data_50785 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50785 _Entry.Title ; In Vitro Fibrillized 0N3R Tau ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-02-21 _Entry.Accession_date 2021-02-21 _Entry.Last_release_date 2021-02-22 _Entry.Original_release_date 2021-02-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solid-state _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 Aurelio Dregni . J. . . 50785 2 Harrison Wang . K. . . 50785 3 Mei Hong . . . . 50785 4 Pu Duan . . . . 50785 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50785 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 399 50785 '15N chemical shifts' 108 50785 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 2 . . 2021-06-03 2021-02-21 update BMRB 'update entry citation' 50785 1 . . 2021-05-18 2021-02-21 original author 'original release' 50785 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50785 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33983722 _Citation.DOI 10.1021/jacs.1c03314 _Citation.Full_citation . _Citation.Title ; Inclusion of the C-Terminal Domain in the beta-Sheet Core of Heparin-Fibrillized Three-Repeat Tau Protein Revealed by Solid-State Nuclear Magnetic Resonance Spectroscopy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 143 _Citation.Journal_issue 20 _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 7839 _Citation.Page_last 7851 _Citation.Year 2021 _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 Aurelio Dregni . J. . . 50785 1 2 Harrison Wang . K. . . 50785 1 3 Haifan Wu . . . . 50785 1 4 Pu Duan . . . . 50785 1 5 Jia Jin . . . . 50785 1 6 William DeGrado . F. . . 50785 1 7 Mei Hong . . . . 50785 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50785 _Assembly.ID 1 _Assembly.Name 'In Vitro Fibrillized 0N3R Tau' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 '0N3R Tau' 1 $entity_1 . . yes native no no . . . 50785 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50785 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; MAEPRQEFEVMEDHAGTYGL GDRKDQGGYTMHQDQEGDTD AGLKAEEAGIGDTPSLEDEA AGHVTQARMVSKSKDGTGSD DKKAKGADGKTKIATPRGAA PPGQKGQANATRIPAKTPPA PKTPPSSGEPPKSGDRSGYS SPGSPGTPGSRSRTPSLPTP PTREPKKVAVVRTPPKSPSS AKSRLQTAPVPMPDLKNVKS KIGSTENLKHQPGGGKVQIV YKPVDLSKVTSKCGSLGNIH HKPGGGQVEVKSEKLDFKDR VQSKIGSLDNITHVPGGGNK KIETHKLTFRENAKAKTDHG AEIVYKSPVVSGDTSPRHLS NVSSTGSIDMVDSPQLATLA DEVSASLAKQGL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 1, MET 2, ALA 3, GLU ...... 42, GLY 43, LEU 44, LYS 103, ALA 104, GLU 105, GLU ...... 272, GLY 273, GLY 274, LYS 306, VAL 307, GLN 308, ILE ...... 439, GLN 440, GLY 441, LEU ; _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 352 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 1 MET . 50785 1 2 2 ALA . 50785 1 3 3 GLU . 50785 1 4 4 PRO . 50785 1 5 5 ARG . 50785 1 6 6 GLN . 50785 1 7 7 GLU . 50785 1 8 8 PHE . 50785 1 9 9 GLU . 50785 1 10 10 VAL . 50785 1 11 11 MET . 50785 1 12 12 GLU . 50785 1 13 13 ASP . 50785 1 14 14 HIS . 50785 1 15 15 ALA . 50785 1 16 16 GLY . 50785 1 17 17 THR . 50785 1 18 18 TYR . 50785 1 19 19 GLY . 50785 1 20 20 LEU . 50785 1 21 21 GLY . 50785 1 22 22 ASP . 50785 1 23 23 ARG . 50785 1 24 24 LYS . 50785 1 25 25 ASP . 50785 1 26 26 GLN . 50785 1 27 27 GLY . 50785 1 28 28 GLY . 50785 1 29 29 TYR . 50785 1 30 30 THR . 50785 1 31 31 MET . 50785 1 32 32 HIS . 50785 1 33 33 GLN . 50785 1 34 34 ASP . 50785 1 35 35 GLN . 50785 1 36 36 GLU . 50785 1 37 37 GLY . 50785 1 38 38 ASP . 50785 1 39 39 THR . 50785 1 40 40 ASP . 50785 1 41 41 ALA . 50785 1 42 42 GLY . 50785 1 43 43 LEU . 50785 1 44 44 LYS . 50785 1 45 103 ALA . 50785 1 46 104 GLU . 50785 1 47 105 GLU . 50785 1 48 106 ALA . 50785 1 49 107 GLY . 50785 1 50 108 ILE . 50785 1 51 109 GLY . 50785 1 52 110 ASP . 50785 1 53 111 THR . 50785 1 54 112 PRO . 50785 1 55 113 SER . 50785 1 56 114 LEU . 50785 1 57 115 GLU . 50785 1 58 116 ASP . 50785 1 59 117 GLU . 50785 1 60 118 ALA . 50785 1 61 119 ALA . 50785 1 62 120 GLY . 50785 1 63 121 HIS . 50785 1 64 122 VAL . 50785 1 65 123 THR . 50785 1 66 124 GLN . 50785 1 67 125 ALA . 50785 1 68 126 ARG . 50785 1 69 127 MET . 50785 1 70 128 VAL . 50785 1 71 129 SER . 50785 1 72 130 LYS . 50785 1 73 131 SER . 50785 1 74 132 LYS . 50785 1 75 133 ASP . 50785 1 76 134 GLY . 50785 1 77 135 THR . 50785 1 78 136 GLY . 50785 1 79 137 SER . 50785 1 80 138 ASP . 50785 1 81 139 ASP . 50785 1 82 140 LYS . 50785 1 83 141 LYS . 50785 1 84 142 ALA . 50785 1 85 143 LYS . 50785 1 86 144 GLY . 50785 1 87 145 ALA . 50785 1 88 146 ASP . 50785 1 89 147 GLY . 50785 1 90 148 LYS . 50785 1 91 149 THR . 50785 1 92 150 LYS . 50785 1 93 151 ILE . 50785 1 94 152 ALA . 50785 1 95 153 THR . 50785 1 96 154 PRO . 50785 1 97 155 ARG . 50785 1 98 156 GLY . 50785 1 99 157 ALA . 50785 1 100 158 ALA . 50785 1 101 159 PRO . 50785 1 102 160 PRO . 50785 1 103 161 GLY . 50785 1 104 162 GLN . 50785 1 105 163 LYS . 50785 1 106 164 GLY . 50785 1 107 165 GLN . 50785 1 108 166 ALA . 50785 1 109 167 ASN . 50785 1 110 168 ALA . 50785 1 111 169 THR . 50785 1 112 170 ARG . 50785 1 113 171 ILE . 50785 1 114 172 PRO . 50785 1 115 173 ALA . 50785 1 116 174 LYS . 50785 1 117 175 THR . 50785 1 118 176 PRO . 50785 1 119 177 PRO . 50785 1 120 178 ALA . 50785 1 121 179 PRO . 50785 1 122 180 LYS . 50785 1 123 181 THR . 50785 1 124 182 PRO . 50785 1 125 183 PRO . 50785 1 126 184 SER . 50785 1 127 185 SER . 50785 1 128 186 GLY . 50785 1 129 187 GLU . 50785 1 130 188 PRO . 50785 1 131 189 PRO . 50785 1 132 190 LYS . 50785 1 133 191 SER . 50785 1 134 192 GLY . 50785 1 135 193 ASP . 50785 1 136 194 ARG . 50785 1 137 195 SER . 50785 1 138 196 GLY . 50785 1 139 197 TYR . 50785 1 140 198 SER . 50785 1 141 199 SER . 50785 1 142 200 PRO . 50785 1 143 201 GLY . 50785 1 144 202 SER . 50785 1 145 203 PRO . 50785 1 146 204 GLY . 50785 1 147 205 THR . 50785 1 148 206 PRO . 50785 1 149 207 GLY . 50785 1 150 208 SER . 50785 1 151 209 ARG . 50785 1 152 210 SER . 50785 1 153 211 ARG . 50785 1 154 212 THR . 50785 1 155 213 PRO . 50785 1 156 214 SER . 50785 1 157 215 LEU . 50785 1 158 216 PRO . 50785 1 159 217 THR . 50785 1 160 218 PRO . 50785 1 161 219 PRO . 50785 1 162 220 THR . 50785 1 163 221 ARG . 50785 1 164 222 GLU . 50785 1 165 223 PRO . 50785 1 166 224 LYS . 50785 1 167 225 LYS . 50785 1 168 226 VAL . 50785 1 169 227 ALA . 50785 1 170 228 VAL . 50785 1 171 229 VAL . 50785 1 172 230 ARG . 50785 1 173 231 THR . 50785 1 174 232 PRO . 50785 1 175 233 PRO . 50785 1 176 234 LYS . 50785 1 177 235 SER . 50785 1 178 236 PRO . 50785 1 179 237 SER . 50785 1 180 238 SER . 50785 1 181 239 ALA . 50785 1 182 240 LYS . 50785 1 183 241 SER . 50785 1 184 242 ARG . 50785 1 185 243 LEU . 50785 1 186 244 GLN . 50785 1 187 245 THR . 50785 1 188 246 ALA . 50785 1 189 247 PRO . 50785 1 190 248 VAL . 50785 1 191 249 PRO . 50785 1 192 250 MET . 50785 1 193 251 PRO . 50785 1 194 252 ASP . 50785 1 195 253 LEU . 50785 1 196 254 LYS . 50785 1 197 255 ASN . 50785 1 198 256 VAL . 50785 1 199 257 LYS . 50785 1 200 258 SER . 50785 1 201 259 LYS . 50785 1 202 260 ILE . 50785 1 203 261 GLY . 50785 1 204 262 SER . 50785 1 205 263 THR . 50785 1 206 264 GLU . 50785 1 207 265 ASN . 50785 1 208 266 LEU . 50785 1 209 267 LYS . 50785 1 210 268 HIS . 50785 1 211 269 GLN . 50785 1 212 270 PRO . 50785 1 213 271 GLY . 50785 1 214 272 GLY . 50785 1 215 273 GLY . 50785 1 216 274 LYS . 50785 1 217 306 VAL . 50785 1 218 307 GLN . 50785 1 219 308 ILE . 50785 1 220 309 VAL . 50785 1 221 310 TYR . 50785 1 222 311 LYS . 50785 1 223 312 PRO . 50785 1 224 313 VAL . 50785 1 225 314 ASP . 50785 1 226 315 LEU . 50785 1 227 316 SER . 50785 1 228 317 LYS . 50785 1 229 318 VAL . 50785 1 230 319 THR . 50785 1 231 320 SER . 50785 1 232 321 LYS . 50785 1 233 322 CYS . 50785 1 234 323 GLY . 50785 1 235 324 SER . 50785 1 236 325 LEU . 50785 1 237 326 GLY . 50785 1 238 327 ASN . 50785 1 239 328 ILE . 50785 1 240 329 HIS . 50785 1 241 330 HIS . 50785 1 242 331 LYS . 50785 1 243 332 PRO . 50785 1 244 333 GLY . 50785 1 245 334 GLY . 50785 1 246 335 GLY . 50785 1 247 336 GLN . 50785 1 248 337 VAL . 50785 1 249 338 GLU . 50785 1 250 339 VAL . 50785 1 251 340 LYS . 50785 1 252 341 SER . 50785 1 253 342 GLU . 50785 1 254 343 LYS . 50785 1 255 344 LEU . 50785 1 256 345 ASP . 50785 1 257 346 PHE . 50785 1 258 347 LYS . 50785 1 259 348 ASP . 50785 1 260 349 ARG . 50785 1 261 350 VAL . 50785 1 262 351 GLN . 50785 1 263 352 SER . 50785 1 264 353 LYS . 50785 1 265 354 ILE . 50785 1 266 355 GLY . 50785 1 267 356 SER . 50785 1 268 357 LEU . 50785 1 269 358 ASP . 50785 1 270 359 ASN . 50785 1 271 360 ILE . 50785 1 272 361 THR . 50785 1 273 362 HIS . 50785 1 274 363 VAL . 50785 1 275 364 PRO . 50785 1 276 365 GLY . 50785 1 277 366 GLY . 50785 1 278 367 GLY . 50785 1 279 368 ASN . 50785 1 280 369 LYS . 50785 1 281 370 LYS . 50785 1 282 371 ILE . 50785 1 283 372 GLU . 50785 1 284 373 THR . 50785 1 285 374 HIS . 50785 1 286 375 LYS . 50785 1 287 376 LEU . 50785 1 288 377 THR . 50785 1 289 378 PHE . 50785 1 290 379 ARG . 50785 1 291 380 GLU . 50785 1 292 381 ASN . 50785 1 293 382 ALA . 50785 1 294 383 LYS . 50785 1 295 384 ALA . 50785 1 296 385 LYS . 50785 1 297 386 THR . 50785 1 298 387 ASP . 50785 1 299 388 HIS . 50785 1 300 389 GLY . 50785 1 301 390 ALA . 50785 1 302 391 GLU . 50785 1 303 392 ILE . 50785 1 304 393 VAL . 50785 1 305 394 TYR . 50785 1 306 395 LYS . 50785 1 307 396 SER . 50785 1 308 397 PRO . 50785 1 309 398 VAL . 50785 1 310 399 VAL . 50785 1 311 400 SER . 50785 1 312 401 GLY . 50785 1 313 402 ASP . 50785 1 314 403 THR . 50785 1 315 404 SER . 50785 1 316 405 PRO . 50785 1 317 406 ARG . 50785 1 318 407 HIS . 50785 1 319 408 LEU . 50785 1 320 409 SER . 50785 1 321 410 ASN . 50785 1 322 411 VAL . 50785 1 323 412 SER . 50785 1 324 413 SER . 50785 1 325 414 THR . 50785 1 326 415 GLY . 50785 1 327 416 SER . 50785 1 328 417 ILE . 50785 1 329 418 ASP . 50785 1 330 419 MET . 50785 1 331 420 VAL . 50785 1 332 421 ASP . 50785 1 333 422 SER . 50785 1 334 423 PRO . 50785 1 335 424 GLN . 50785 1 336 425 LEU . 50785 1 337 426 ALA . 50785 1 338 427 THR . 50785 1 339 428 LEU . 50785 1 340 429 ALA . 50785 1 341 430 ASP . 50785 1 342 431 GLU . 50785 1 343 432 VAL . 50785 1 344 433 SER . 50785 1 345 434 ALA . 50785 1 346 435 SER . 50785 1 347 436 LEU . 50785 1 348 437 ALA . 50785 1 349 438 LYS . 50785 1 350 439 GLN . 50785 1 351 440 GLY . 50785 1 352 441 LEU . 50785 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 . MET 1 1 50785 1 . ALA 2 2 50785 1 . GLU 3 3 50785 1 . PRO 4 4 50785 1 . ARG 5 5 50785 1 . GLN 6 6 50785 1 . GLU 7 7 50785 1 . PHE 8 8 50785 1 . GLU 9 9 50785 1 . VAL 10 10 50785 1 . MET 11 11 50785 1 . GLU 12 12 50785 1 . ASP 13 13 50785 1 . HIS 14 14 50785 1 . ALA 15 15 50785 1 . GLY 16 16 50785 1 . THR 17 17 50785 1 . TYR 18 18 50785 1 . GLY 19 19 50785 1 . LEU 20 20 50785 1 . GLY 21 21 50785 1 . ASP 22 22 50785 1 . ARG 23 23 50785 1 . LYS 24 24 50785 1 . ASP 25 25 50785 1 . GLN 26 26 50785 1 . GLY 27 27 50785 1 . GLY 28 28 50785 1 . TYR 29 29 50785 1 . THR 30 30 50785 1 . MET 31 31 50785 1 . HIS 32 32 50785 1 . GLN 33 33 50785 1 . ASP 34 34 50785 1 . GLN 35 35 50785 1 . GLU 36 36 50785 1 . GLY 37 37 50785 1 . ASP 38 38 50785 1 . THR 39 39 50785 1 . ASP 40 40 50785 1 . ALA 41 41 50785 1 . GLY 42 42 50785 1 . LEU 43 43 50785 1 . LYS 44 44 50785 1 . ALA 45 45 50785 1 . GLU 46 46 50785 1 . GLU 47 47 50785 1 . ALA 48 48 50785 1 . GLY 49 49 50785 1 . ILE 50 50 50785 1 . GLY 51 51 50785 1 . ASP 52 52 50785 1 . THR 53 53 50785 1 . PRO 54 54 50785 1 . SER 55 55 50785 1 . LEU 56 56 50785 1 . GLU 57 57 50785 1 . ASP 58 58 50785 1 . GLU 59 59 50785 1 . ALA 60 60 50785 1 . ALA 61 61 50785 1 . GLY 62 62 50785 1 . HIS 63 63 50785 1 . VAL 64 64 50785 1 . THR 65 65 50785 1 . GLN 66 66 50785 1 . ALA 67 67 50785 1 . ARG 68 68 50785 1 . MET 69 69 50785 1 . VAL 70 70 50785 1 . SER 71 71 50785 1 . LYS 72 72 50785 1 . SER 73 73 50785 1 . LYS 74 74 50785 1 . ASP 75 75 50785 1 . GLY 76 76 50785 1 . THR 77 77 50785 1 . GLY 78 78 50785 1 . SER 79 79 50785 1 . ASP 80 80 50785 1 . ASP 81 81 50785 1 . LYS 82 82 50785 1 . LYS 83 83 50785 1 . ALA 84 84 50785 1 . LYS 85 85 50785 1 . GLY 86 86 50785 1 . ALA 87 87 50785 1 . ASP 88 88 50785 1 . GLY 89 89 50785 1 . LYS 90 90 50785 1 . THR 91 91 50785 1 . LYS 92 92 50785 1 . ILE 93 93 50785 1 . ALA 94 94 50785 1 . THR 95 95 50785 1 . PRO 96 96 50785 1 . ARG 97 97 50785 1 . GLY 98 98 50785 1 . ALA 99 99 50785 1 . ALA 100 100 50785 1 . PRO 101 101 50785 1 . PRO 102 102 50785 1 . GLY 103 103 50785 1 . GLN 104 104 50785 1 . LYS 105 105 50785 1 . GLY 106 106 50785 1 . GLN 107 107 50785 1 . ALA 108 108 50785 1 . ASN 109 109 50785 1 . ALA 110 110 50785 1 . THR 111 111 50785 1 . ARG 112 112 50785 1 . ILE 113 113 50785 1 . PRO 114 114 50785 1 . ALA 115 115 50785 1 . LYS 116 116 50785 1 . THR 117 117 50785 1 . PRO 118 118 50785 1 . PRO 119 119 50785 1 . ALA 120 120 50785 1 . PRO 121 121 50785 1 . LYS 122 122 50785 1 . THR 123 123 50785 1 . PRO 124 124 50785 1 . PRO 125 125 50785 1 . SER 126 126 50785 1 . SER 127 127 50785 1 . GLY 128 128 50785 1 . GLU 129 129 50785 1 . PRO 130 130 50785 1 . PRO 131 131 50785 1 . LYS 132 132 50785 1 . SER 133 133 50785 1 . GLY 134 134 50785 1 . ASP 135 135 50785 1 . ARG 136 136 50785 1 . SER 137 137 50785 1 . GLY 138 138 50785 1 . TYR 139 139 50785 1 . SER 140 140 50785 1 . SER 141 141 50785 1 . PRO 142 142 50785 1 . GLY 143 143 50785 1 . SER 144 144 50785 1 . PRO 145 145 50785 1 . GLY 146 146 50785 1 . THR 147 147 50785 1 . PRO 148 148 50785 1 . GLY 149 149 50785 1 . SER 150 150 50785 1 . ARG 151 151 50785 1 . SER 152 152 50785 1 . ARG 153 153 50785 1 . THR 154 154 50785 1 . PRO 155 155 50785 1 . SER 156 156 50785 1 . LEU 157 157 50785 1 . PRO 158 158 50785 1 . THR 159 159 50785 1 . PRO 160 160 50785 1 . PRO 161 161 50785 1 . THR 162 162 50785 1 . ARG 163 163 50785 1 . GLU 164 164 50785 1 . PRO 165 165 50785 1 . LYS 166 166 50785 1 . LYS 167 167 50785 1 . VAL 168 168 50785 1 . ALA 169 169 50785 1 . VAL 170 170 50785 1 . VAL 171 171 50785 1 . ARG 172 172 50785 1 . THR 173 173 50785 1 . PRO 174 174 50785 1 . PRO 175 175 50785 1 . LYS 176 176 50785 1 . SER 177 177 50785 1 . PRO 178 178 50785 1 . SER 179 179 50785 1 . SER 180 180 50785 1 . ALA 181 181 50785 1 . LYS 182 182 50785 1 . SER 183 183 50785 1 . ARG 184 184 50785 1 . LEU 185 185 50785 1 . GLN 186 186 50785 1 . THR 187 187 50785 1 . ALA 188 188 50785 1 . PRO 189 189 50785 1 . VAL 190 190 50785 1 . PRO 191 191 50785 1 . MET 192 192 50785 1 . PRO 193 193 50785 1 . ASP 194 194 50785 1 . LEU 195 195 50785 1 . LYS 196 196 50785 1 . ASN 197 197 50785 1 . VAL 198 198 50785 1 . LYS 199 199 50785 1 . SER 200 200 50785 1 . LYS 201 201 50785 1 . ILE 202 202 50785 1 . GLY 203 203 50785 1 . SER 204 204 50785 1 . THR 205 205 50785 1 . GLU 206 206 50785 1 . ASN 207 207 50785 1 . LEU 208 208 50785 1 . LYS 209 209 50785 1 . HIS 210 210 50785 1 . GLN 211 211 50785 1 . PRO 212 212 50785 1 . GLY 213 213 50785 1 . GLY 214 214 50785 1 . GLY 215 215 50785 1 . LYS 216 216 50785 1 . VAL 217 217 50785 1 . GLN 218 218 50785 1 . ILE 219 219 50785 1 . VAL 220 220 50785 1 . TYR 221 221 50785 1 . LYS 222 222 50785 1 . PRO 223 223 50785 1 . VAL 224 224 50785 1 . ASP 225 225 50785 1 . LEU 226 226 50785 1 . SER 227 227 50785 1 . LYS 228 228 50785 1 . VAL 229 229 50785 1 . THR 230 230 50785 1 . SER 231 231 50785 1 . LYS 232 232 50785 1 . CYS 233 233 50785 1 . GLY 234 234 50785 1 . SER 235 235 50785 1 . LEU 236 236 50785 1 . GLY 237 237 50785 1 . ASN 238 238 50785 1 . ILE 239 239 50785 1 . HIS 240 240 50785 1 . HIS 241 241 50785 1 . LYS 242 242 50785 1 . PRO 243 243 50785 1 . GLY 244 244 50785 1 . GLY 245 245 50785 1 . GLY 246 246 50785 1 . GLN 247 247 50785 1 . VAL 248 248 50785 1 . GLU 249 249 50785 1 . VAL 250 250 50785 1 . LYS 251 251 50785 1 . SER 252 252 50785 1 . GLU 253 253 50785 1 . LYS 254 254 50785 1 . LEU 255 255 50785 1 . ASP 256 256 50785 1 . PHE 257 257 50785 1 . LYS 258 258 50785 1 . ASP 259 259 50785 1 . ARG 260 260 50785 1 . VAL 261 261 50785 1 . GLN 262 262 50785 1 . SER 263 263 50785 1 . LYS 264 264 50785 1 . ILE 265 265 50785 1 . GLY 266 266 50785 1 . SER 267 267 50785 1 . LEU 268 268 50785 1 . ASP 269 269 50785 1 . ASN 270 270 50785 1 . ILE 271 271 50785 1 . THR 272 272 50785 1 . HIS 273 273 50785 1 . VAL 274 274 50785 1 . PRO 275 275 50785 1 . GLY 276 276 50785 1 . GLY 277 277 50785 1 . GLY 278 278 50785 1 . ASN 279 279 50785 1 . LYS 280 280 50785 1 . LYS 281 281 50785 1 . ILE 282 282 50785 1 . GLU 283 283 50785 1 . THR 284 284 50785 1 . HIS 285 285 50785 1 . LYS 286 286 50785 1 . LEU 287 287 50785 1 . THR 288 288 50785 1 . PHE 289 289 50785 1 . ARG 290 290 50785 1 . GLU 291 291 50785 1 . ASN 292 292 50785 1 . ALA 293 293 50785 1 . LYS 294 294 50785 1 . ALA 295 295 50785 1 . LYS 296 296 50785 1 . THR 297 297 50785 1 . ASP 298 298 50785 1 . HIS 299 299 50785 1 . GLY 300 300 50785 1 . ALA 301 301 50785 1 . GLU 302 302 50785 1 . ILE 303 303 50785 1 . VAL 304 304 50785 1 . TYR 305 305 50785 1 . LYS 306 306 50785 1 . SER 307 307 50785 1 . PRO 308 308 50785 1 . VAL 309 309 50785 1 . VAL 310 310 50785 1 . SER 311 311 50785 1 . GLY 312 312 50785 1 . ASP 313 313 50785 1 . THR 314 314 50785 1 . SER 315 315 50785 1 . PRO 316 316 50785 1 . ARG 317 317 50785 1 . HIS 318 318 50785 1 . LEU 319 319 50785 1 . SER 320 320 50785 1 . ASN 321 321 50785 1 . VAL 322 322 50785 1 . SER 323 323 50785 1 . SER 324 324 50785 1 . THR 325 325 50785 1 . GLY 326 326 50785 1 . SER 327 327 50785 1 . ILE 328 328 50785 1 . ASP 329 329 50785 1 . MET 330 330 50785 1 . VAL 331 331 50785 1 . ASP 332 332 50785 1 . SER 333 333 50785 1 . PRO 334 334 50785 1 . GLN 335 335 50785 1 . LEU 336 336 50785 1 . ALA 337 337 50785 1 . THR 338 338 50785 1 . LEU 339 339 50785 1 . ALA 340 340 50785 1 . ASP 341 341 50785 1 . GLU 342 342 50785 1 . VAL 343 343 50785 1 . SER 344 344 50785 1 . ALA 345 345 50785 1 . SER 346 346 50785 1 . LEU 347 347 50785 1 . ALA 348 348 50785 1 . LYS 349 349 50785 1 . GLN 350 350 50785 1 . GLY 351 351 50785 1 . LEU 352 352 50785 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50785 _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 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 50785 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50785 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . BL21(DE3) . . . 50785 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50785 _Sample.ID 1 _Sample.Name 1 _Sample.Type fiber _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system 'aqueous buffer' _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 'in vitro fibrillized 0N3R tau' '[U-13C; U-15N]' . . 1 $entity_1 . . 18 . . mg . . . . 50785 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 50785 _Sample_condition_list.ID 1 _Sample_condition_list.Name 1 _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' 10 . mM 50785 1 pH 7.4 0.2 pH 50785 1 pressure 1 . atm 50785 1 temperature 290 . K 50785 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50785 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50785 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50785 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 50785 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50785 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE II' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50785 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 13C-detected CORD' no . . . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 2 '2D 13C-detected NCA' no . . . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 3 '3D NCACX' no . . . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 4 '3D NCOCX' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 5 '3D CONCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 6 '3D CAN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 7 '3D 13C-detected CORD' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50785 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50785 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 1 _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 'liquid anhydrous ammonia' nitrogen . . . . ppm 0 external direct 1 . . . . . 50785 1 N 15 DSS 'methyl carbons' . . . . ppm 0 external direct 1 . . . . . 50785 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50785 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 1 _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 $chem_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 13C-detected CORD' . . . 50785 1 2 '2D 13C-detected NCA' . . . 50785 1 3 '3D NCACX' . . . 50785 1 4 '3D NCOCX' . . . 50785 1 5 '3D CONCA' . . . 50785 1 6 '3D CAN(CO)CA' . . . 50785 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50785 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 . 1 204 204 SER C C 13 174.3 0.2 . 1 . . . . . 262 SER CO . 50785 1 2 . 1 . 1 204 204 SER CA C 13 57.2 0.1 . 1 . . . . . 262 SER CA . 50785 1 3 . 1 . 1 204 204 SER CB C 13 66.9 0.1 . 1 . . . . . 262 SER CB . 50785 1 4 . 1 . 1 204 204 SER N N 15 111.0 0.3 . 1 . . . . . 262 SER N . 50785 1 5 . 1 . 1 205 205 THR C C 13 173.2 0.3 . 1 . . . . . 263 THR CO . 50785 1 6 . 1 . 1 205 205 THR CA C 13 60.7 0.1 . 1 . . . . . 263 THR CA . 50785 1 7 . 1 . 1 205 205 THR CB C 13 70.0 0.1 . 1 . . . . . 263 THR CB . 50785 1 8 . 1 . 1 205 205 THR CG2 C 13 21.6 0.1 . 1 . . . . . 263 THR CG . 50785 1 9 . 1 . 1 205 205 THR N N 15 121.7 0.4 . 1 . . . . . 263 THR N . 50785 1 10 . 1 . 1 206 206 GLU C C 13 174.1 0.1 . 1 . . . . . 264 GLU CO . 50785 1 11 . 1 . 1 206 206 GLU CA C 13 55.0 0.1 . 1 . . . . . 264 GLU CA . 50785 1 12 . 1 . 1 206 206 GLU CB C 13 33.7 0.1 . 1 . . . . . 264 GLU CB . 50785 1 13 . 1 . 1 206 206 GLU CG C 13 34.3 0.1 . 1 . . . . . 264 GLU CG . 50785 1 14 . 1 . 1 206 206 GLU CD C 13 179.7 0.2 . 1 . . . . . 264 GLU CD . 50785 1 15 . 1 . 1 206 206 GLU N N 15 120.2 0.4 . 1 . . . . . 264 GLU N . 50785 1 16 . 1 . 1 207 207 ASN C C 13 174.8 0.2 . 1 . . . . . 265 ASN CO . 50785 1 17 . 1 . 1 207 207 ASN CA C 13 52.3 0.2 . 1 . . . . . 265 ASN CA . 50785 1 18 . 1 . 1 207 207 ASN CB C 13 42.9 0.0 . 1 . . . . . 265 ASN CB . 50785 1 19 . 1 . 1 207 207 ASN CG C 13 172.9 0.2 . 1 . . . . . 265 ASN CG . 50785 1 20 . 1 . 1 207 207 ASN N N 15 124.2 0.3 . 1 . . . . . 265 ASN N . 50785 1 21 . 1 . 1 208 208 LEU CA C 13 54.1 0.1 . 9 . . . . . 266 LEU CA . 50785 1 22 . 1 . 1 208 208 LEU CB C 13 40.3 0.1 . 9 . . . . . 266 LEU CB . 50785 1 23 . 1 . 1 208 208 LEU CG C 13 28.1 0.0 . 9 . . . . . 266 LEU CG . 50785 1 24 . 1 . 1 208 208 LEU N N 15 116.7 0.3 . 9 . . . . . 266 LEU N . 50785 1 25 . 1 . 1 217 217 VAL C C 13 174.5 0.1 . 1 . . . . . 306 VAL CO . 50785 1 26 . 1 . 1 217 217 VAL CA C 13 61.1 0.1 . 1 . . . . . 306 VAL CA . 50785 1 27 . 1 . 1 217 217 VAL CB C 13 35.4 0.1 . 1 . . . . . 306 VAL CB . 50785 1 28 . 1 . 1 217 217 VAL CG1 C 13 21.3 0.1 . 1 . . . . . 306 VAL CG# . 50785 1 29 . 1 . 1 217 217 VAL CG2 C 13 21.3 0.1 . 1 . . . . . 306 VAL CG# . 50785 1 30 . 1 . 1 217 217 VAL N N 15 125.7 0.2 . 1 . . . . . 306 VAL N . 50785 1 31 . 1 . 1 218 218 GLN C C 13 174.3 0.2 . 1 . . . . . 307 GLN CO . 50785 1 32 . 1 . 1 218 218 GLN CA C 13 54.6 0.2 . 1 . . . . . 307 GLN CA . 50785 1 33 . 1 . 1 218 218 GLN CB C 13 35.4 0.1 . 1 . . . . . 307 GLN CB . 50785 1 34 . 1 . 1 218 218 GLN CG C 13 34.0 0.2 . 1 . . . . . 307 GLN CG . 50785 1 35 . 1 . 1 218 218 GLN CD C 13 179.6 0.2 . 1 . . . . . 307 GLN CD . 50785 1 36 . 1 . 1 218 218 GLN N N 15 129.4 0.5 . 1 . . . . . 307 GLN N . 50785 1 37 . 1 . 1 218 218 GLN NE2 N 15 111.9 0.0 . 1 . . . . . 307 GLN NE2 . 50785 1 38 . 1 . 1 219 219 ILE C C 13 173.9 0.1 . 1 . . . . . 308 ILE CO . 50785 1 39 . 1 . 1 219 219 ILE CA C 13 60.1 0.2 . 1 . . . . . 308 ILE CA . 50785 1 40 . 1 . 1 219 219 ILE CB C 13 41.0 0.1 . 1 . . . . . 308 ILE CB . 50785 1 41 . 1 . 1 219 219 ILE CG1 C 13 27.8 0.2 . 1 . . . . . 308 ILE CG1 . 50785 1 42 . 1 . 1 219 219 ILE CG2 C 13 17.4 0.2 . 1 . . . . . 308 ILE CG2 . 50785 1 43 . 1 . 1 219 219 ILE CD1 C 13 13.8 0.1 . 1 . . . . . 308 ILE CD1 . 50785 1 44 . 1 . 1 219 219 ILE N N 15 126.3 0.5 . 1 . . . . . 308 ILE N . 50785 1 45 . 1 . 1 220 220 VAL C C 13 172.9 0.2 . 1 . . . . . 309 VAL CO . 50785 1 46 . 1 . 1 220 220 VAL CA C 13 61.7 0.2 . 1 . . . . . 309 VAL CA . 50785 1 47 . 1 . 1 220 220 VAL CB C 13 34.0 0.2 . 1 . . . . . 309 VAL CB . 50785 1 48 . 1 . 1 220 220 VAL CG1 C 13 21.2 0.1 . 1 . . . . . 309 VAL CG# . 50785 1 49 . 1 . 1 220 220 VAL CG2 C 13 21.2 0.1 . 1 . . . . . 309 VAL CG# . 50785 1 50 . 1 . 1 220 220 VAL N N 15 128.4 0.5 . 1 . . . . . 309 VAL N . 50785 1 51 . 1 . 1 221 221 TYR C C 13 173.1 0.0 . 1 . . . . . 310 TYR CO . 50785 1 52 . 1 . 1 221 221 TYR CA C 13 57.1 0.2 . 1 . . . . . 310 TYR CA . 50785 1 53 . 1 . 1 221 221 TYR CG C 13 132.6 0.1 . 1 . . . . . 310 TYR CG . 50785 1 54 . 1 . 1 221 221 TYR N N 15 132.2 0.6 . 1 . . . . . 310 TYR N . 50785 1 55 . 1 . 1 224 224 VAL C C 13 174.2 0.2 . 1 . . . . . 313 VAL CO . 50785 1 56 . 1 . 1 224 224 VAL CA C 13 61.4 0.2 . 1 . . . . . 313 VAL CA . 50785 1 57 . 1 . 1 224 224 VAL CB C 13 33.8 0.0 . 1 . . . . . 313 VAL CB . 50785 1 58 . 1 . 1 224 224 VAL CG1 C 13 21.1 0.1 . 1 . . . . . 313 VAL CG# . 50785 1 59 . 1 . 1 224 224 VAL CG2 C 13 21.1 0.1 . 1 . . . . . 313 VAL CG# . 50785 1 60 . 1 . 1 224 224 VAL N N 15 118.5 0.2 . 1 . . . . . 313 VAL N . 50785 1 61 . 1 . 1 225 225 ASP C C 13 173.7 0.1 . 1 . . . . . 314 ASP CO . 50785 1 62 . 1 . 1 225 225 ASP CA C 13 52.7 0.1 . 1 . . . . . 314 ASP CA . 50785 1 63 . 1 . 1 225 225 ASP CB C 13 41.9 0.2 . 1 . . . . . 314 ASP CB . 50785 1 64 . 1 . 1 225 225 ASP CG C 13 179.7 0.1 . 1 . . . . . 314 ASP CG . 50785 1 65 . 1 . 1 225 225 ASP N N 15 128.7 0.3 . 1 . . . . . 314 ASP N . 50785 1 66 . 1 . 1 226 226 LEU C C 13 176.8 0.1 . 1 . . . . . 315 LEU CO . 50785 1 67 . 1 . 1 226 226 LEU CA C 13 54.2 0.2 . 1 . . . . . 315 LEU CA . 50785 1 68 . 1 . 1 226 226 LEU CB C 13 43.6 0.3 . 1 . . . . . 315 LEU CB . 50785 1 69 . 1 . 1 226 226 LEU CG C 13 28.3 0.1 . 1 . . . . . 315 LEU CG . 50785 1 70 . 1 . 1 226 226 LEU N N 15 130.0 0.3 . 1 . . . . . 315 LEU N . 50785 1 71 . 1 . 1 226 226 LEU CD1 C 13 26.7 0.1 . 1 . . . . . 315 LEU CD1 . 50785 1 72 . 1 . 1 227 227 SER C C 13 174.3 0.1 . 1 . . . . . 316 SER CO . 50785 1 73 . 1 . 1 227 227 SER CA C 13 59.8 0.2 . 1 . . . . . 316 SER CA . 50785 1 74 . 1 . 1 227 227 SER CB C 13 65.0 0.1 . 1 . . . . . 316 SER CB . 50785 1 75 . 1 . 1 227 227 SER N N 15 120.4 0.4 . 1 . . . . . 316 SER N . 50785 1 76 . 1 . 1 228 228 LYS CA C 13 55.1 0.0 . 9 . . . . . 317 LYS CA . 50785 1 77 . 1 . 1 229 229 VAL C C 13 175.0 0.2 . 1 . . . . . 318 VAL CO . 50785 1 78 . 1 . 1 229 229 VAL CA C 13 61.0 0.1 . 1 . . . . . 318 VAL CA . 50785 1 79 . 1 . 1 229 229 VAL CB C 13 36.1 0.0 . 1 . . . . . 318 VAL CB . 50785 1 80 . 1 . 1 229 229 VAL CG1 C 13 21.9 0.1 . 1 . . . . . 318 VAL CG# . 50785 1 81 . 1 . 1 229 229 VAL CG2 C 13 21.9 0.1 . 1 . . . . . 318 VAL CG# . 50785 1 82 . 1 . 1 229 229 VAL N N 15 119.2 0.0 . 1 . . . . . 318 VAL N . 50785 1 83 . 1 . 1 230 230 THR C C 13 174.3 0.1 . 1 . . . . . 319 THR CO . 50785 1 84 . 1 . 1 230 230 THR CA C 13 61.4 0.2 . 1 . . . . . 319 THR CA . 50785 1 85 . 1 . 1 230 230 THR CB C 13 70.6 0.2 . 1 . . . . . 319 THR CB . 50785 1 86 . 1 . 1 230 230 THR CG2 C 13 22.1 0.0 . 1 . . . . . 319 THR CG . 50785 1 87 . 1 . 1 230 230 THR N N 15 127.1 0.2 . 1 . . . . . 319 THR N . 50785 1 88 . 1 . 1 231 231 SER CA C 13 56.3 0.2 . 1 . . . . . 320 SER CA . 50785 1 89 . 1 . 1 231 231 SER CB C 13 65.8 0.1 . 1 . . . . . 320 SER CB . 50785 1 90 . 1 . 1 231 231 SER N N 15 122.4 0.4 . 1 . . . . . 320 SER N . 50785 1 91 . 1 . 1 232 232 LYS C C 13 174.5 0.0 . 9 . . . . . 321 LYS CO . 50785 1 92 . 1 . 1 233 233 CYS C C 13 175.2 0.2 . 1 . . . . . 322 CYS CO . 50785 1 93 . 1 . 1 233 233 CYS CA C 13 56.9 0.2 . 1 . . . . . 322 CYS CA . 50785 1 94 . 1 . 1 233 233 CYS CB C 13 31.9 0.1 . 1 . . . . . 322 CYS CB . 50785 1 95 . 1 . 1 233 233 CYS N N 15 113.8 0.2 . 1 . . . . . 322 CYS N . 50785 1 96 . 1 . 1 234 234 GLY C C 13 173.6 0.2 . 1 . . . . . 323 GLY CO . 50785 1 97 . 1 . 1 234 234 GLY CA C 13 49.2 0.2 . 1 . . . . . 323 GLY CA . 50785 1 98 . 1 . 1 234 234 GLY N N 15 112.5 0.3 . 1 . . . . . 323 GLY N . 50785 1 99 . 1 . 1 235 235 SER C C 13 173.1 0.1 . 1 . . . . . 324 SER CO . 50785 1 100 . 1 . 1 235 235 SER CA C 13 55.7 0.4 . 1 . . . . . 324 SER CA . 50785 1 101 . 1 . 1 235 235 SER CB C 13 64.9 0.3 . 1 . . . . . 324 SER CB . 50785 1 102 . 1 . 1 235 235 SER N N 15 117.2 0.2 . 1 . . . . . 324 SER N . 50785 1 103 . 1 . 1 236 236 LEU C C 13 175.9 0.1 . 1 . . . . . 325 LEU CO . 50785 1 104 . 1 . 1 236 236 LEU CA C 13 54.9 0.1 . 1 . . . . . 325 LEU CA . 50785 1 105 . 1 . 1 236 236 LEU CB C 13 44.9 0.1 . 1 . . . . . 325 LEU CB . 50785 1 106 . 1 . 1 236 236 LEU CG C 13 28.1 0.1 . 1 . . . . . 325 LEU CG . 50785 1 107 . 1 . 1 236 236 LEU N N 15 126.6 0.3 . 1 . . . . . 325 LEU N . 50785 1 108 . 1 . 1 237 237 GLY C C 13 172.1 0.2 . 1 . . . . . 326 GLY CO . 50785 1 109 . 1 . 1 237 237 GLY CA C 13 47.9 0.2 . 1 . . . . . 326 GLY CA . 50785 1 110 . 1 . 1 237 237 GLY N N 15 110.0 0.2 . 1 . . . . . 326 GLY N . 50785 1 111 . 1 . 1 238 238 ASN C C 13 175.8 0.3 . 1 . . . . . 327 ASN CO . 50785 1 112 . 1 . 1 238 238 ASN CA C 13 52.7 0.1 . 1 . . . . . 327 ASN CA . 50785 1 113 . 1 . 1 238 238 ASN CB C 13 42.1 0.2 . 1 . . . . . 327 ASN CB . 50785 1 114 . 1 . 1 238 238 ASN CG C 13 176.6 0.2 . 1 . . . . . 327 ASN CG . 50785 1 115 . 1 . 1 238 238 ASN N N 15 113.3 0.1 . 1 . . . . . 327 ASN N . 50785 1 116 . 1 . 1 238 238 ASN ND2 N 15 110.1 0.2 . 1 . . . . . 327 ASN ND2 . 50785 1 117 . 1 . 1 239 239 ILE C C 13 174.8 0.1 . 1 . . . . . 328 ILE CO . 50785 1 118 . 1 . 1 239 239 ILE CA C 13 61.4 0.2 . 1 . . . . . 328 ILE CA . 50785 1 119 . 1 . 1 239 239 ILE CB C 13 41.8 0.2 . 1 . . . . . 328 ILE CB . 50785 1 120 . 1 . 1 239 239 ILE CG1 C 13 27.9 0.1 . 1 . . . . . 328 ILE CG1 . 50785 1 121 . 1 . 1 239 239 ILE CD1 C 13 15.8 0.1 . 1 . . . . . 328 ILE CD1 . 50785 1 122 . 1 . 1 239 239 ILE N N 15 124.7 0.4 . 1 . . . . . 328 ILE N . 50785 1 123 . 1 . 1 240 240 HIS C C 13 173.7 0.1 . 1 . . . . . 329 HIS CO . 50785 1 124 . 1 . 1 240 240 HIS CA C 13 55.5 0.1 . 1 . . . . . 329 HIS CA . 50785 1 125 . 1 . 1 240 240 HIS CB C 13 31.1 0.1 . 1 . . . . . 329 HIS CB . 50785 1 126 . 1 . 1 240 240 HIS N N 15 123.4 0.3 . 1 . . . . . 329 HIS N . 50785 1 127 . 1 . 1 247 247 GLN CA C 13 54.5 0.2 . 1 . . . . . 336 GLN CA . 50785 1 128 . 1 . 1 247 247 GLN CB C 13 36.4 0.0 . 1 . . . . . 336 GLN CB . 50785 1 129 . 1 . 1 247 247 GLN CG C 13 33.1 0.1 . 1 . . . . . 336 GLN CG . 50785 1 130 . 1 . 1 247 247 GLN CD C 13 179.2 0.1 . 1 . . . . . 336 GLN CD . 50785 1 131 . 1 . 1 247 247 GLN N N 15 128.7 0.4 . 1 . . . . . 336 GLN N . 50785 1 132 . 1 . 1 248 248 VAL C C 13 174.4 0.1 . 1 . . . . . 337 VAL CO . 50785 1 133 . 1 . 1 248 248 VAL CA C 13 61.2 0.2 . 1 . . . . . 337 VAL CA . 50785 1 134 . 1 . 1 248 248 VAL CB C 13 33.6 0.1 . 1 . . . . . 337 VAL CB . 50785 1 135 . 1 . 1 248 248 VAL CG1 C 13 21.5 0.3 . 1 . . . . . 337 VAL CG1 . 50785 1 136 . 1 . 1 248 248 VAL CG2 C 13 19.5 0.1 . 1 . . . . . 337 VAL CG2 . 50785 1 137 . 1 . 1 248 248 VAL N N 15 125.9 0.0 . 1 . . . . . 337 VAL N . 50785 1 138 . 1 . 1 249 249 GLU C C 13 174.4 0.2 . 1 . . . . . 338 GLU CO . 50785 1 139 . 1 . 1 249 249 GLU CA C 13 54.6 0.1 . 1 . . . . . 338 GLU CA . 50785 1 140 . 1 . 1 249 249 GLU CB C 13 33.5 0.1 . 1 . . . . . 338 GLU CB . 50785 1 141 . 1 . 1 249 249 GLU CG C 13 36.4 0.1 . 1 . . . . . 338 GLU CG . 50785 1 142 . 1 . 1 249 249 GLU CD C 13 182.8 0.2 . 1 . . . . . 338 GLU CD . 50785 1 143 . 1 . 1 249 249 GLU N N 15 129.3 0.4 . 1 . . . . . 338 GLU N . 50785 1 144 . 1 . 1 250 250 VAL C C 13 173.0 0.2 . 1 . . . . . 339 VAL CO . 50785 1 145 . 1 . 1 250 250 VAL CA C 13 61.5 0.2 . 1 . . . . . 339 VAL CA . 50785 1 146 . 1 . 1 250 250 VAL CB C 13 33.6 0.2 . 1 . . . . . 339 VAL CB . 50785 1 147 . 1 . 1 250 250 VAL CG1 C 13 23.7 0.2 . 1 . . . . . 339 VAL CG1 . 50785 1 148 . 1 . 1 250 250 VAL CG2 C 13 20.4 0.2 . 1 . . . . . 339 VAL CG2 . 50785 1 149 . 1 . 1 250 250 VAL N N 15 126.9 0.4 . 1 . . . . . 339 VAL N . 50785 1 150 . 1 . 1 251 251 LYS C C 13 176.3 0.1 . 1 . . . . . 340 LYS CO . 50785 1 151 . 1 . 1 251 251 LYS CA C 13 54.6 0.2 . 1 . . . . . 340 LYS CA . 50785 1 152 . 1 . 1 251 251 LYS CB C 13 35.3 0.1 . 1 . . . . . 340 LYS CB . 50785 1 153 . 1 . 1 251 251 LYS CG C 13 26.9 0.1 . 1 . . . . . 340 LYS CG . 50785 1 154 . 1 . 1 251 251 LYS CD C 13 29.2 0.2 . 1 . . . . . 340 LYS CD . 50785 1 155 . 1 . 1 251 251 LYS CE C 13 44.1 0.0 . 1 . . . . . 340 LYS CE . 50785 1 156 . 1 . 1 251 251 LYS N N 15 130.1 0.4 . 1 . . . . . 340 LYS N . 50785 1 157 . 1 . 1 252 252 SER C C 13 173.3 0.2 . 1 . . . . . 341 SER CO . 50785 1 158 . 1 . 1 252 252 SER CA C 13 57.3 0.3 . 1 . . . . . 341 SER CA . 50785 1 159 . 1 . 1 252 252 SER CB C 13 66.4 0.2 . 1 . . . . . 341 SER CB . 50785 1 160 . 1 . 1 252 252 SER N N 15 120.9 0.5 . 1 . . . . . 341 SER N . 50785 1 161 . 1 . 1 253 253 GLU C C 13 175.2 0.2 . 1 . . . . . 342 GLU CO . 50785 1 162 . 1 . 1 253 253 GLU CA C 13 54.3 0.2 . 1 . . . . . 342 GLU CA . 50785 1 163 . 1 . 1 253 253 GLU CB C 13 32.5 0.2 . 1 . . . . . 342 GLU CB . 50785 1 164 . 1 . 1 253 253 GLU CG C 13 34.4 0.1 . 1 . . . . . 342 GLU CG . 50785 1 165 . 1 . 1 253 253 GLU CD C 13 180.2 0.1 . 1 . . . . . 342 GLU CD . 50785 1 166 . 1 . 1 253 253 GLU N N 15 127.0 0.4 . 1 . . . . . 342 GLU N . 50785 1 167 . 1 . 1 254 254 LYS C C 13 175.8 0.3 . 1 . . . . . 343 LYS CO . 50785 1 168 . 1 . 1 254 254 LYS CA C 13 58.0 0.2 . 1 . . . . . 343 LYS CA . 50785 1 169 . 1 . 1 254 254 LYS CB C 13 32.2 0.1 . 1 . . . . . 343 LYS CB . 50785 1 170 . 1 . 1 254 254 LYS CG C 13 23.0 0.1 . 1 . . . . . 343 LYS CG . 50785 1 171 . 1 . 1 254 254 LYS CD C 13 27.8 0.3 . 1 . . . . . 343 LYS CD . 50785 1 172 . 1 . 1 254 254 LYS N N 15 126.0 0.4 . 1 . . . . . 343 LYS N . 50785 1 173 . 1 . 1 259 259 ASP C C 13 173.0 0.2 . 1 . . . . . 348 ASP CO . 50785 1 174 . 1 . 1 259 259 ASP CA C 13 53.2 0.1 . 1 . . . . . 348 ASP CA . 50785 1 175 . 1 . 1 259 259 ASP CB C 13 44.4 0.2 . 1 . . . . . 348 ASP CB . 50785 1 176 . 1 . 1 259 259 ASP CG C 13 180.4 0.2 . 1 . . . . . 348 ASP CG . 50785 1 177 . 1 . 1 259 259 ASP N N 15 123.6 0.3 . 1 . . . . . 348 ASP N . 50785 1 178 . 1 . 1 260 260 ARG C C 13 174.2 0.1 . 1 . . . . . 349 ARG CO . 50785 1 179 . 1 . 1 260 260 ARG CA C 13 56.3 0.2 . 1 . . . . . 349 ARG CA . 50785 1 180 . 1 . 1 260 260 ARG CB C 13 34.3 0.1 . 1 . . . . . 349 ARG CB . 50785 1 181 . 1 . 1 260 260 ARG CG C 13 30.7 0.2 . 1 . . . . . 349 ARG CG . 50785 1 182 . 1 . 1 260 260 ARG CD C 13 44.7 0.1 . 1 . . . . . 349 ARG CD . 50785 1 183 . 1 . 1 260 260 ARG CZ C 13 159.5 0.1 . 1 . . . . . 349 ARG CZ . 50785 1 184 . 1 . 1 260 260 ARG N N 15 117.4 0.3 . 1 . . . . . 349 ARG N . 50785 1 185 . 1 . 1 260 260 ARG NE N 15 85.3 0.2 . 1 . . . . . 349 ARG NE . 50785 1 186 . 1 . 1 260 260 ARG NH1 N 15 80.6 0.1 . 1 . . . . . 349 ARG NH# . 50785 1 187 . 1 . 1 260 260 ARG NH2 N 15 80.6 0.1 . 1 . . . . . 349 ARG NH# . 50785 1 188 . 1 . 1 261 261 VAL C C 13 174.4 0.2 . 9 . . . . . 350 VAL CO . 50785 1 189 . 1 . 1 261 261 VAL CA C 13 60.6 0.1 . 9 . . . . . 350 VAL CA . 50785 1 190 . 1 . 1 261 261 VAL CB C 13 34.8 0.0 . 9 . . . . . 350 VAL CB . 50785 1 191 . 1 . 1 261 261 VAL CG1 C 13 21.5 0.1 . 9 . . . . . 350 VAL CG# . 50785 1 192 . 1 . 1 261 261 VAL CG2 C 13 21.5 0.1 . 9 . . . . . 350 VAL CG# . 50785 1 193 . 1 . 1 261 261 VAL N N 15 122.8 0.3 . 9 . . . . . 350 VAL N . 50785 1 194 . 1 . 1 262 262 GLN C C 13 174.6 0.2 . 1 . . . . . 351 GLN CO . 50785 1 195 . 1 . 1 262 262 GLN CA C 13 54.6 0.2 . 1 . . . . . 351 GLN CA . 50785 1 196 . 1 . 1 262 262 GLN CB C 13 32.3 0.1 . 1 . . . . . 351 GLN CB . 50785 1 197 . 1 . 1 262 262 GLN CG C 13 31.3 0.1 . 1 . . . . . 351 GLN CG . 50785 1 198 . 1 . 1 262 262 GLN CD C 13 179.1 0.2 . 1 . . . . . 351 GLN CD . 50785 1 199 . 1 . 1 262 262 GLN N N 15 122.2 0.4 . 1 . . . . . 351 GLN N . 50785 1 200 . 1 . 1 262 262 GLN NE2 N 15 111.4 0.0 . 1 . . . . . 351 GLN NE2 . 50785 1 201 . 1 . 1 263 263 SER C C 13 174.1 0.3 . 1 . . . . . 352 SER CO . 50785 1 202 . 1 . 1 263 263 SER CA C 13 56.4 0.2 . 1 . . . . . 352 SER CA . 50785 1 203 . 1 . 1 263 263 SER CB C 13 65.4 0.2 . 1 . . . . . 352 SER CB . 50785 1 204 . 1 . 1 263 263 SER N N 15 116.3 0.4 . 1 . . . . . 352 SER N . 50785 1 205 . 1 . 1 264 264 LYS CA C 13 55.3 0.2 . 1 . . . . . 353 LYS CA . 50785 1 206 . 1 . 1 264 264 LYS CB C 13 35.3 0.0 . 1 . . . . . 353 LYS CB . 50785 1 207 . 1 . 1 264 264 LYS CG C 13 22.9 0.9 . 1 . . . . . 353 LYS CG . 50785 1 208 . 1 . 1 264 264 LYS N N 15 121.3 0.3 . 1 . . . . . 353 LYS N . 50785 1 209 . 1 . 1 265 265 ILE C C 13 177.4 0.2 . 1 . . . . . 354 ILE CO . 50785 1 210 . 1 . 1 265 265 ILE CA C 13 60.3 0.1 . 1 . . . . . 354 ILE CA . 50785 1 211 . 1 . 1 265 265 ILE CB C 13 40.6 0.1 . 1 . . . . . 354 ILE CB . 50785 1 212 . 1 . 1 265 265 ILE CG1 C 13 28.2 0.1 . 1 . . . . . 354 ILE CG1 . 50785 1 213 . 1 . 1 265 265 ILE CG2 C 13 18.7 0.1 . 1 . . . . . 354 ILE CG2 . 50785 1 214 . 1 . 1 265 265 ILE CD1 C 13 13.9 0.1 . 1 . . . . . 354 ILE CD1 . 50785 1 215 . 1 . 1 265 265 ILE N N 15 125.7 0.1 . 1 . . . . . 354 ILE N . 50785 1 216 . 1 . 1 266 266 GLY C C 13 171.6 0.2 . 1 . . . . . 355 GLY CO . 50785 1 217 . 1 . 1 266 266 GLY CA C 13 47.1 0.2 . 1 . . . . . 355 GLY CA . 50785 1 218 . 1 . 1 266 266 GLY N N 15 112.7 0.4 . 1 . . . . . 355 GLY N . 50785 1 219 . 1 . 1 267 267 SER C C 13 172.7 0.1 . 1 . . . . . 356 SER CO . 50785 1 220 . 1 . 1 267 267 SER CA C 13 56.7 0.2 . 1 . . . . . 356 SER CA . 50785 1 221 . 1 . 1 267 267 SER CB C 13 67.5 0.2 . 1 . . . . . 356 SER CB . 50785 1 222 . 1 . 1 267 267 SER N N 15 109.3 0.3 . 1 . . . . . 356 SER N . 50785 1 223 . 1 . 1 268 268 LEU C C 13 175.5 0.1 . 1 . . . . . 357 LEU CO . 50785 1 224 . 1 . 1 268 268 LEU CA C 13 55.7 0.2 . 1 . . . . . 357 LEU CA . 50785 1 225 . 1 . 1 268 268 LEU CB C 13 42.3 0.1 . 1 . . . . . 357 LEU CB . 50785 1 226 . 1 . 1 268 268 LEU CG C 13 28.6 0.1 . 1 . . . . . 357 LEU CG . 50785 1 227 . 1 . 1 268 268 LEU CD1 C 13 26.5 0.1 . 1 . . . . . 357 LEU CD1 . 50785 1 228 . 1 . 1 268 268 LEU N N 15 124.5 0.5 . 1 . . . . . 357 LEU N . 50785 1 229 . 1 . 1 269 269 ASP C C 13 173.8 0.3 . 9 . . . . . 358 ASP CO . 50785 1 230 . 1 . 1 269 269 ASP CA C 13 52.9 0.2 . 9 . . . . . 358 ASP CA . 50785 1 231 . 1 . 1 269 269 ASP CB C 13 44.2 0.1 . 9 . . . . . 358 ASP CB . 50785 1 232 . 1 . 1 269 269 ASP CG C 13 180.2 0.3 . 9 . . . . . 358 ASP CG . 50785 1 233 . 1 . 1 269 269 ASP N N 15 118.5 0.4 . 9 . . . . . 358 ASP N . 50785 1 234 . 1 . 1 270 270 ASN C C 13 173.9 0.3 . 9 . . . . . 359 ASN CO . 50785 1 235 . 1 . 1 270 270 ASN CA C 13 51.5 0.2 . 9 . . . . . 359 ASN CA . 50785 1 236 . 1 . 1 270 270 ASN CB C 13 41.9 0.1 . 9 . . . . . 359 ASN CB . 50785 1 237 . 1 . 1 270 270 ASN N N 15 123.3 0.5 . 9 . . . . . 359 ASN N . 50785 1 238 . 1 . 1 271 271 ILE C C 13 174.8 0.0 . 9 . . . . . 360 ILE CO . 50785 1 239 . 1 . 1 271 271 ILE CA C 13 59.9 0.1 . 9 . . . . . 360 ILE CA . 50785 1 240 . 1 . 1 271 271 ILE CB C 13 41.4 0.1 . 9 . . . . . 360 ILE CB . 50785 1 241 . 1 . 1 271 271 ILE CG1 C 13 26.8 0.0 . 9 . . . . . 360 ILE CG1 . 50785 1 242 . 1 . 1 271 271 ILE CG2 C 13 17.0 0.1 . 9 . . . . . 360 ILE CG2 . 50785 1 243 . 1 . 1 271 271 ILE CD1 C 13 12.9 0.0 . 9 . . . . . 360 ILE CD1 . 50785 1 244 . 1 . 1 271 271 ILE N N 15 122.4 0.2 . 9 . . . . . 360 ILE N . 50785 1 245 . 1 . 1 272 272 THR C C 13 174.0 0.1 . 9 . . . . . 361 THR CO . 50785 1 246 . 1 . 1 272 272 THR CA C 13 60.0 0.2 . 9 . . . . . 361 THR CA . 50785 1 247 . 1 . 1 272 272 THR CB C 13 71.5 0.1 . 9 . . . . . 361 THR CB . 50785 1 248 . 1 . 1 272 272 THR CG2 C 13 20.8 0.1 . 9 . . . . . 361 THR CG . 50785 1 249 . 1 . 1 272 272 THR N N 15 116.3 0.1 . 9 . . . . . 361 THR N . 50785 1 250 . 1 . 1 278 278 GLY C C 13 174.8 0.2 . 1 . . . . . 367 GLY CO . 50785 1 251 . 1 . 1 278 278 GLY CA C 13 47.2 0.2 . 1 . . . . . 367 GLY CA . 50785 1 252 . 1 . 1 278 278 GLY N N 15 105.6 0.3 . 1 . . . . . 367 GLY N . 50785 1 253 . 1 . 1 279 279 ASN C C 13 175.8 0.1 . 1 . . . . . 368 ASN CO . 50785 1 254 . 1 . 1 279 279 ASN CA C 13 53.4 0.2 . 1 . . . . . 368 ASN CA . 50785 1 255 . 1 . 1 279 279 ASN CB C 13 40.8 0.1 . 1 . . . . . 368 ASN CB . 50785 1 256 . 1 . 1 279 279 ASN N N 15 118.5 0.3 . 1 . . . . . 368 ASN N . 50785 1 257 . 1 . 1 280 280 LYS C C 13 173.7 0.3 . 1 . . . . . 369 LYS CO . 50785 1 258 . 1 . 1 280 280 LYS CA C 13 58.2 0.2 . 1 . . . . . 369 LYS CA . 50785 1 259 . 1 . 1 280 280 LYS N N 15 117.3 0.5 . 1 . . . . . 369 LYS N . 50785 1 260 . 1 . 1 281 281 LYS CA C 13 54.4 0.1 . 1 . . . . . 370 LYS CA . 50785 1 261 . 1 . 1 281 281 LYS CB C 13 36.1 0.0 . 1 . . . . . 370 LYS CB . 50785 1 262 . 1 . 1 281 281 LYS CG C 13 23.8 0.2 . 1 . . . . . 370 LYS CG . 50785 1 263 . 1 . 1 281 281 LYS CD C 13 28.8 0.1 . 1 . . . . . 370 LYS CD . 50785 1 264 . 1 . 1 281 281 LYS CE C 13 45.6 0.1 . 1 . . . . . 370 LYS CE . 50785 1 265 . 1 . 1 281 281 LYS N N 15 123.9 0.2 . 1 . . . . . 370 LYS N . 50785 1 266 . 1 . 1 282 282 ILE C C 13 173.2 0.1 . 1 . . . . . 371 ILE CO . 50785 1 267 . 1 . 1 282 282 ILE CA C 13 60.2 0.1 . 1 . . . . . 371 ILE CA . 50785 1 268 . 1 . 1 282 282 ILE CB C 13 42.3 0.2 . 1 . . . . . 371 ILE CB . 50785 1 269 . 1 . 1 282 282 ILE CG1 C 13 27.5 0.1 . 1 . . . . . 371 ILE CG1 . 50785 1 270 . 1 . 1 282 282 ILE CG2 C 13 18.3 0.1 . 1 . . . . . 371 ILE CG2 . 50785 1 271 . 1 . 1 282 282 ILE CD1 C 13 14.1 0.0 . 1 . . . . . 371 ILE CD1 . 50785 1 272 . 1 . 1 282 282 ILE N N 15 123.5 0.3 . 1 . . . . . 371 ILE N . 50785 1 273 . 1 . 1 283 283 GLU C C 13 177.0 0.1 . 9 . . . . . 372 GLU CO . 50785 1 274 . 1 . 1 283 283 GLU CA C 13 54.4 0.0 . 9 . . . . . 372 GLU CA . 50785 1 275 . 1 . 1 284 284 THR C C 13 171.3 0.1 . 9 . . . . . 373 THR CO . 50785 1 276 . 1 . 1 284 284 THR CA C 13 57.4 0.2 . 9 . . . . . 373 THR CA . 50785 1 277 . 1 . 1 284 284 THR CB C 13 70.0 0.2 . 9 . . . . . 373 THR CB . 50785 1 278 . 1 . 1 284 284 THR CG2 C 13 22.2 0.2 . 9 . . . . . 373 THR CG . 50785 1 279 . 1 . 1 284 284 THR N N 15 109.9 0.2 . 9 . . . . . 373 THR N . 50785 1 280 . 1 . 1 288 288 THR C C 13 172.4 0.1 . 1 . . . . . 377 THR CO . 50785 1 281 . 1 . 1 288 288 THR CA C 13 58.9 0.2 . 1 . . . . . 377 THR CA . 50785 1 282 . 1 . 1 288 288 THR CB C 13 70.8 0.1 . 1 . . . . . 377 THR CB . 50785 1 283 . 1 . 1 288 288 THR CG2 C 13 21.9 0.2 . 1 . . . . . 377 THR CG . 50785 1 284 . 1 . 1 288 288 THR N N 15 118.2 0.3 . 1 . . . . . 377 THR N . 50785 1 285 . 1 . 1 289 289 PHE C C 13 175.4 0.0 . 1 . . . . . 378 PHE CO . 50785 1 286 . 1 . 1 289 289 PHE CA C 13 56.9 0.1 . 1 . . . . . 378 PHE CA . 50785 1 287 . 1 . 1 289 289 PHE CB C 13 41.8 0.2 . 1 . . . . . 378 PHE CB . 50785 1 288 . 1 . 1 289 289 PHE CD1 C 13 130.7 0.3 . 1 . . . . . 378 PHE CG . 50785 1 289 . 1 . 1 289 289 PHE N N 15 127.9 0.3 . 1 . . . . . 378 PHE N . 50785 1 290 . 1 . 1 291 291 GLU CA C 13 54.4 0.1 . 9 . . . . . 380 GLU CA . 50785 1 291 . 1 . 1 291 291 GLU CB C 13 36.5 0.0 . 9 . . . . . 380 GLU CB . 50785 1 292 . 1 . 1 291 291 GLU CG C 13 33.0 0.0 . 9 . . . . . 380 GLU CG . 50785 1 293 . 1 . 1 291 291 GLU CD C 13 183.3 0.0 . 9 . . . . . 380 GLU CD . 50785 1 294 . 1 . 1 291 291 GLU N N 15 127.4 0.2 . 9 . . . . . 380 GLU N . 50785 1 295 . 1 . 1 293 293 ALA C C 13 174.1 0.3 . 1 . . . . . 382 ALA CO . 50785 1 296 . 1 . 1 293 293 ALA CA C 13 51.7 0.1 . 1 . . . . . 382 ALA CA . 50785 1 297 . 1 . 1 293 293 ALA CB C 13 23.4 0.2 . 1 . . . . . 382 ALA CB . 50785 1 298 . 1 . 1 293 293 ALA N N 15 123.5 0.2 . 1 . . . . . 382 ALA N . 50785 1 299 . 1 . 1 294 294 LYS C C 13 171.9 0.1 . 1 . . . . . 383 LYS CO . 50785 1 300 . 1 . 1 294 294 LYS CA C 13 59.2 0.2 . 1 . . . . . 383 LYS CA . 50785 1 301 . 1 . 1 294 294 LYS N N 15 121.6 0.4 . 1 . . . . . 383 LYS N . 50785 1 302 . 1 . 1 295 295 ALA C C 13 176.6 0.2 . 1 . . . . . 384 ALA CO . 50785 1 303 . 1 . 1 295 295 ALA CA C 13 49.4 0.1 . 1 . . . . . 384 ALA CA . 50785 1 304 . 1 . 1 295 295 ALA CB C 13 22.3 0.1 . 1 . . . . . 384 ALA CB . 50785 1 305 . 1 . 1 295 295 ALA N N 15 116.9 0.2 . 1 . . . . . 384 ALA N . 50785 1 306 . 1 . 1 296 296 LYS C C 13 175.3 0.0 . 1 . . . . . 385 LYS CO . 50785 1 307 . 1 . 1 296 296 LYS CA C 13 57.8 0.1 . 1 . . . . . 385 LYS CA . 50785 1 308 . 1 . 1 296 296 LYS CB C 13 35.8 0.0 . 1 . . . . . 385 LYS CB . 50785 1 309 . 1 . 1 296 296 LYS N N 15 122.0 0.3 . 1 . . . . . 385 LYS N . 50785 1 310 . 1 . 1 297 297 THR C C 13 172.4 0.1 . 1 . . . . . 386 THR CO . 50785 1 311 . 1 . 1 297 297 THR CA C 13 62.1 0.2 . 1 . . . . . 386 THR CA . 50785 1 312 . 1 . 1 297 297 THR CB C 13 67.4 0.1 . 1 . . . . . 386 THR CB . 50785 1 313 . 1 . 1 297 297 THR CG2 C 13 23.7 0.0 . 1 . . . . . 386 THR CG . 50785 1 314 . 1 . 1 297 297 THR N N 15 127.3 0.4 . 1 . . . . . 386 THR N . 50785 1 315 . 1 . 1 298 298 ASP C C 13 174.1 0.2 . 1 . . . . . 387 ASP CO . 50785 1 316 . 1 . 1 298 298 ASP CA C 13 53.1 0.2 . 1 . . . . . 387 ASP CA . 50785 1 317 . 1 . 1 298 298 ASP CB C 13 43.3 0.1 . 1 . . . . . 387 ASP CB . 50785 1 318 . 1 . 1 298 298 ASP CG C 13 179.8 0.2 . 1 . . . . . 387 ASP CG . 50785 1 319 . 1 . 1 298 298 ASP N N 15 129.9 0.2 . 1 . . . . . 387 ASP N . 50785 1 320 . 1 . 1 299 299 HIS C C 13 174.1 0.2 . 1 . . . . . 388 HIS CO . 50785 1 321 . 1 . 1 299 299 HIS CA C 13 56.3 0.2 . 1 . . . . . 388 HIS CA . 50785 1 322 . 1 . 1 299 299 HIS CB C 13 32.7 0.1 . 1 . . . . . 388 HIS CB . 50785 1 323 . 1 . 1 299 299 HIS N N 15 123.2 0.5 . 1 . . . . . 388 HIS N . 50785 1 324 . 1 . 1 300 300 GLY C C 13 172.8 0.3 . 1 . . . . . 389 GLY CO . 50785 1 325 . 1 . 1 300 300 GLY CA C 13 44.6 0.1 . 1 . . . . . 389 GLY CA . 50785 1 326 . 1 . 1 300 300 GLY N N 15 107.6 0.3 . 1 . . . . . 389 GLY N . 50785 1 327 . 1 . 1 301 301 ALA C C 13 175.4 0.0 . 1 . . . . . 390 ALA CO . 50785 1 328 . 1 . 1 301 301 ALA CA C 13 49.6 0.1 . 1 . . . . . 390 ALA CA . 50785 1 329 . 1 . 1 301 301 ALA CB C 13 22.8 0.1 . 1 . . . . . 390 ALA CB . 50785 1 330 . 1 . 1 301 301 ALA N N 15 126.4 0.3 . 1 . . . . . 390 ALA N . 50785 1 331 . 1 . 1 303 303 ILE C C 13 173.6 0.1 . 1 . . . . . 392 ILE CO . 50785 1 332 . 1 . 1 303 303 ILE CA C 13 60.1 0.1 . 1 . . . . . 392 ILE CA . 50785 1 333 . 1 . 1 303 303 ILE CB C 13 40.8 0.2 . 1 . . . . . 392 ILE CB . 50785 1 334 . 1 . 1 303 303 ILE CG1 C 13 26.7 0.2 . 1 . . . . . 392 ILE CG1 . 50785 1 335 . 1 . 1 303 303 ILE CG2 C 13 18.7 0.1 . 1 . . . . . 392 ILE CG2 . 50785 1 336 . 1 . 1 303 303 ILE CD1 C 13 13.9 0.0 . 1 . . . . . 392 ILE CD1 . 50785 1 337 . 1 . 1 303 303 ILE N N 15 123.0 0.1 . 1 . . . . . 392 ILE N . 50785 1 338 . 1 . 1 304 304 VAL C C 13 173.8 0.1 . 1 . . . . . 393 VAL CO . 50785 1 339 . 1 . 1 304 304 VAL CA C 13 61.5 0.1 . 1 . . . . . 393 VAL CA . 50785 1 340 . 1 . 1 304 304 VAL CB C 13 34.9 0.0 . 1 . . . . . 393 VAL CB . 50785 1 341 . 1 . 1 304 304 VAL N N 15 127.3 0.2 . 1 . . . . . 393 VAL N . 50785 1 342 . 1 . 1 305 305 TYR CA C 13 58.1 0.1 . 9 . . . . . 394 TYR CA . 50785 1 343 . 1 . 1 305 305 TYR CB C 13 44.1 0.0 . 9 . . . . . 394 TYR CB . 50785 1 344 . 1 . 1 305 305 TYR N N 15 122.0 0.1 . 9 . . . . . 394 TYR N . 50785 1 345 . 1 . 1 307 307 SER C C 13 173.7 0.2 . 1 . . . . . 396 SER CO . 50785 1 346 . 1 . 1 307 307 SER CA C 13 56.0 0.2 . 1 . . . . . 396 SER CA . 50785 1 347 . 1 . 1 307 307 SER CB C 13 63.6 0.1 . 1 . . . . . 396 SER CB . 50785 1 348 . 1 . 1 307 307 SER N N 15 122.1 0.2 . 1 . . . . . 396 SER N . 50785 1 349 . 1 . 1 308 308 PRO C C 13 174.9 0.4 . 1 . . . . . 397 PRO CO . 50785 1 350 . 1 . 1 308 308 PRO CA C 13 62.9 0.3 . 1 . . . . . 397 PRO CA . 50785 1 351 . 1 . 1 308 308 PRO CB C 13 32.7 0.2 . 1 . . . . . 397 PRO CB . 50785 1 352 . 1 . 1 308 308 PRO CG C 13 27.7 0.1 . 1 . . . . . 397 PRO CG . 50785 1 353 . 1 . 1 308 308 PRO CD C 13 50.3 0.2 . 1 . . . . . 397 PRO CD . 50785 1 354 . 1 . 1 308 308 PRO N N 15 136.1 0.3 . 1 . . . . . 397 PRO N . 50785 1 355 . 1 . 1 309 309 VAL C C 13 174.7 0.2 . 1 . . . . . 398 VAL CO . 50785 1 356 . 1 . 1 309 309 VAL CA C 13 61.1 0.1 . 1 . . . . . 398 VAL CA . 50785 1 357 . 1 . 1 309 309 VAL CB C 13 35.5 0.1 . 1 . . . . . 398 VAL CB . 50785 1 358 . 1 . 1 309 309 VAL CG1 C 13 21.4 0.1 . 1 . . . . . 398 VAL CG# . 50785 1 359 . 1 . 1 309 309 VAL CG2 C 13 21.4 0.1 . 1 . . . . . 398 VAL CG# . 50785 1 360 . 1 . 1 309 309 VAL N N 15 119.9 0.4 . 1 . . . . . 398 VAL N . 50785 1 361 . 1 . 1 310 310 VAL C C 13 175.6 0.1 . 1 . . . . . 399 VAL CO . 50785 1 362 . 1 . 1 310 310 VAL CA C 13 60.6 0.1 . 1 . . . . . 399 VAL CA . 50785 1 363 . 1 . 1 310 310 VAL CB C 13 36.4 0.1 . 1 . . . . . 399 VAL CB . 50785 1 364 . 1 . 1 310 310 VAL CG1 C 13 20.9 0.0 . 1 . . . . . 399 VAL CG1 . 50785 1 365 . 1 . 1 310 310 VAL CG2 C 13 19.9 0.0 . 1 . . . . . 399 VAL CG2 . 50785 1 366 . 1 . 1 310 310 VAL N N 15 124.3 0.4 . 1 . . . . . 399 VAL N . 50785 1 367 . 1 . 1 311 311 SER C C 13 173.8 0.2 . 1 . . . . . 400 SER CO . 50785 1 368 . 1 . 1 311 311 SER CA C 13 54.4 0.1 . 1 . . . . . 400 SER CA . 50785 1 369 . 1 . 1 311 311 SER CB C 13 63.2 0.2 . 1 . . . . . 400 SER CB . 50785 1 370 . 1 . 1 311 311 SER N N 15 122.9 0.3 . 1 . . . . . 400 SER N . 50785 1 371 . 1 . 1 312 312 GLY C C 13 174.1 0.1 . 1 . . . . . 401 GLY CO . 50785 1 372 . 1 . 1 312 312 GLY CA C 13 43.9 0.1 . 1 . . . . . 401 GLY CA . 50785 1 373 . 1 . 1 312 312 GLY N N 15 114.0 0.2 . 1 . . . . . 401 GLY N . 50785 1 374 . 1 . 1 313 313 ASP C C 13 174.4 0.0 . 9 . . . . . 402 ASP CO . 50785 1 375 . 1 . 1 313 313 ASP CA C 13 53.4 0.1 . 9 . . . . . 402 ASP CA . 50785 1 376 . 1 . 1 313 313 ASP CB C 13 44.8 0.1 . 9 . . . . . 402 ASP CB . 50785 1 377 . 1 . 1 313 313 ASP CG C 13 181.1 0.1 . 9 . . . . . 402 ASP CG . 50785 1 378 . 1 . 1 313 313 ASP N N 15 126.6 0.3 . 9 . . . . . 402 ASP N . 50785 1 379 . 1 . 1 314 314 THR C C 13 172.7 0.2 . 1 . . . . . 403 THR CO . 50785 1 380 . 1 . 1 314 314 THR CA C 13 61.1 0.2 . 1 . . . . . 403 THR CA . 50785 1 381 . 1 . 1 314 314 THR CB C 13 71.1 0.1 . 1 . . . . . 403 THR CB . 50785 1 382 . 1 . 1 314 314 THR CG2 C 13 21.7 0.0 . 1 . . . . . 403 THR CG . 50785 1 383 . 1 . 1 314 314 THR N N 15 122.5 0.2 . 1 . . . . . 403 THR N . 50785 1 384 . 1 . 1 315 315 SER CA C 13 56.4 0.1 . 9 . . . . . 404 SER CA . 50785 1 385 . 1 . 1 315 315 SER CB C 13 64.1 0.0 . 9 . . . . . 404 SER CB . 50785 1 386 . 1 . 1 315 315 SER N N 15 125.2 0.2 . 9 . . . . . 404 SER N . 50785 1 387 . 1 . 1 322 322 VAL C C 13 174.3 0.1 . 1 . . . . . 411 VAL CO . 50785 1 388 . 1 . 1 322 322 VAL CA C 13 62.4 0.2 . 1 . . . . . 411 VAL CA . 50785 1 389 . 1 . 1 322 322 VAL CB C 13 33.9 0.1 . 1 . . . . . 411 VAL CB . 50785 1 390 . 1 . 1 322 322 VAL CG1 C 13 22.1 0.2 . 1 . . . . . 411 VAL CG# . 50785 1 391 . 1 . 1 322 322 VAL CG2 C 13 22.1 0.2 . 1 . . . . . 411 VAL CG# . 50785 1 392 . 1 . 1 322 322 VAL N N 15 130.6 0.3 . 1 . . . . . 411 VAL N . 50785 1 393 . 1 . 1 323 323 SER C C 13 173.9 0.1 . 1 . . . . . 412 SER CO . 50785 1 394 . 1 . 1 323 323 SER CA C 13 55.0 0.2 . 1 . . . . . 412 SER CA . 50785 1 395 . 1 . 1 323 323 SER CB C 13 64.5 0.3 . 1 . . . . . 412 SER CB . 50785 1 396 . 1 . 1 323 323 SER N N 15 117.4 0.5 . 1 . . . . . 412 SER N . 50785 1 397 . 1 . 1 324 324 SER C C 13 174.5 0.2 . 1 . . . . . 413 SER CO . 50785 1 398 . 1 . 1 324 324 SER CA C 13 57.2 0.2 . 1 . . . . . 413 SER CA . 50785 1 399 . 1 . 1 324 324 SER CB C 13 66.3 0.1 . 1 . . . . . 413 SER CB . 50785 1 400 . 1 . 1 324 324 SER N N 15 121.0 0.1 . 1 . . . . . 413 SER N . 50785 1 401 . 1 . 1 325 325 THR C C 13 175.4 0.2 . 1 . . . . . 414 THR CO . 50785 1 402 . 1 . 1 325 325 THR CA C 13 60.4 0.2 . 1 . . . . . 414 THR CA . 50785 1 403 . 1 . 1 325 325 THR CB C 13 68.0 0.1 . 1 . . . . . 414 THR CB . 50785 1 404 . 1 . 1 325 325 THR CG2 C 13 22.1 0.2 . 1 . . . . . 414 THR CG . 50785 1 405 . 1 . 1 325 325 THR N N 15 116.9 0.4 . 1 . . . . . 414 THR N . 50785 1 406 . 1 . 1 326 326 GLY C C 13 171.7 0.2 . 1 . . . . . 415 GLY CO . 50785 1 407 . 1 . 1 326 326 GLY CA C 13 44.1 0.2 . 1 . . . . . 415 GLY CA . 50785 1 408 . 1 . 1 326 326 GLY N N 15 114.9 0.4 . 1 . . . . . 415 GLY N . 50785 1 409 . 1 . 1 327 327 SER C C 13 174.7 0.1 . 1 . . . . . 416 SER CO . 50785 1 410 . 1 . 1 327 327 SER CA C 13 56.4 0.2 . 1 . . . . . 416 SER CA . 50785 1 411 . 1 . 1 327 327 SER CB C 13 66.3 0.1 . 1 . . . . . 416 SER CB . 50785 1 412 . 1 . 1 327 327 SER N N 15 120.7 0.3 . 1 . . . . . 416 SER N . 50785 1 413 . 1 . 1 328 328 ILE C C 13 174.4 0.3 . 1 . . . . . 417 ILE CO . 50785 1 414 . 1 . 1 328 328 ILE CA C 13 61.1 0.3 . 1 . . . . . 417 ILE CA . 50785 1 415 . 1 . 1 328 328 ILE CB C 13 41.0 0.3 . 1 . . . . . 417 ILE CB . 50785 1 416 . 1 . 1 328 328 ILE CG1 C 13 27.9 0.2 . 1 . . . . . 417 ILE CG1 . 50785 1 417 . 1 . 1 328 328 ILE CG2 C 13 19.0 0.1 . 1 . . . . . 417 ILE CG2 . 50785 1 418 . 1 . 1 328 328 ILE CD1 C 13 14.7 0.2 . 1 . . . . . 417 ILE CD1 . 50785 1 419 . 1 . 1 328 328 ILE N N 15 124.1 0.4 . 1 . . . . . 417 ILE N . 50785 1 420 . 1 . 1 330 330 MET C C 13 174.4 0.0 . 9 . . . . . 419 MET CO . 50785 1 421 . 1 . 1 330 330 MET CA C 13 54.2 0.1 . 9 . . . . . 419 MET CA . 50785 1 422 . 1 . 1 330 330 MET CB C 13 34.1 0.1 . 9 . . . . . 419 MET CB . 50785 1 423 . 1 . 1 330 330 MET CG C 13 31.4 0.1 . 9 . . . . . 419 MET CG . 50785 1 424 . 1 . 1 330 330 MET CE C 13 20.8 0.0 . 9 . . . . . 419 MET CE . 50785 1 425 . 1 . 1 330 330 MET N N 15 123.8 0.2 . 9 . . . . . 419 MET N . 50785 1 426 . 1 . 1 331 331 VAL C C 13 174.2 0.1 . 1 . . . . . 420 VAL CO . 50785 1 427 . 1 . 1 331 331 VAL CA C 13 60.0 0.1 . 1 . . . . . 420 VAL CA . 50785 1 428 . 1 . 1 331 331 VAL CB C 13 35.2 0.1 . 1 . . . . . 420 VAL CB . 50785 1 429 . 1 . 1 331 331 VAL CG1 C 13 20.7 0.1 . 1 . . . . . 420 VAL CG# . 50785 1 430 . 1 . 1 331 331 VAL CG2 C 13 20.7 0.1 . 1 . . . . . 420 VAL CG# . 50785 1 431 . 1 . 1 331 331 VAL N N 15 121.8 0.3 . 1 . . . . . 420 VAL N . 50785 1 432 . 1 . 1 332 332 ASP C C 13 175.3 0.2 . 1 . . . . . 421 ASP CO . 50785 1 433 . 1 . 1 332 332 ASP CA C 13 52.9 0.1 . 1 . . . . . 421 ASP CA . 50785 1 434 . 1 . 1 332 332 ASP CB C 13 42.7 0.0 . 1 . . . . . 421 ASP CB . 50785 1 435 . 1 . 1 332 332 ASP CG C 13 181.3 0.2 . 1 . . . . . 421 ASP CG . 50785 1 436 . 1 . 1 332 332 ASP N N 15 128.6 0.2 . 1 . . . . . 421 ASP N . 50785 1 437 . 1 . 1 333 333 SER C C 13 168.0 0.0 . 9 . . . . . 422 SER CO . 50785 1 438 . 1 . 1 333 333 SER CA C 13 54.6 0.2 . 9 . . . . . 422 SER CA . 50785 1 439 . 1 . 1 333 333 SER CB C 13 64.7 0.1 . 9 . . . . . 422 SER CB . 50785 1 440 . 1 . 1 333 333 SER N N 15 114.3 0.2 . 9 . . . . . 422 SER N . 50785 1 441 . 1 . 1 337 337 ALA C C 13 175.9 0.2 . 1 . . . . . 426 ALA CO . 50785 1 442 . 1 . 1 337 337 ALA CA C 13 49.8 0.1 . 1 . . . . . 426 ALA CA . 50785 1 443 . 1 . 1 337 337 ALA CB C 13 23.7 0.2 . 1 . . . . . 426 ALA CB . 50785 1 444 . 1 . 1 337 337 ALA N N 15 124.0 0.3 . 1 . . . . . 426 ALA N . 50785 1 445 . 1 . 1 338 338 THR C C 13 171.2 0.1 . 1 . . . . . 427 THR CO . 50785 1 446 . 1 . 1 338 338 THR CA C 13 61.7 0.2 . 1 . . . . . 427 THR CA . 50785 1 447 . 1 . 1 338 338 THR CB C 13 71.7 0.1 . 1 . . . . . 427 THR CB . 50785 1 448 . 1 . 1 338 338 THR CG2 C 13 21.6 0.1 . 1 . . . . . 427 THR CG . 50785 1 449 . 1 . 1 338 338 THR N N 15 119.3 0.2 . 1 . . . . . 427 THR N . 50785 1 450 . 1 . 1 339 339 LEU C C 13 174.5 0.2 . 1 . . . . . 428 LEU CO . 50785 1 451 . 1 . 1 339 339 LEU CA C 13 54.5 0.2 . 1 . . . . . 428 LEU CA . 50785 1 452 . 1 . 1 339 339 LEU CB C 13 45.1 0.1 . 1 . . . . . 428 LEU CB . 50785 1 453 . 1 . 1 339 339 LEU CG C 13 29.6 0.2 . 1 . . . . . 428 LEU CG . 50785 1 454 . 1 . 1 339 339 LEU CD1 C 13 28.0 0.1 . 1 . . . . . 428 LEU CD1 . 50785 1 455 . 1 . 1 339 339 LEU CD2 C 13 24.7 0.2 . 1 . . . . . 428 LEU CD2 . 50785 1 456 . 1 . 1 339 339 LEU N N 15 132.3 0.4 . 1 . . . . . 428 LEU N . 50785 1 457 . 1 . 1 340 340 ALA C C 13 175.6 0.1 . 1 . . . . . 429 ALA CO . 50785 1 458 . 1 . 1 340 340 ALA CA C 13 50.7 0.2 . 1 . . . . . 429 ALA CA . 50785 1 459 . 1 . 1 340 340 ALA CB C 13 23.3 0.1 . 1 . . . . . 429 ALA CB . 50785 1 460 . 1 . 1 340 340 ALA N N 15 126.5 0.3 . 1 . . . . . 429 ALA N . 50785 1 461 . 1 . 1 341 341 ASP C C 13 174.8 0.1 . 9 . . . . . 430 ASP CO . 50785 1 462 . 1 . 1 341 341 ASP CA C 13 53.3 0.2 . 9 . . . . . 430 ASP CA . 50785 1 463 . 1 . 1 341 341 ASP CB C 13 41.4 0.1 . 9 . . . . . 430 ASP CB . 50785 1 464 . 1 . 1 341 341 ASP CG C 13 177.1 0.0 . 9 . . . . . 430 ASP CG . 50785 1 465 . 1 . 1 341 341 ASP N N 15 119.0 0.3 . 9 . . . . . 430 ASP N . 50785 1 466 . 1 . 1 344 344 SER C C 13 175.1 0.2 . 9 . . . . . 433 SER CO . 50785 1 467 . 1 . 1 344 344 SER CA C 13 57.9 0.2 . 9 . . . . . 433 SER CA . 50785 1 468 . 1 . 1 344 344 SER CB C 13 63.0 0.1 . 9 . . . . . 433 SER CB . 50785 1 469 . 1 . 1 344 344 SER N N 15 120.2 0.3 . 9 . . . . . 433 SER N . 50785 1 470 . 1 . 1 345 345 ALA C C 13 174.8 0.2 . 1 . . . . . 434 ALA CO . 50785 1 471 . 1 . 1 345 345 ALA CA C 13 49.8 0.1 . 1 . . . . . 434 ALA CA . 50785 1 472 . 1 . 1 345 345 ALA CB C 13 22.3 0.1 . 1 . . . . . 434 ALA CB . 50785 1 473 . 1 . 1 345 345 ALA N N 15 124.3 0.2 . 1 . . . . . 434 ALA N . 50785 1 474 . 1 . 1 346 346 SER CA C 13 54.2 0.2 . 9 . . . . . 435 SER CA . 50785 1 475 . 1 . 1 346 346 SER CB C 13 64.5 0.0 . 9 . . . . . 435 SER CB . 50785 1 476 . 1 . 1 346 346 SER N N 15 121.0 0.2 . 9 . . . . . 435 SER N . 50785 1 477 . 1 . 1 347 347 LEU C C 13 172.9 0.2 . 9 . . . . . 436 LEU CO . 50785 1 478 . 1 . 1 347 347 LEU CA C 13 55.2 0.1 . 9 . . . . . 436 LEU CA . 50785 1 479 . 1 . 1 347 347 LEU CB C 13 40.9 0.3 . 9 . . . . . 436 LEU CB . 50785 1 480 . 1 . 1 347 347 LEU CG C 13 28.0 0.2 . 9 . . . . . 436 LEU CG . 50785 1 481 . 1 . 1 347 347 LEU CD1 C 13 25.5 0.1 . 9 . . . . . 436 LEU CD . 50785 1 482 . 1 . 1 347 347 LEU CD2 C 13 25.5 0.1 . 9 . . . . . 436 LEU CD . 50785 1 483 . 1 . 1 347 347 LEU N N 15 124.2 0.3 . 9 . . . . . 436 LEU N . 50785 1 484 . 1 . 1 348 348 ALA C C 13 176.0 0.1 . 1 . . . . . 437 ALA CO . 50785 1 485 . 1 . 1 348 348 ALA CA C 13 50.5 0.2 . 1 . . . . . 437 ALA CA . 50785 1 486 . 1 . 1 348 348 ALA CB C 13 21.9 0.1 . 1 . . . . . 437 ALA CB . 50785 1 487 . 1 . 1 348 348 ALA N N 15 128.5 0.4 . 1 . . . . . 437 ALA N . 50785 1 488 . 1 . 1 349 349 LYS C C 13 173.0 0.2 . 1 . . . . . 438 LYS CO . 50785 1 489 . 1 . 1 349 349 LYS CA C 13 57.9 0.2 . 1 . . . . . 438 LYS CA . 50785 1 490 . 1 . 1 349 349 LYS CB C 13 33.6 0.1 . 1 . . . . . 438 LYS CB . 50785 1 491 . 1 . 1 349 349 LYS CG C 13 22.1 0.1 . 1 . . . . . 438 LYS CG . 50785 1 492 . 1 . 1 349 349 LYS CD C 13 28.6 0.1 . 1 . . . . . 438 LYS CD . 50785 1 493 . 1 . 1 349 349 LYS CE C 13 45.1 0.0 . 1 . . . . . 438 LYS CE . 50785 1 494 . 1 . 1 349 349 LYS N N 15 125.6 0.3 . 1 . . . . . 438 LYS N . 50785 1 495 . 1 . 1 350 350 GLN C C 13 174.2 0.0 . 1 . . . . . 439 GLN CO . 50785 1 496 . 1 . 1 350 350 GLN CA C 13 54.3 0.2 . 1 . . . . . 439 GLN CA . 50785 1 497 . 1 . 1 350 350 GLN CB C 13 36.3 0.1 . 1 . . . . . 439 GLN CB . 50785 1 498 . 1 . 1 350 350 GLN CG C 13 35.3 0.1 . 1 . . . . . 439 GLN CG . 50785 1 499 . 1 . 1 350 350 GLN CD C 13 179.6 0.0 . 1 . . . . . 439 GLN CD . 50785 1 500 . 1 . 1 350 350 GLN N N 15 122.4 0.5 . 1 . . . . . 439 GLN N . 50785 1 501 . 1 . 1 351 351 GLY C C 13 168.2 0.0 . 1 . . . . . 440 GLY CO . 50785 1 502 . 1 . 1 351 351 GLY CA C 13 43.9 0.1 . 1 . . . . . 440 GLY CA . 50785 1 503 . 1 . 1 351 351 GLY N N 15 114.7 0.2 . 1 . . . . . 440 GLY N . 50785 1 504 . 1 . 1 352 352 LEU C C 13 178.8 0.1 . 1 . . . . . 441 LEU CO . 50785 1 505 . 1 . 1 352 352 LEU CA C 13 52.5 0.2 . 1 . . . . . 441 LEU CA . 50785 1 506 . 1 . 1 352 352 LEU CB C 13 43.7 0.0 . 1 . . . . . 441 LEU CB . 50785 1 507 . 1 . 1 352 352 LEU N N 15 118.4 0.4 . 1 . . . . . 441 LEU N . 50785 1 stop_ save_