 1 161 161 ILE N N 15 119.386 0.00 . . . . . . . 272 ILE N . 28000 1 289 . 1 1 162 162 ASP H H 1 8.234 0.00 . . . . . . . 273 ASP H . 28000 1 290 . 1 1 162 162 ASP N N 15 120.852 0.00 . . . . . . . 273 ASP N . 28000 1 291 . 1 1 163 163 LEU H H 1 8.838 0.00 . . . . . . . 274 LEU H . 28000 1 292 . 1 1 163 163 LEU N N 15 123.114 0.00 . . . . . . . 274 LEU N . 28000 1 293 . 1 1 164 164 LEU H H 1 8.092 0.00 . . . . . . . 275 LEU H . 28000 1 294 . 1 1 164 164 LEU N N 15 117.208 0.00 . . . . . . . 275 LEU N . 28000 1 295 . 1 1 165 165 THR H H 1 7.666 0.00 . . . . . . . 276 THR H . 28000 1 296 . 1 1 165 165 THR N N 15 117.612 0.00 . . . . . . . 276 THR N . 28000 1 297 . 1 1 166 166 ALA H H 1 7.812 0.00 . . . . . . . 277 ALA H . 28000 1 298 . 1 1 166 166 ALA N N 15 123.098 0.00 . . . . . . . 277 ALA N . 28000 1 299 . 1 1 167 167 ILE H H 1 8.138 0.00 . . . . . . . 278 ILE H . 28000 1 300 . 1 1 167 167 ILE N N 15 117.081 0.00 . . . . . . . 278 ILE N . 28000 1 301 . 1 1 168 168 ALA H H 1 8.425 0.00 . . . . . . . 279 ALA H . 28000 1 302 . 1 1 168 168 ALA N N 15 120.884 0.00 . . . . . . . 279 ALA N . 28000 1 303 . 1 1 169 169 GLY H H 1 8.131 0.00 . . . . . . . 280 GLY H . 28000 1 304 . 1 1 169 169 GLY N N 15 108.342 0.00 . . . . . . . 280 GLY N . 28000 1 305 . 1 1 170 170 GLY H H 1 8.178 0.00 . . . . . . . 281 GLY H . 28000 1 306 . 1 1 170 170 GLY N N 15 104.429 0.00 . . . . . . . 281 GLY N . 28000 1 307 . 1 1 171 171 GLU H H 1 8.502 0.00 . . . . . . . 282 GLU H . 28000 1 308 . 1 1 171 171 GLU N N 15 121.427 0.00 . . . . . . . 282 GLU N . 28000 1 309 . 1 1 172 172 PHE H H 1 8.766 0.00 . . . . . . . 283 PHE H . 28000 1 310 . 1 1 172 172 PHE N N 15 122.128 0.00 . . . . . . . 283 PHE N . 28000 1 311 . 1 1 173 173 ALA H H 1 8.309 0.00 . . . . . . . 284 ALA H . 28000 1 312 . 1 1 173 173 ALA N N 15 125.337 0.00 . . . . . . . 284 ALA N . 28000 1 313 . 1 1 174 174 LEU H H 1 8.763 0.00 . . . . . . . 285 LEU H . 28000 1 314 . 1 1 174 174 LEU N N 15 120.057 0.00 . . . . . . . 285 LEU N . 28000 1 315 . 1 1 175 175 GLU H H 1 8.144 0.00 . . . . . . . 286 GLU H . 28000 1 316 . 1 1 175 175 GLU N N 15 126.432 0.00 . . . . . . . 286 GLU N . 28000 1 317 . 1 1 176 176 HIS H H 1 8.465 0.00 . . . . . . . 287 HIS H . 28000 1 318 . 1 1 176 176 HIS N N 15 127.861 0.00 . . . . . . . 287 HIS N . 28000 1 319 . 1 1 177 177 VAL H H 1 9.056 0.00 . . . . . . . 288 VAL H . 28000 1 320 . 1 1 177 177 VAL N N 15 127.185 0.00 . . . . . . . 288 VAL N . 28000 1 321 . 1 1 178 178 SER H H 1 8.757 0.00 . . . . . . . 289 SER H . 28000 1 322 . 1 1 178 178 SER N N 15 117.292 0.00 . . . . . . . 289 SER N . 28000 1 323 . 1 1 179 179 GLY H H 1 7.852 0.00 . . . . . . . 290 GLY H . 28000 1 324 . 1 1 179 179 GLY N N 15 111.185 0.00 . . . . . . . 290 GLY N . 28000 1 325 . 1 1 180 180 ASP H H 1 7.426 0.00 . . . . . . . 291 ASP H . 28000 1 326 . 1 1 180 180 ASP N N 15 120.412 0.00 . . . . . . . 291 ASP N . 28000 1 327 . 1 1 181 181 TRP H H 1 8.717 0.00 . . . . . . . 292 TRP H . 28000 1 328 . 1 1 181 181 TRP HE1 H 1 9.993 0.00 . . . . . . . 292 TRP HE1 . 28000 1 329 . 1 1 181 181 TRP N N 15 122.011 0.00 . . . . . . . 292 TRP N . 28000 1 330 . 1 1 181 181 TRP NE1 N 15 129.965 0.00 . . . . . . . 292 TRP NE1 . 28000 1 331 . 1 1 182 182 LEU H H 1 9.240 0.00 . . . . . . . 293 LEU H . 28000 1 332 . 1 1 182 182 LEU N N 15 126.457 0.00 . . . . . . . 293 LEU N . 28000 1 333 . 1 1 183 183 LYS H H 1 8.339 0.00 . . . . . . . 294 LYS H . 28000 1 334 . 1 1 183 183 LYS N N 15 123.852 0.00 . . . . . . . 294 LYS N . 28000 1 335 . 1 1 184 184 VAL H H 1 8.872 0.00 . . . . . . . 295 VAL H . 28000 1 336 . 1 1 184 184 VAL N N 15 126.467 0.00 . . . . . . . 295 VAL N . 28000 1 337 . 1 1 185 185 GLY H H 1 8.402 0.00 . . . . . . . 296 GLY H . 28000 1 338 . 1 1 185 185 GLY N N 15 114.198 0.00 . . . . . . . 296 GLY N . 28000 1 339 . 1 1 186 186 ILE H H 1 8.575 0.00 . . . . . . . 297 ILE H . 28000 1 340 . 1 1 186 186 ILE N N 15 121.485 0.00 . . . . . . . 297 ILE N . 28000 1 341 . 1 1 187 187 VAL H H 1 9.037 0.00 . . . . . . . 298 VAL H . 28000 1 342 . 1 1 187 187 VAL N N 15 126.192 0.00 . . . . . . . 298 VAL N . 28000 1 343 . 1 1 189 189 GLY H H 1 8.026 0.00 . . . . . . . 300 GLY H . 28000 1 344 . 1 1 189 189 GLY N N 15 112.504 0.00 . . . . . . . 300 GLY N . 28000 1 345 . 1 1 190 190 GLU H H 1 7.769 0.00 . . . . . . . 301 GLU H . 28000 1 346 . 1 1 190 190 GLU N N 15 121.584 0.00 . . . . . . . 301 GLU N . 28000 1 347 . 1 1 191 191 VAL H H 1 8.675 0.00 . . . . . . . 302 VAL H . 28000 1 348 . 1 1 191 191 VAL N N 15 121.123 0.00 . . . . . . . 302 VAL N . 28000 1 349 . 1 1 192 192 ILE H H 1 8.472 0.00 . . . . . . . 303 ILE H . 28000 1 350 . 1 1 192 192 ILE N N 15 125.103 0.00 . . . . . . . 303 ILE N . 28000 1 351 . 1 1 193 193 ALA H H 1 7.249 0.00 . . . . . . . 304 ALA H . 28000 1 352 . 1 1 193 193 ALA N N 15 125.303 0.00 . . . . . . . 304 ALA N . 28000 1 353 . 1 1 195 195 GLY H H 1 7.970 0.00 . . . . . . . 306 GLY H . 28000 1 354 . 1 1 195 195 GLY N N 15 112.446 0.00 . . . . . . . 306 GLY N . 28000 1 355 . 1 1 196 196 MET H H 1 7.812 0.00 . . . . . . . 307 MET H . 28000 1 356 . 1 1 196 196 MET N N 15 124.240 0.00 . . . . . . . 307 MET N . 28000 1 357 . 1 1 198 198 LYS H H 1 9.096 0.00 . . . . . . . 309 LYS H . 28000 1 358 . 1 1 198 198 LYS N N 15 123.848 0.00 . . . . . . . 309 LYS N . 28000 1 359 . 1 1 199 199 VAL H H 1 8.769 0.00 . . . . . . . 310 VAL H . 28000 1 360 . 1 1 199 199 VAL N N 15 126.738 0.00 . . . . . . . 310 VAL N . 28000 1 361 . 1 1 200 200 ILE H H 1 9.828 0.00 . . . . . . . 311 ILE H . 28000 1 362 . 1 1 200 200 ILE N N 15 130.439 0.00 . . . . . . . 311 ILE N . 28000 1 363 . 1 1 201 201 GLU H H 1 8.991 0.00 . . . . . . . 312 GLU H . 28000 1 364 . 1 1 201 201 GLU N N 15 130.741 0.00 . . . . . . . 312 GLU N . 28000 1 365 . 1 1 202 202 GLY H H 1 8.542 0.00 . . . . . . . 313 GLY H . 28000 1 366 . 1 1 202 202 GLY N N 15 111.201 0.00 . . . . . . . 313 GLY N . 28000 1 367 . 1 1 203 203 LYS H H 1 6.558 0.00 . . . . . . . 314 LYS H . 28000 1 368 . 1 1 203 203 LYS N N 15 115.104 0.00 . . . . . . . 314 LYS N . 28000 1 369 . 1 1 204 204 GLY H H 1 8.034 0.00 . . . . . . . 315 GLY H . 28000 1 370 . 1 1 204 204 GLY N N 15 110.435 0.00 . . . . . . . 315 GLY N . 28000 1 371 . 1 1 205 205 MET H H 1 8.305 0.00 . . . . . . . 316 MET H . 28000 1 372 . 1 1 205 205 MET N N 15 117.254 0.00 . . . . . . . 316 MET N . 28000 1 373 . 1 1 207 207 ILE H H 1 7.535 0.00 . . . . . . . 318 ILE H . 28000 1 374 . 1 1 207 207 ILE N N 15 123.982 0.00 . . . . . . . 318 ILE N . 28000 1 375 . 1 1 209 209 LYS H H 1 8.667 0.00 . . . . . . . 320 LYS H . 28000 1 376 . 1 1 209 209 LYS N N 15 118.293 0.00 . . . . . . . 320 LYS N . 28000 1 377 . 1 1 210 210 TYR H H 1 8.237 0.00 . . . . . . . 321 TYR H . 28000 1 378 . 1 1 210 210 TYR N N 15 119.561 0.00 . . . . . . . 321 TYR N . 28000 1 379 . 1 1 211 211 GLY H H 1 7.233 0.00 . . . . . . . 322 GLY H . 28000 1 380 . 1 1 211 211 GLY N N 15 106.314 0.00 . . . . . . . 322 GLY N . 28000 1 381 . 1 1 212 212 GLY H H 1 7.426 0.00 . . . . . . . 323 GLY H . 28000 1 382 . 1 1 212 212 GLY N N 15 104.211 0.00 . . . . . . . 323 GLY N . 28000 1 383 . 1 1 213 213 TYR H H 1 8.332 0.00 . . . . . . . 324 TYR H . 28000 1 384 . 1 1 213 213 TYR N N 15 118.199 0.00 . . . . . . . 324 TYR N . 28000 1 385 . 1 1 214 214 GLY H H 1 8.880 0.00 . . . . . . . 325 GLY H . 28000 1 386 . 1 1 214 214 GLY N N 15 106.652 0.00 . . . . . . . 325 GLY N . 28000 1 387 . 1 1 215 215 ASN H H 1 9.626 0.00 . . . . . . . 326 ASN H . 28000 1 388 . 1 1 215 215 ASN N N 15 119.041 0.00 . . . . . . . 326 ASN N . 28000 1 389 . 1 1 216 216 LEU H H 1 8.135 0.00 . . . . . . . 327 LEU H . 28000 1 390 . 1 1 216 216 LEU N N 15 121.247 0.00 . . . . . . . 327 LEU N . 28000 1 391 . 1 1 217 217 ILE H H 1 9.699 0.00 . . . . . . . 328 ILE H . 28000 1 392 . 1 1 217 217 ILE N N 15 130.007 0.00 . . . . . . . 328 ILE N . 28000 1 393 . 1 1 218 218 ILE H H 1 9.216 0.00 . . . . . . . 329 ILE H . 28000 1 394 . 1 1 218 218 ILE N N 15 126.899 0.00 . . . . . . . 329 ILE N . 28000 1 395 . 1 1 219 219 LYS H H 1 8.476 0.00 . . . . . . . 330 LYS H . 28000 1 396 . 1 1 219 219 LYS N N 15 126.262 0.00 . . . . . . . 330 LYS N . 28000 1 397 . 1 1 220 220 PHE H H 1 8.669 0.00 . . . . . . . 331 PHE H . 28000 1 398 . 1 1 220 220 PHE N N 15 121.757 0.00 . . . . . . . 331 PHE N . 28000 1 399 . 1 1 221 221 THR H H 1 8.672 0.00 . . . . . . . 332 THR H . 28000 1 400 . 1 1 221 221 THR N N 15 118.782 0.00 . . . . . . . 332 THR N . 28000 1 401 . 1 1 222 222 ILE H H 1 8.536 0.00 . . . . . . . 333 ILE H . 28000 1 402 . 1 1 222 222 ILE N N 15 125.840 0.00 . . . . . . . 333 ILE N . 28000 1 403 . 1 1 223 223 LYS H H 1 8.652 0.00 . . . . . . . 334 LYS H . 28000 1 404 . 1 1 223 223 LYS N N 15 129.532 0.00 . . . . . . . 334 LYS N . 28000 1 405 . 1 1 224 224 ASP H H 1 8.633 0.00 . . . . . . . 335 ASP H . 28000 1 406 . 1 1 224 224 ASP N N 15 125.049 0.00 . . . . . . . 335 ASP N . 28000 1 407 . 1 1 226 226 GLU H H 1 8.392 0.00 . . . . . . . 337 GLU H . 28000 1 408 . 1 1 226 226 GLU N N 15 119.668 0.00 . . . . . . . 337 GLU N . 28000 1 409 . 1 1 227 227 ASN H H 1 8.071 0.00 . . . . . . . 338 ASN H . 28000 1 410 . 1 1 227 227 ASN N N 15 119.160 0.00 . . . . . . . 338 ASN N . 28000 1 411 . 1 1 229 229 PHE H H 1 8.290 0.00 . . . . . . . 340 PHE H . 28000 1 412 . 1 1 229 229 PHE N N 15 121.808 0.00 . . . . . . . 340 PHE N . 28000 1 413 . 1 1 230 230 THR H H 1 8.035 0.00 . . . . . . . 341 THR H . 28000 1 414 . 1 1 230 230 THR N N 15 116.425 0.00 . . . . . . . 341 THR N . 28000 1 415 . 1 1 231 231 SER H H 1 8.241 0.00 . . . . . . . 342 SER H . 28000 1 416 . 1 1 231 231 SER N N 15 118.605 0.00 . . . . . . . 342 SER N . 28000 1 417 . 1 1 232 232 GLU H H 1 8.461 0.00 . . . . . . . 343 GLU H . 28000 1 418 . 1 1 232 232 GLU N N 15 123.332 0.00 . . . . . . . 343 GLU N . 28000 1 419 . 1 1 233 233 GLU H H 1 8.324 0.00 . . . . . . . 344 GLU H . 28000 1 420 . 1 1 233 233 GLU N N 15 121.532 0.00 . . . . . . . 344 GLU N . 28000 1 421 . 1 1 234 234 ASN H H 1 8.279 0.00 . . . . . . . 345 ASN H . 28000 1 422 . 1 1 234 234 ASN N N 15 119.396 0.00 . . . . . . . 345 ASN N . 28000 1 423 . 1 1 235 235 LEU H H 1 7.965 0.00 . . . . . . . 346 LEU H . 28000 1 424 . 1 1 235 235 LEU N N 15 122.511 0.00 . . . . . . . 346 LEU N . 28000 1 425 . 1 1 236 236 LYS H H 1 8.014 0.00 . . . . . . . 347 LYS H . 28000 1 426 . 1 1 236 236 LYS N N 15 122.207 0.00 . . . . . . . 347 LYS N . 28000 1 427 . 1 1 237 237 LYS H H 1 8.121 0.00 . . . . . . . 348 LYS H . 28000 1 428 . 1 1 237 237 LYS N N 15 123.373 0.00 . . . . . . . 348 LYS N . 28000 1 429 . 1 1 238 238 LEU H H 1 8.157 0.00 . . . . . . . 349 LEU H . 28000 1 430 . 1 1 238 238 LEU N N 15 124.079 0.00 . . . . . . . 349 LEU N . 28000 1 431 . 1 1 239 239 GLU H H 1 8.206 0.00 . . . . . . . 350 GLU H . 28000 1 432 . 1 1 239 239 GLU N N 15 122.220 0.00 . . . . . . . 350 GLU N . 28000 1 433 . 1 1 240 240 GLU H H 1 7.850 0.00 . . . . . . . 351 GLU H . 28000 1 434 . 1 1 240 240 GLU N N 15 127.473 0.00 . . . . . . . 351 GLU N . 28000 1 stop_ save_