data_50701 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50701 _Entry.Title ; htau40 assignment ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-01-07 _Entry.Accession_date 2021-01-07 _Entry.Last_release_date 2021-02-05 _Entry.Original_release_date 2021-02-05 _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 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 ; 1H/15N chemical shifts assignment for htau40 (ref. to https://pure.mpg.de/rest/items/item_958636_3/component/file_2182227/content) ; _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 'Anna Siegert' Zweckstetter . . . . 50701 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Translationale strukturelle Biologie der Demenz' . 50701 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50701 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 362 50701 '1H chemical shifts' 362 50701 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 . . 2021-02-11 . original BMRB . 50701 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50701 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 20687558 _Citation.DOI 10.1021/ja105657f _Citation.Full_citation . _Citation.Title ; Automatic assignment of the intrinsically disordered protein Tau with 441-residues. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full 'Journal of the American Chemical Society' _Citation.Journal_volume 132 _Citation.Journal_issue 34 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-5126 _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 11906 _Citation.Page_last 11907 _Citation.Year 2010 _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 Rhagavendran Narayanan R. L. . . 50701 1 2 Ulrich Durr U. H. . . 50701 1 3 Stefan Bibow S. . . . 50701 1 4 Jacek Biernat J. . . . 50701 1 5 Eckhard Mandelkow E. . . . 50701 1 6 Markus Zweckstetter M. . . . 50701 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50701 _Assembly.ID 1 _Assembly.Name htau40 _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 htau40 1 $entity_1 . . yes native no no . . . 50701 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50701 _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 AGLKESPLQTPTEDGSEEPG SETSDAKSTPTAEDVTAPLV DEGAPGKQAAAQPHTEIPEG TTAEEAGIGDTPSLEDEAAG HVTQARMVSKSKDGTGSDDK KAKGADGKTKIATPRGAAPP GQKGQANATRIPAKTPPAPK TPPSSGEPPKSGDRSGYSSP GSPGTPGSRSRTPSLPTPPT REPKKVAVVRTPPKSPSSAK SRLQTAPVPMPDLKNVKSKI GSTENLKHQPGGGKVQIINK KLDLSNVQSKCGSKDNIKHV PGGGSVQIVYKPVDLSKVTS KCGSLGNIHHKPGGGQVEVK SEKLDFKDRVQSKIGSLDNI THVPGGGNKKIETHKLTFRE NAKAKTDHGAEIVYKSPVVS GDTSPRHLSNVSSTGSIDMV DSPQLATLADEVSASLAKQG L ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _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 441 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment htau40 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 45849.91 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Promotes microtubule assembly and stability, and might be involved in the establishment and maintenance of neuronal polarity.' 50701 1 stop_ 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 . MET . 50701 1 2 . ALA . 50701 1 3 . GLU . 50701 1 4 . PRO . 50701 1 5 . ARG . 50701 1 6 . GLN . 50701 1 7 . GLU . 50701 1 8 . PHE . 50701 1 9 . GLU . 50701 1 10 . VAL . 50701 1 11 . MET . 50701 1 12 . GLU . 50701 1 13 . ASP . 50701 1 14 . HIS . 50701 1 15 . ALA . 50701 1 16 . GLY . 50701 1 17 . THR . 50701 1 18 . TYR . 50701 1 19 . GLY . 50701 1 20 . LEU . 50701 1 21 . GLY . 50701 1 22 . ASP . 50701 1 23 . ARG . 50701 1 24 . LYS . 50701 1 25 . ASP . 50701 1 26 . GLN . 50701 1 27 . GLY . 50701 1 28 . GLY . 50701 1 29 . TYR . 50701 1 30 . THR . 50701 1 31 . MET . 50701 1 32 . HIS . 50701 1 33 . GLN . 50701 1 34 . ASP . 50701 1 35 . GLN . 50701 1 36 . GLU . 50701 1 37 . GLY . 50701 1 38 . ASP . 50701 1 39 . THR . 50701 1 40 . ASP . 50701 1 41 . ALA . 50701 1 42 . GLY . 50701 1 43 . LEU . 50701 1 44 . LYS . 50701 1 45 . GLU . 50701 1 46 . SER . 50701 1 47 . PRO . 50701 1 48 . LEU . 50701 1 49 . GLN . 50701 1 50 . THR . 50701 1 51 . PRO . 50701 1 52 . THR . 50701 1 53 . GLU . 50701 1 54 . ASP . 50701 1 55 . GLY . 50701 1 56 . SER . 50701 1 57 . GLU . 50701 1 58 . GLU . 50701 1 59 . PRO . 50701 1 60 . GLY . 50701 1 61 . SER . 50701 1 62 . GLU . 50701 1 63 . THR . 50701 1 64 . SER . 50701 1 65 . ASP . 50701 1 66 . ALA . 50701 1 67 . LYS . 50701 1 68 . SER . 50701 1 69 . THR . 50701 1 70 . PRO . 50701 1 71 . THR . 50701 1 72 . ALA . 50701 1 73 . GLU . 50701 1 74 . ASP . 50701 1 75 . VAL . 50701 1 76 . THR . 50701 1 77 . ALA . 50701 1 78 . PRO . 50701 1 79 . LEU . 50701 1 80 . VAL . 50701 1 81 . ASP . 50701 1 82 . GLU . 50701 1 83 . GLY . 50701 1 84 . ALA . 50701 1 85 . PRO . 50701 1 86 . GLY . 50701 1 87 . LYS . 50701 1 88 . GLN . 50701 1 89 . ALA . 50701 1 90 . ALA . 50701 1 91 . ALA . 50701 1 92 . GLN . 50701 1 93 . PRO . 50701 1 94 . HIS . 50701 1 95 . THR . 50701 1 96 . GLU . 50701 1 97 . ILE . 50701 1 98 . PRO . 50701 1 99 . GLU . 50701 1 100 . GLY . 50701 1 101 . THR . 50701 1 102 . THR . 50701 1 103 . ALA . 50701 1 104 . GLU . 50701 1 105 . GLU . 50701 1 106 . ALA . 50701 1 107 . GLY . 50701 1 108 . ILE . 50701 1 109 . GLY . 50701 1 110 . ASP . 50701 1 111 . THR . 50701 1 112 . PRO . 50701 1 113 . SER . 50701 1 114 . LEU . 50701 1 115 . GLU . 50701 1 116 . ASP . 50701 1 117 . GLU . 50701 1 118 . ALA . 50701 1 119 . ALA . 50701 1 120 . GLY . 50701 1 121 . HIS . 50701 1 122 . VAL . 50701 1 123 . THR . 50701 1 124 . GLN . 50701 1 125 . ALA . 50701 1 126 . ARG . 50701 1 127 . MET . 50701 1 128 . VAL . 50701 1 129 . SER . 50701 1 130 . LYS . 50701 1 131 . SER . 50701 1 132 . LYS . 50701 1 133 . ASP . 50701 1 134 . GLY . 50701 1 135 . THR . 50701 1 136 . GLY . 50701 1 137 . SER . 50701 1 138 . ASP . 50701 1 139 . ASP . 50701 1 140 . LYS . 50701 1 141 . LYS . 50701 1 142 . ALA . 50701 1 143 . LYS . 50701 1 144 . GLY . 50701 1 145 . ALA . 50701 1 146 . ASP . 50701 1 147 . GLY . 50701 1 148 . LYS . 50701 1 149 . THR . 50701 1 150 . LYS . 50701 1 151 . ILE . 50701 1 152 . ALA . 50701 1 153 . THR . 50701 1 154 . PRO . 50701 1 155 . ARG . 50701 1 156 . GLY . 50701 1 157 . ALA . 50701 1 158 . ALA . 50701 1 159 . PRO . 50701 1 160 . PRO . 50701 1 161 . GLY . 50701 1 162 . GLN . 50701 1 163 . LYS . 50701 1 164 . GLY . 50701 1 165 . GLN . 50701 1 166 . ALA . 50701 1 167 . ASN . 50701 1 168 . ALA . 50701 1 169 . THR . 50701 1 170 . ARG . 50701 1 171 . ILE . 50701 1 172 . PRO . 50701 1 173 . ALA . 50701 1 174 . LYS . 50701 1 175 . THR . 50701 1 176 . PRO . 50701 1 177 . PRO . 50701 1 178 . ALA . 50701 1 179 . PRO . 50701 1 180 . LYS . 50701 1 181 . THR . 50701 1 182 . PRO . 50701 1 183 . PRO . 50701 1 184 . SER . 50701 1 185 . SER . 50701 1 186 . GLY . 50701 1 187 . GLU . 50701 1 188 . PRO . 50701 1 189 . PRO . 50701 1 190 . LYS . 50701 1 191 . SER . 50701 1 192 . GLY . 50701 1 193 . ASP . 50701 1 194 . ARG . 50701 1 195 . SER . 50701 1 196 . GLY . 50701 1 197 . TYR . 50701 1 198 . SER . 50701 1 199 . SER . 50701 1 200 . PRO . 50701 1 201 . GLY . 50701 1 202 . SER . 50701 1 203 . PRO . 50701 1 204 . GLY . 50701 1 205 . THR . 50701 1 206 . PRO . 50701 1 207 . GLY . 50701 1 208 . SER . 50701 1 209 . ARG . 50701 1 210 . SER . 50701 1 211 . ARG . 50701 1 212 . THR . 50701 1 213 . PRO . 50701 1 214 . SER . 50701 1 215 . LEU . 50701 1 216 . PRO . 50701 1 217 . THR . 50701 1 218 . PRO . 50701 1 219 . PRO . 50701 1 220 . THR . 50701 1 221 . ARG . 50701 1 222 . GLU . 50701 1 223 . PRO . 50701 1 224 . LYS . 50701 1 225 . LYS . 50701 1 226 . VAL . 50701 1 227 . ALA . 50701 1 228 . VAL . 50701 1 229 . VAL . 50701 1 230 . ARG . 50701 1 231 . THR . 50701 1 232 . PRO . 50701 1 233 . PRO . 50701 1 234 . LYS . 50701 1 235 . SER . 50701 1 236 . PRO . 50701 1 237 . SER . 50701 1 238 . SER . 50701 1 239 . ALA . 50701 1 240 . LYS . 50701 1 241 . SER . 50701 1 242 . ARG . 50701 1 243 . LEU . 50701 1 244 . GLN . 50701 1 245 . THR . 50701 1 246 . ALA . 50701 1 247 . PRO . 50701 1 248 . VAL . 50701 1 249 . PRO . 50701 1 250 . MET . 50701 1 251 . PRO . 50701 1 252 . ASP . 50701 1 253 . LEU . 50701 1 254 . LYS . 50701 1 255 . ASN . 50701 1 256 . VAL . 50701 1 257 . LYS . 50701 1 258 . SER . 50701 1 259 . LYS . 50701 1 260 . ILE . 50701 1 261 . GLY . 50701 1 262 . SER . 50701 1 263 . THR . 50701 1 264 . GLU . 50701 1 265 . ASN . 50701 1 266 . LEU . 50701 1 267 . LYS . 50701 1 268 . HIS . 50701 1 269 . GLN . 50701 1 270 . PRO . 50701 1 271 . GLY . 50701 1 272 . GLY . 50701 1 273 . GLY . 50701 1 274 . LYS . 50701 1 275 . VAL . 50701 1 276 . GLN . 50701 1 277 . ILE . 50701 1 278 . ILE . 50701 1 279 . ASN . 50701 1 280 . LYS . 50701 1 281 . LYS . 50701 1 282 . LEU . 50701 1 283 . ASP . 50701 1 284 . LEU . 50701 1 285 . SER . 50701 1 286 . ASN . 50701 1 287 . VAL . 50701 1 288 . GLN . 50701 1 289 . SER . 50701 1 290 . LYS . 50701 1 291 . CYS . 50701 1 292 . GLY . 50701 1 293 . SER . 50701 1 294 . LYS . 50701 1 295 . ASP . 50701 1 296 . ASN . 50701 1 297 . ILE . 50701 1 298 . LYS . 50701 1 299 . HIS . 50701 1 300 . VAL . 50701 1 301 . PRO . 50701 1 302 . GLY . 50701 1 303 . GLY . 50701 1 304 . GLY . 50701 1 305 . SER . 50701 1 306 . VAL . 50701 1 307 . GLN . 50701 1 308 . ILE . 50701 1 309 . VAL . 50701 1 310 . TYR . 50701 1 311 . LYS . 50701 1 312 . PRO . 50701 1 313 . VAL . 50701 1 314 . ASP . 50701 1 315 . LEU . 50701 1 316 . SER . 50701 1 317 . LYS . 50701 1 318 . VAL . 50701 1 319 . THR . 50701 1 320 . SER . 50701 1 321 . LYS . 50701 1 322 . CYS . 50701 1 323 . GLY . 50701 1 324 . SER . 50701 1 325 . LEU . 50701 1 326 . GLY . 50701 1 327 . ASN . 50701 1 328 . ILE . 50701 1 329 . HIS . 50701 1 330 . HIS . 50701 1 331 . LYS . 50701 1 332 . PRO . 50701 1 333 . GLY . 50701 1 334 . GLY . 50701 1 335 . GLY . 50701 1 336 . GLN . 50701 1 337 . VAL . 50701 1 338 . GLU . 50701 1 339 . VAL . 50701 1 340 . LYS . 50701 1 341 . SER . 50701 1 342 . GLU . 50701 1 343 . LYS . 50701 1 344 . LEU . 50701 1 345 . ASP . 50701 1 346 . PHE . 50701 1 347 . LYS . 50701 1 348 . ASP . 50701 1 349 . ARG . 50701 1 350 . VAL . 50701 1 351 . GLN . 50701 1 352 . SER . 50701 1 353 . LYS . 50701 1 354 . ILE . 50701 1 355 . GLY . 50701 1 356 . SER . 50701 1 357 . LEU . 50701 1 358 . ASP . 50701 1 359 . ASN . 50701 1 360 . ILE . 50701 1 361 . THR . 50701 1 362 . HIS . 50701 1 363 . VAL . 50701 1 364 . PRO . 50701 1 365 . GLY . 50701 1 366 . GLY . 50701 1 367 . GLY . 50701 1 368 . ASN . 50701 1 369 . LYS . 50701 1 370 . LYS . 50701 1 371 . ILE . 50701 1 372 . GLU . 50701 1 373 . THR . 50701 1 374 . HIS . 50701 1 375 . LYS . 50701 1 376 . LEU . 50701 1 377 . THR . 50701 1 378 . PHE . 50701 1 379 . ARG . 50701 1 380 . GLU . 50701 1 381 . ASN . 50701 1 382 . ALA . 50701 1 383 . LYS . 50701 1 384 . ALA . 50701 1 385 . LYS . 50701 1 386 . THR . 50701 1 387 . ASP . 50701 1 388 . HIS . 50701 1 389 . GLY . 50701 1 390 . ALA . 50701 1 391 . GLU . 50701 1 392 . ILE . 50701 1 393 . VAL . 50701 1 394 . TYR . 50701 1 395 . LYS . 50701 1 396 . SER . 50701 1 397 . PRO . 50701 1 398 . VAL . 50701 1 399 . VAL . 50701 1 400 . SER . 50701 1 401 . GLY . 50701 1 402 . ASP . 50701 1 403 . THR . 50701 1 404 . SER . 50701 1 405 . PRO . 50701 1 406 . ARG . 50701 1 407 . HIS . 50701 1 408 . LEU . 50701 1 409 . SER . 50701 1 410 . ASN . 50701 1 411 . VAL . 50701 1 412 . SER . 50701 1 413 . SER . 50701 1 414 . THR . 50701 1 415 . GLY . 50701 1 416 . SER . 50701 1 417 . ILE . 50701 1 418 . ASP . 50701 1 419 . MET . 50701 1 420 . VAL . 50701 1 421 . ASP . 50701 1 422 . SER . 50701 1 423 . PRO . 50701 1 424 . GLN . 50701 1 425 . LEU . 50701 1 426 . ALA . 50701 1 427 . THR . 50701 1 428 . LEU . 50701 1 429 . ALA . 50701 1 430 . ASP . 50701 1 431 . GLU . 50701 1 432 . VAL . 50701 1 433 . SER . 50701 1 434 . ALA . 50701 1 435 . SER . 50701 1 436 . LEU . 50701 1 437 . ALA . 50701 1 438 . LYS . 50701 1 439 . GLN . 50701 1 440 . GLY . 50701 1 441 . LEU . 50701 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 50701 1 . ALA 2 2 50701 1 . GLU 3 3 50701 1 . PRO 4 4 50701 1 . ARG 5 5 50701 1 . GLN 6 6 50701 1 . GLU 7 7 50701 1 . PHE 8 8 50701 1 . GLU 9 9 50701 1 . VAL 10 10 50701 1 . MET 11 11 50701 1 . GLU 12 12 50701 1 . ASP 13 13 50701 1 . HIS 14 14 50701 1 . ALA 15 15 50701 1 . GLY 16 16 50701 1 . THR 17 17 50701 1 . TYR 18 18 50701 1 . GLY 19 19 50701 1 . LEU 20 20 50701 1 . GLY 21 21 50701 1 . ASP 22 22 50701 1 . ARG 23 23 50701 1 . LYS 24 24 50701 1 . ASP 25 25 50701 1 . GLN 26 26 50701 1 . GLY 27 27 50701 1 . GLY 28 28 50701 1 . TYR 29 29 50701 1 . THR 30 30 50701 1 . MET 31 31 50701 1 . HIS 32 32 50701 1 . GLN 33 33 50701 1 . ASP 34 34 50701 1 . GLN 35 35 50701 1 . GLU 36 36 50701 1 . GLY 37 37 50701 1 . ASP 38 38 50701 1 . THR 39 39 50701 1 . ASP 40 40 50701 1 . ALA 41 41 50701 1 . GLY 42 42 50701 1 . LEU 43 43 50701 1 . LYS 44 44 50701 1 . GLU 45 45 50701 1 . SER 46 46 50701 1 . PRO 47 47 50701 1 . LEU 48 48 50701 1 . GLN 49 49 50701 1 . THR 50 50 50701 1 . PRO 51 51 50701 1 . THR 52 52 50701 1 . GLU 53 53 50701 1 . ASP 54 54 50701 1 . GLY 55 55 50701 1 . SER 56 56 50701 1 . GLU 57 57 50701 1 . GLU 58 58 50701 1 . PRO 59 59 50701 1 . GLY 60 60 50701 1 . SER 61 61 50701 1 . GLU 62 62 50701 1 . THR 63 63 50701 1 . SER 64 64 50701 1 . ASP 65 65 50701 1 . ALA 66 66 50701 1 . LYS 67 67 50701 1 . SER 68 68 50701 1 . THR 69 69 50701 1 . PRO 70 70 50701 1 . THR 71 71 50701 1 . ALA 72 72 50701 1 . GLU 73 73 50701 1 . ASP 74 74 50701 1 . VAL 75 75 50701 1 . THR 76 76 50701 1 . ALA 77 77 50701 1 . PRO 78 78 50701 1 . LEU 79 79 50701 1 . VAL 80 80 50701 1 . ASP 81 81 50701 1 . GLU 82 82 50701 1 . GLY 83 83 50701 1 . ALA 84 84 50701 1 . PRO 85 85 50701 1 . GLY 86 86 50701 1 . LYS 87 87 50701 1 . GLN 88 88 50701 1 . ALA 89 89 50701 1 . ALA 90 90 50701 1 . ALA 91 91 50701 1 . GLN 92 92 50701 1 . PRO 93 93 50701 1 . HIS 94 94 50701 1 . THR 95 95 50701 1 . GLU 96 96 50701 1 . ILE 97 97 50701 1 . PRO 98 98 50701 1 . GLU 99 99 50701 1 . GLY 100 100 50701 1 . THR 101 101 50701 1 . THR 102 102 50701 1 . ALA 103 103 50701 1 . GLU 104 104 50701 1 . GLU 105 105 50701 1 . ALA 106 106 50701 1 . GLY 107 107 50701 1 . ILE 108 108 50701 1 . GLY 109 109 50701 1 . ASP 110 110 50701 1 . THR 111 111 50701 1 . PRO 112 112 50701 1 . SER 113 113 50701 1 . LEU 114 114 50701 1 . GLU 115 115 50701 1 . ASP 116 116 50701 1 . GLU 117 117 50701 1 . ALA 118 118 50701 1 . ALA 119 119 50701 1 . GLY 120 120 50701 1 . HIS 121 121 50701 1 . VAL 122 122 50701 1 . THR 123 123 50701 1 . GLN 124 124 50701 1 . ALA 125 125 50701 1 . ARG 126 126 50701 1 . MET 127 127 50701 1 . VAL 128 128 50701 1 . SER 129 129 50701 1 . LYS 130 130 50701 1 . SER 131 131 50701 1 . LYS 132 132 50701 1 . ASP 133 133 50701 1 . GLY 134 134 50701 1 . THR 135 135 50701 1 . GLY 136 136 50701 1 . SER 137 137 50701 1 . ASP 138 138 50701 1 . ASP 139 139 50701 1 . LYS 140 140 50701 1 . LYS 141 141 50701 1 . ALA 142 142 50701 1 . LYS 143 143 50701 1 . GLY 144 144 50701 1 . ALA 145 145 50701 1 . ASP 146 146 50701 1 . GLY 147 147 50701 1 . LYS 148 148 50701 1 . THR 149 149 50701 1 . LYS 150 150 50701 1 . ILE 151 151 50701 1 . ALA 152 152 50701 1 . THR 153 153 50701 1 . PRO 154 154 50701 1 . ARG 155 155 50701 1 . GLY 156 156 50701 1 . ALA 157 157 50701 1 . ALA 158 158 50701 1 . PRO 159 159 50701 1 . PRO 160 160 50701 1 . GLY 161 161 50701 1 . GLN 162 162 50701 1 . LYS 163 163 50701 1 . GLY 164 164 50701 1 . GLN 165 165 50701 1 . ALA 166 166 50701 1 . ASN 167 167 50701 1 . ALA 168 168 50701 1 . THR 169 169 50701 1 . ARG 170 170 50701 1 . ILE 171 171 50701 1 . PRO 172 172 50701 1 . ALA 173 173 50701 1 . LYS 174 174 50701 1 . THR 175 175 50701 1 . PRO 176 176 50701 1 . PRO 177 177 50701 1 . ALA 178 178 50701 1 . PRO 179 179 50701 1 . LYS 180 180 50701 1 . THR 181 181 50701 1 . PRO 182 182 50701 1 . PRO 183 183 50701 1 . SER 184 184 50701 1 . SER 185 185 50701 1 . GLY 186 186 50701 1 . GLU 187 187 50701 1 . PRO 188 188 50701 1 . PRO 189 189 50701 1 . LYS 190 190 50701 1 . SER 191 191 50701 1 . GLY 192 192 50701 1 . ASP 193 193 50701 1 . ARG 194 194 50701 1 . SER 195 195 50701 1 . GLY 196 196 50701 1 . TYR 197 197 50701 1 . SER 198 198 50701 1 . SER 199 199 50701 1 . PRO 200 200 50701 1 . GLY 201 201 50701 1 . SER 202 202 50701 1 . PRO 203 203 50701 1 . GLY 204 204 50701 1 . THR 205 205 50701 1 . PRO 206 206 50701 1 . GLY 207 207 50701 1 . SER 208 208 50701 1 . ARG 209 209 50701 1 . SER 210 210 50701 1 . ARG 211 211 50701 1 . THR 212 212 50701 1 . PRO 213 213 50701 1 . SER 214 214 50701 1 . LEU 215 215 50701 1 . PRO 216 216 50701 1 . THR 217 217 50701 1 . PRO 218 218 50701 1 . PRO 219 219 50701 1 . THR 220 220 50701 1 . ARG 221 221 50701 1 . GLU 222 222 50701 1 . PRO 223 223 50701 1 . LYS 224 224 50701 1 . LYS 225 225 50701 1 . VAL 226 226 50701 1 . ALA 227 227 50701 1 . VAL 228 228 50701 1 . VAL 229 229 50701 1 . ARG 230 230 50701 1 . THR 231 231 50701 1 . PRO 232 232 50701 1 . PRO 233 233 50701 1 . LYS 234 234 50701 1 . SER 235 235 50701 1 . PRO 236 236 50701 1 . SER 237 237 50701 1 . SER 238 238 50701 1 . ALA 239 239 50701 1 . LYS 240 240 50701 1 . SER 241 241 50701 1 . ARG 242 242 50701 1 . LEU 243 243 50701 1 . GLN 244 244 50701 1 . THR 245 245 50701 1 . ALA 246 246 50701 1 . PRO 247 247 50701 1 . VAL 248 248 50701 1 . PRO 249 249 50701 1 . MET 250 250 50701 1 . PRO 251 251 50701 1 . ASP 252 252 50701 1 . LEU 253 253 50701 1 . LYS 254 254 50701 1 . ASN 255 255 50701 1 . VAL 256 256 50701 1 . LYS 257 257 50701 1 . SER 258 258 50701 1 . LYS 259 259 50701 1 . ILE 260 260 50701 1 . GLY 261 261 50701 1 . SER 262 262 50701 1 . THR 263 263 50701 1 . GLU 264 264 50701 1 . ASN 265 265 50701 1 . LEU 266 266 50701 1 . LYS 267 267 50701 1 . HIS 268 268 50701 1 . GLN 269 269 50701 1 . PRO 270 270 50701 1 . GLY 271 271 50701 1 . GLY 272 272 50701 1 . GLY 273 273 50701 1 . LYS 274 274 50701 1 . VAL 275 275 50701 1 . GLN 276 276 50701 1 . ILE 277 277 50701 1 . ILE 278 278 50701 1 . ASN 279 279 50701 1 . LYS 280 280 50701 1 . LYS 281 281 50701 1 . LEU 282 282 50701 1 . ASP 283 283 50701 1 . LEU 284 284 50701 1 . SER 285 285 50701 1 . ASN 286 286 50701 1 . VAL 287 287 50701 1 . GLN 288 288 50701 1 . SER 289 289 50701 1 . LYS 290 290 50701 1 . CYS 291 291 50701 1 . GLY 292 292 50701 1 . SER 293 293 50701 1 . LYS 294 294 50701 1 . ASP 295 295 50701 1 . ASN 296 296 50701 1 . ILE 297 297 50701 1 . LYS 298 298 50701 1 . HIS 299 299 50701 1 . VAL 300 300 50701 1 . PRO 301 301 50701 1 . GLY 302 302 50701 1 . GLY 303 303 50701 1 . GLY 304 304 50701 1 . SER 305 305 50701 1 . VAL 306 306 50701 1 . GLN 307 307 50701 1 . ILE 308 308 50701 1 . VAL 309 309 50701 1 . TYR 310 310 50701 1 . LYS 311 311 50701 1 . PRO 312 312 50701 1 . VAL 313 313 50701 1 . ASP 314 314 50701 1 . LEU 315 315 50701 1 . SER 316 316 50701 1 . LYS 317 317 50701 1 . VAL 318 318 50701 1 . THR 319 319 50701 1 . SER 320 320 50701 1 . LYS 321 321 50701 1 . CYS 322 322 50701 1 . GLY 323 323 50701 1 . SER 324 324 50701 1 . LEU 325 325 50701 1 . GLY 326 326 50701 1 . ASN 327 327 50701 1 . ILE 328 328 50701 1 . HIS 329 329 50701 1 . HIS 330 330 50701 1 . LYS 331 331 50701 1 . PRO 332 332 50701 1 . GLY 333 333 50701 1 . GLY 334 334 50701 1 . GLY 335 335 50701 1 . GLN 336 336 50701 1 . VAL 337 337 50701 1 . GLU 338 338 50701 1 . VAL 339 339 50701 1 . LYS 340 340 50701 1 . SER 341 341 50701 1 . GLU 342 342 50701 1 . LYS 343 343 50701 1 . LEU 344 344 50701 1 . ASP 345 345 50701 1 . PHE 346 346 50701 1 . LYS 347 347 50701 1 . ASP 348 348 50701 1 . ARG 349 349 50701 1 . VAL 350 350 50701 1 . GLN 351 351 50701 1 . SER 352 352 50701 1 . LYS 353 353 50701 1 . ILE 354 354 50701 1 . GLY 355 355 50701 1 . SER 356 356 50701 1 . LEU 357 357 50701 1 . ASP 358 358 50701 1 . ASN 359 359 50701 1 . ILE 360 360 50701 1 . THR 361 361 50701 1 . HIS 362 362 50701 1 . VAL 363 363 50701 1 . PRO 364 364 50701 1 . GLY 365 365 50701 1 . GLY 366 366 50701 1 . GLY 367 367 50701 1 . ASN 368 368 50701 1 . LYS 369 369 50701 1 . LYS 370 370 50701 1 . ILE 371 371 50701 1 . GLU 372 372 50701 1 . THR 373 373 50701 1 . HIS 374 374 50701 1 . LYS 375 375 50701 1 . LEU 376 376 50701 1 . THR 377 377 50701 1 . PHE 378 378 50701 1 . ARG 379 379 50701 1 . GLU 380 380 50701 1 . ASN 381 381 50701 1 . ALA 382 382 50701 1 . LYS 383 383 50701 1 . ALA 384 384 50701 1 . LYS 385 385 50701 1 . THR 386 386 50701 1 . ASP 387 387 50701 1 . HIS 388 388 50701 1 . GLY 389 389 50701 1 . ALA 390 390 50701 1 . GLU 391 391 50701 1 . ILE 392 392 50701 1 . VAL 393 393 50701 1 . TYR 394 394 50701 1 . LYS 395 395 50701 1 . SER 396 396 50701 1 . PRO 397 397 50701 1 . VAL 398 398 50701 1 . VAL 399 399 50701 1 . SER 400 400 50701 1 . GLY 401 401 50701 1 . ASP 402 402 50701 1 . THR 403 403 50701 1 . SER 404 404 50701 1 . PRO 405 405 50701 1 . ARG 406 406 50701 1 . HIS 407 407 50701 1 . LEU 408 408 50701 1 . SER 409 409 50701 1 . ASN 410 410 50701 1 . VAL 411 411 50701 1 . SER 412 412 50701 1 . SER 413 413 50701 1 . THR 414 414 50701 1 . GLY 415 415 50701 1 . SER 416 416 50701 1 . ILE 417 417 50701 1 . ASP 418 418 50701 1 . MET 419 419 50701 1 . VAL 420 420 50701 1 . ASP 421 421 50701 1 . SER 422 422 50701 1 . PRO 423 423 50701 1 . GLN 424 424 50701 1 . LEU 425 425 50701 1 . ALA 426 426 50701 1 . THR 427 427 50701 1 . LEU 428 428 50701 1 . ALA 429 429 50701 1 . ASP 430 430 50701 1 . GLU 431 431 50701 1 . VAL 432 432 50701 1 . SER 433 433 50701 1 . ALA 434 434 50701 1 . SER 435 435 50701 1 . LEU 436 436 50701 1 . ALA 437 437 50701 1 . LYS 438 438 50701 1 . GLN 439 439 50701 1 . GLY 440 440 50701 1 . LEU 441 441 50701 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 50701 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 50701 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 50701 _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 BL21DE3 . . plasmid . . pNG2 . . . 50701 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50701 _Sample.ID 1 _Sample.Name 15N13C-htau40 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'Microtubule-associated protein tau' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1.3 . . mM . . . . 50701 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 50701 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'NMR ample 15-13CNhtau40' _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' 0.05 . M 50701 1 pH 6.0 . pH 50701 1 pressure 1 . atm 50701 1 temperature 278 . K 50701 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50701 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version 9.9 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50701 1 'chemical shift calculation' . 50701 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50701 _Software.ID 2 _Software.Type . _Software.Name MARS _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50701 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50701 _Software.ID 3 _Software.Type . _Software.Name PROSA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 50701 3 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 50701 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '900 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 50701 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 800MHz _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _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 50701 _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 APSY no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50701 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 50701 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'reference htau40' _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 H 1 DSS 'methyl protons' . . . . ppm 10 na direct 1 . . . . . 50701 1 N 15 DSS 'methyl nitrogen' . . . . ppm 30 na indirect 1 . . . . . 50701 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 50701 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '15N-hTau40 chemical shift bacbone' _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 APSY . . . 50701 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 . . 50701 1 2 $software_2 . . 50701 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 5 5 ARG H H 1 8.3405 . . . . . . . . 5 ARG HN . 50701 1 2 . 1 . 1 5 5 ARG N N 15 121.3767 . . . . . . . . 5 ARG N . 50701 1 3 . 1 . 1 6 6 GLN H H 1 8.3968 . . . . . . . . 6 GLN HN . 50701 1 4 . 1 . 1 6 6 GLN N N 15 122.2700 . . . . . . . . 6 GLN N . 50701 1 5 . 1 . 1 7 7 GLU H H 1 8.3806 . . . . . . . . 7 GLU HN . 50701 1 6 . 1 . 1 7 7 GLU N N 15 122.1380 . . . . . . . . 7 GLU N . 50701 1 7 . 1 . 1 8 8 PHE H H 1 7.9973 . . . . . . . . 8 PHE HN . 50701 1 8 . 1 . 1 8 8 PHE N N 15 119.3646 . . . . . . . . 8 PHE N . 50701 1 9 . 1 . 1 9 9 GLU H H 1 8.1633 . . . . . . . . 9 GLU HN . 50701 1 10 . 1 . 1 9 9 GLU N N 15 122.1055 . . . . . . . . 9 GLU N . 50701 1 11 . 1 . 1 10 10 VAL H H 1 8.0882 . . . . . . . . 10 VAL HN . 50701 1 12 . 1 . 1 10 10 VAL N N 15 121.4573 . . . . . . . . 10 VAL N . 50701 1 13 . 1 . 1 11 11 MET H H 1 8.3507 . . . . . . . . 11 MET HN . 50701 1 14 . 1 . 1 11 11 MET N N 15 124.4456 . . . . . . . . 11 MET N . 50701 1 15 . 1 . 1 12 12 GLU H H 1 8.3106 . . . . . . . . 12 GLU HN . 50701 1 16 . 1 . 1 12 12 GLU N N 15 122.3751 . . . . . . . . 12 GLU N . 50701 1 17 . 1 . 1 13 13 ASP H H 1 8.2551 . . . . . . . . 13 ASP HN . 50701 1 18 . 1 . 1 13 13 ASP N N 15 121.3604 . . . . . . . . 13 ASP N . 50701 1 19 . 1 . 1 14 14 HIS H H 1 8.3468 . . . . . . . . 14 HIS HN . 50701 1 20 . 1 . 1 14 14 HIS N N 15 119.3808 . . . . . . . . 14 HIS N . 50701 1 21 . 1 . 1 15 15 ALA H H 1 8.2641 . . . . . . . . 15 ALA HN . 50701 1 22 . 1 . 1 15 15 ALA N N 15 124.3066 . . . . . . . . 15 ALA N . 50701 1 23 . 1 . 1 16 16 GLY H H 1 8.3038 . . . . . . . . 16 GLY HN . 50701 1 24 . 1 . 1 16 16 GLY N N 15 107.8808 . . . . . . . . 16 GLY N . 50701 1 25 . 1 . 1 17 17 THR H H 1 7.8759 . . . . . . . . 17 THR HN . 50701 1 26 . 1 . 1 17 17 THR N N 15 113.4247 . . . . . . . . 17 THR N . 50701 1 27 . 1 . 1 18 18 TYR H H 1 8.1864 . . . . . . . . 18 TYR HN . 50701 1 28 . 1 . 1 18 18 TYR N N 15 122.4802 . . . . . . . . 18 TYR N . 50701 1 29 . 1 . 1 19 19 GLY H H 1 8.2492 . . . . . . . . 19 GLY HN . 50701 1 30 . 1 . 1 19 19 GLY N N 15 110.5775 . . . . . . . . 19 GLY N . 50701 1 31 . 1 . 1 20 20 LEU H H 1 7.9937 . . . . . . . . 20 LEU HN . 50701 1 32 . 1 . 1 20 20 LEU N N 15 121.2698 . . . . . . . . 20 LEU N . 50701 1 33 . 1 . 1 21 21 GLY H H 1 8.3345 . . . . . . . . 21 GLY HN . 50701 1 34 . 1 . 1 21 21 GLY N N 15 109.0901 . . . . . . . . 21 GLY N . 50701 1 35 . 1 . 1 22 22 ASP H H 1 8.1152 . . . . . . . . 22 ASP HN . 50701 1 36 . 1 . 1 22 22 ASP N N 15 120.3292 . . . . . . . . 22 ASP N . 50701 1 37 . 1 . 1 23 23 ARG H H 1 8.1729 . . . . . . . . 23 ARG HN . 50701 1 38 . 1 . 1 23 23 ARG N N 15 120.9901 . . . . . . . . 23 ARG N . 50701 1 39 . 1 . 1 24 24 LYS H H 1 8.3045 . . . . . . . . 24 LYS HN . 50701 1 40 . 1 . 1 24 24 LYS N N 15 122.0095 . . . . . . . . 24 LYS N . 50701 1 41 . 1 . 1 25 25 ASP H H 1 8.2600 . . . . . . . . 25 ASP HN . 50701 1 42 . 1 . 1 25 25 ASP N N 15 120.3638 . . . . . . . . 25 ASP N . 50701 1 43 . 1 . 1 26 26 GLN H H 1 8.2063 . . . . . . . . 26 GLN HN . 50701 1 44 . 1 . 1 26 26 GLN N N 15 120.2259 . . . . . . . . 26 GLN N . 50701 1 45 . 1 . 1 27 27 GLY H H 1 8.3519 . . . . . . . . 27 GLY HN . 50701 1 46 . 1 . 1 27 27 GLY N N 15 109.2549 . . . . . . . . 27 GLY N . 50701 1 47 . 1 . 1 28 28 GLY H H 1 8.1252 . . . . . . . . 28 GLY HN . 50701 1 48 . 1 . 1 28 28 GLY N N 15 108.4278 . . . . . . . . 28 GLY N . 50701 1 49 . 1 . 1 29 29 TYR H H 1 7.9787 . . . . . . . . 29 TYR HN . 50701 1 50 . 1 . 1 29 29 TYR N N 15 120.0546 . . . . . . . . 29 TYR N . 50701 1 51 . 1 . 1 30 30 THR H H 1 7.9881 . . . . . . . . 30 THR HN . 50701 1 52 . 1 . 1 30 30 THR N N 15 116.4341 . . . . . . . . 30 THR N . 50701 1 53 . 1 . 1 31 31 MET H H 1 8.1749 . . . . . . . . 31 MET HN . 50701 1 54 . 1 . 1 31 31 MET N N 15 122.6256 . . . . . . . . 31 MET N . 50701 1 55 . 1 . 1 32 32 HIS H H 1 8.4109 . . . . . . . . 32 HIS HN . 50701 1 56 . 1 . 1 32 32 HIS N N 15 120.1125 . . . . . . . . 32 HIS N . 50701 1 57 . 1 . 1 33 33 GLN H H 1 8.3799 . . . . . . . . 33 GLN HN . 50701 1 58 . 1 . 1 33 33 GLN N N 15 122.3467 . . . . . . . . 33 GLN N . 50701 1 59 . 1 . 1 34 34 ASP H H 1 8.4428 . . . . . . . . 34 ASP HN . 50701 1 60 . 1 . 1 34 34 ASP N N 15 121.7407 . . . . . . . . 34 ASP N . 50701 1 61 . 1 . 1 35 35 GLN H H 1 8.2627 . . . . . . . . 35 GLN HN . 50701 1 62 . 1 . 1 35 35 GLN N N 15 119.9487 . . . . . . . . 35 GLN N . 50701 1 63 . 1 . 1 36 36 GLU H H 1 8.3764 . . . . . . . . 36 GLU HN . 50701 1 64 . 1 . 1 36 36 GLU N N 15 122.0407 . . . . . . . . 36 GLU N . 50701 1 65 . 1 . 1 37 37 GLY H H 1 8.3149 . . . . . . . . 37 GLY HN . 50701 1 66 . 1 . 1 37 37 GLY N N 15 109.7525 . . . . . . . . 37 GLY N . 50701 1 67 . 1 . 1 38 38 ASP H H 1 8.1720 . . . . . . . . 38 ASP HN . 50701 1 68 . 1 . 1 38 38 ASP N N 15 120.4912 . . . . . . . . 38 ASP N . 50701 1 69 . 1 . 1 39 39 THR H H 1 8.0987 . . . . . . . . 39 THR HN . 50701 1 70 . 1 . 1 39 39 THR N N 15 114.3782 . . . . . . . . 39 THR N . 50701 1 71 . 1 . 1 40 40 ASP H H 1 8.2922 . . . . . . . . 40 ASP HN . 50701 1 72 . 1 . 1 40 40 ASP N N 15 122.6136 . . . . . . . . 40 ASP N . 50701 1 73 . 1 . 1 41 41 ALA H H 1 8.1399 . . . . . . . . 41 ALA HN . 50701 1 74 . 1 . 1 41 41 ALA N N 15 124.7402 . . . . . . . . 41 ALA N . 50701 1 75 . 1 . 1 42 42 GLY H H 1 8.2917 . . . . . . . . 42 GLY HN . 50701 1 76 . 1 . 1 42 42 GLY N N 15 107.1775 . . . . . . . . 42 GLY N . 50701 1 77 . 1 . 1 43 43 LEU H H 1 7.8446 . . . . . . . . 43 LEU HN . 50701 1 78 . 1 . 1 43 43 LEU N N 15 121.1797 . . . . . . . . 43 LEU N . 50701 1 79 . 1 . 1 44 44 LYS H H 1 8.1327 . . . . . . . . 44 LYS HN . 50701 1 80 . 1 . 1 44 44 LYS N N 15 121.9304 . . . . . . . . 44 LYS N . 50701 1 81 . 1 . 1 45 45 GLU H H 1 8.2305 . . . . . . . . 45 GLU HN . 50701 1 82 . 1 . 1 45 45 GLU N N 15 121.5885 . . . . . . . . 45 GLU N . 50701 1 83 . 1 . 1 46 46 SER H H 1 8.3177 . . . . . . . . 46 SER HN . 50701 1 84 . 1 . 1 46 46 SER N N 15 118.4771 . . . . . . . . 46 SER N . 50701 1 85 . 1 . 1 48 48 LEU H H 1 8.1613 . . . . . . . . 48 LEU HN . 50701 1 86 . 1 . 1 48 48 LEU N N 15 121.9285 . . . . . . . . 48 LEU N . 50701 1 87 . 1 . 1 49 49 GLN H H 1 8.2383 . . . . . . . . 49 GLN HN . 50701 1 88 . 1 . 1 49 49 GLN N N 15 121.3698 . . . . . . . . 49 GLN N . 50701 1 89 . 1 . 1 50 50 THR H H 1 8.1690 . . . . . . . . 50 THR HN . 50701 1 90 . 1 . 1 50 50 THR N N 15 118.5156 . . . . . . . . 50 THR N . 50701 1 91 . 1 . 1 52 52 THR H H 1 8.1956 . . . . . . . . 52 THR HN . 50701 1 92 . 1 . 1 52 52 THR N N 15 114.7981 . . . . . . . . 52 THR N . 50701 1 93 . 1 . 1 53 53 GLU H H 1 8.4036 . . . . . . . . 53 GLU HN . 50701 1 94 . 1 . 1 53 53 GLU N N 15 123.1029 . . . . . . . . 53 GLU N . 50701 1 95 . 1 . 1 54 54 ASP H H 1 8.3280 . . . . . . . . 54 ASP HN . 50701 1 96 . 1 . 1 54 54 ASP N N 15 121.5171 . . . . . . . . 54 ASP N . 50701 1 97 . 1 . 1 55 55 GLY H H 1 8.3452 . . . . . . . . 55 GLY HN . 50701 1 98 . 1 . 1 55 55 GLY N N 15 109.9373 . . . . . . . . 55 GLY N . 50701 1 99 . 1 . 1 56 56 SER H H 1 8.1254 . . . . . . . . 56 SER HN . 50701 1 100 . 1 . 1 56 56 SER N N 15 115.6752 . . . . . . . . 56 SER N . 50701 1 101 . 1 . 1 57 57 GLU H H 1 8.4154 . . . . . . . . 57 GLU HN . 50701 1 102 . 1 . 1 57 57 GLU N N 15 122.3115 . . . . . . . . 57 GLU N . 50701 1 103 . 1 . 1 58 58 GLU H H 1 8.3301 . . . . . . . . 58 GLU HN . 50701 1 104 . 1 . 1 58 58 GLU N N 15 123.3882 . . . . . . . . 58 GLU N . 50701 1 105 . 1 . 1 61 61 SER H H 1 8.1137 . . . . . . . . 61 SER HN . 50701 1 106 . 1 . 1 61 61 SER N N 15 115.4866 . . . . . . . . 61 SER N . 50701 1 107 . 1 . 1 62 62 GLU H H 1 8.5964 . . . . . . . . 62 GLU HN . 50701 1 108 . 1 . 1 62 62 GLU N N 15 122.7187 . . . . . . . . 62 GLU N . 50701 1 109 . 1 . 1 63 63 THR H H 1 8.1151 . . . . . . . . 63 THR HN . 50701 1 110 . 1 . 1 63 63 THR N N 15 114.5663 . . . . . . . . 63 THR N . 50701 1 111 . 1 . 1 64 64 SER H H 1 8.2340 . . . . . . . . 64 SER HN . 50701 1 112 . 1 . 1 64 64 SER N N 15 117.9007 . . . . . . . . 64 SER N . 50701 1 113 . 1 . 1 65 65 ASP H H 1 8.2794 . . . . . . . . 65 ASP HN . 50701 1 114 . 1 . 1 65 65 ASP N N 15 122.4821 . . . . . . . . 65 ASP N . 50701 1 115 . 1 . 1 66 66 ALA H H 1 8.0916 . . . . . . . . 66 ALA HN . 50701 1 116 . 1 . 1 66 66 ALA N N 15 124.2159 . . . . . . . . 66 ALA N . 50701 1 117 . 1 . 1 67 67 LYS H H 1 8.1579 . . . . . . . . 67 LYS HN . 50701 1 118 . 1 . 1 67 67 LYS N N 15 119.8652 . . . . . . . . 67 LYS N . 50701 1 119 . 1 . 1 68 68 SER H H 1 8.1535 . . . . . . . . 68 SER HN . 50701 1 120 . 1 . 1 68 68 SER N N 15 116.6791 . . . . . . . . 68 SER N . 50701 1 121 . 1 . 1 69 69 THR H H 1 8.0909 . . . . . . . . 69 THR HN . 50701 1 122 . 1 . 1 69 69 THR N N 15 118.3809 . . . . . . . . 69 THR N . 50701 1 123 . 1 . 1 71 71 THR H H 1 8.2343 . . . . . . . . 71 THR HN . 50701 1 124 . 1 . 1 71 71 THR N N 15 115.0360 . . . . . . . . 71 THR N . 50701 1 125 . 1 . 1 72 72 ALA H H 1 8.2922 . . . . . . . . 72 ALA HN . 50701 1 126 . 1 . 1 72 72 ALA N N 15 126.3863 . . . . . . . . 72 ALA N . 50701 1 127 . 1 . 1 73 73 GLU H H 1 8.2658 . . . . . . . . 73 GLU HN . 50701 1 128 . 1 . 1 73 73 GLU N N 15 119.8198 . . . . . . . . 73 GLU N . 50701 1 129 . 1 . 1 74 74 ASP H H 1 8.2287 . . . . . . . . 74 ASP HN . 50701 1 130 . 1 . 1 74 74 ASP N N 15 121.3247 . . . . . . . . 74 ASP N . 50701 1 131 . 1 . 1 75 75 VAL H H 1 7.9937 . . . . . . . . 75 VAL HN . 50701 1 132 . 1 . 1 75 75 VAL N N 15 120.0153 . . . . . . . . 75 VAL N . 50701 1 133 . 1 . 1 76 76 THR H H 1 8.1465 . . . . . . . . 76 THR HN . 50701 1 134 . 1 . 1 76 76 THR N N 15 117.8263 . . . . . . . . 76 THR N . 50701 1 135 . 1 . 1 77 77 ALA H H 1 8.1141 . . . . . . . . 77 ALA HN . 50701 1 136 . 1 . 1 77 77 ALA N N 15 128.1555 . . . . . . . . 77 ALA N . 50701 1 137 . 1 . 1 79 79 LEU H H 1 8.2357 . . . . . . . . 79 LEU HN . 50701 1 138 . 1 . 1 79 79 LEU N N 15 122.5350 . . . . . . . . 79 LEU N . 50701 1 139 . 1 . 1 80 80 VAL H H 1 8.0337 . . . . . . . . 80 VAL HN . 50701 1 140 . 1 . 1 80 80 VAL N N 15 121.2128 . . . . . . . . 80 VAL N . 50701 1 141 . 1 . 1 81 81 ASP H H 1 8.3123 . . . . . . . . 81 ASP HN . 50701 1 142 . 1 . 1 81 81 ASP N N 15 124.3469 . . . . . . . . 81 ASP N . 50701 1 143 . 1 . 1 82 82 GLU H H 1 8.4155 . . . . . . . . 82 GLU HN . 50701 1 144 . 1 . 1 82 82 GLU N N 15 122.6741 . . . . . . . . 82 GLU N . 50701 1 145 . 1 . 1 83 83 GLY H H 1 8.3848 . . . . . . . . 83 GLY HN . 50701 1 146 . 1 . 1 83 83 GLY N N 15 109.2567 . . . . . . . . 83 GLY N . 50701 1 147 . 1 . 1 84 84 ALA H H 1 7.8859 . . . . . . . . 84 ALA HN . 50701 1 148 . 1 . 1 84 84 ALA N N 15 124.5555 . . . . . . . . 84 ALA N . 50701 1 149 . 1 . 1 86 86 GLY H H 1 8.3686 . . . . . . . . 86 GLY HN . 50701 1 150 . 1 . 1 86 86 GLY N N 15 108.7825 . . . . . . . . 86 GLY N . 50701 1 151 . 1 . 1 87 87 LYS H H 1 7.9954 . . . . . . . . 87 LYS HN . 50701 1 152 . 1 . 1 87 87 LYS N N 15 120.6771 . . . . . . . . 87 LYS N . 50701 1 153 . 1 . 1 88 88 GLN H H 1 8.3025 . . . . . . . . 88 GLN HN . 50701 1 154 . 1 . 1 88 88 GLN N N 15 121.4170 . . . . . . . . 88 GLN N . 50701 1 155 . 1 . 1 89 89 ALA H H 1 8.2545 . . . . . . . . 89 ALA HN . 50701 1 156 . 1 . 1 89 89 ALA N N 15 125.6250 . . . . . . . . 89 ALA N . 50701 1 157 . 1 . 1 90 90 ALA H H 1 8.1455 . . . . . . . . 90 ALA HN . 50701 1 158 . 1 . 1 90 90 ALA N N 15 123.1985 . . . . . . . . 90 ALA N . 50701 1 159 . 1 . 1 91 91 ALA H H 1 8.1156 . . . . . . . . 91 ALA HN . 50701 1 160 . 1 . 1 91 91 ALA N N 15 123.2711 . . . . . . . . 91 ALA N . 50701 1 161 . 1 . 1 92 92 GLN H H 1 8.2090 . . . . . . . . 92 GLN HN . 50701 1 162 . 1 . 1 92 92 GLN N N 15 120.6854 . . . . . . . . 92 GLN N . 50701 1 163 . 1 . 1 94 94 HIS H H 1 8.5334 . . . . . . . . 94 HIS HN . 50701 1 164 . 1 . 1 94 94 HIS N N 15 119.1669 . . . . . . . . 94 HIS N . 50701 1 165 . 1 . 1 95 95 THR H H 1 8.0918 . . . . . . . . 95 THR HN . 50701 1 166 . 1 . 1 95 95 THR N N 15 116.4626 . . . . . . . . 95 THR N . 50701 1 167 . 1 . 1 96 96 GLU H H 1 8.4804 . . . . . . . . 96 GLU HN . 50701 1 168 . 1 . 1 96 96 GLU N N 15 123.7934 . . . . . . . . 96 GLU N . 50701 1 169 . 1 . 1 97 97 ILE H H 1 8.1922 . . . . . . . . 97 ILE HN . 50701 1 170 . 1 . 1 97 97 ILE N N 15 123.8799 . . . . . . . . 97 ILE N . 50701 1 171 . 1 . 1 99 99 GLU H H 1 8.4862 . . . . . . . . 99 GLU HN . 50701 1 172 . 1 . 1 99 99 GLU N N 15 121.9371 . . . . . . . . 99 GLU N . 50701 1 173 . 1 . 1 100 100 GLY H H 1 8.4324 . . . . . . . . 100 GLY HN . 50701 1 174 . 1 . 1 100 100 GLY N N 15 110.3345 . . . . . . . . 100 GLY N . 50701 1 175 . 1 . 1 101 101 THR H H 1 7.9560 . . . . . . . . 101 THR HN . 50701 1 176 . 1 . 1 101 101 THR N N 15 113.8114 . . . . . . . . 101 THR N . 50701 1 177 . 1 . 1 102 102 THR H H 1 8.1888 . . . . . . . . 102 THR HN . 50701 1 178 . 1 . 1 102 102 THR N N 15 116.5135 . . . . . . . . 102 THR N . 50701 1 179 . 1 . 1 103 103 ALA H H 1 8.3483 . . . . . . . . 103 ALA HN . 50701 1 180 . 1 . 1 103 103 ALA N N 15 126.3761 . . . . . . . . 103 ALA N . 50701 1 181 . 1 . 1 104 104 GLU H H 1 8.3077 . . . . . . . . 104 GLU HN . 50701 1 182 . 1 . 1 104 104 GLU N N 15 119.9632 . . . . . . . . 104 GLU N . 50701 1 183 . 1 . 1 105 105 GLU H H 1 8.2279 . . . . . . . . 105 GLU HN . 50701 1 184 . 1 . 1 105 105 GLU N N 15 121.7287 . . . . . . . . 105 GLU N . 50701 1 185 . 1 . 1 106 106 ALA H H 1 8.1903 . . . . . . . . 106 ALA HN . 50701 1 186 . 1 . 1 106 106 ALA N N 15 124.7880 . . . . . . . . 106 ALA N . 50701 1 187 . 1 . 1 107 107 GLY H H 1 8.2517 . . . . . . . . 107 GLY HN . 50701 1 188 . 1 . 1 107 107 GLY N N 15 107.9731 . . . . . . . . 107 GLY N . 50701 1 189 . 1 . 1 108 108 ILE H H 1 7.8863 . . . . . . . . 108 ILE HN . 50701 1 190 . 1 . 1 108 108 ILE N N 15 119.4092 . . . . . . . . 108 ILE N . 50701 1 191 . 1 . 1 109 109 GLY H H 1 8.3726 . . . . . . . . 109 GLY HN . 50701 1 192 . 1 . 1 109 109 GLY N N 15 112.3551 . . . . . . . . 109 GLY N . 50701 1 193 . 1 . 1 110 110 ASP H H 1 8.1100 . . . . . . . . 110 ASP HN . 50701 1 194 . 1 . 1 110 110 ASP N N 15 120.3865 . . . . . . . . 110 ASP N . 50701 1 195 . 1 . 1 111 111 THR H H 1 8.0982 . . . . . . . . 111 THR HN . 50701 1 196 . 1 . 1 111 111 THR N N 15 116.7177 . . . . . . . . 111 THR N . 50701 1 197 . 1 . 1 113 113 SER H H 1 8.4210 . . . . . . . . 113 SER HN . 50701 1 198 . 1 . 1 113 113 SER N N 15 116.5713 . . . . . . . . 113 SER N . 50701 1 199 . 1 . 1 114 114 LEU H H 1 8.3385 . . . . . . . . 114 LEU HN . 50701 1 200 . 1 . 1 114 114 LEU N N 15 124.4773 . . . . . . . . 114 LEU N . 50701 1 201 . 1 . 1 115 115 GLU H H 1 8.3067 . . . . . . . . 115 GLU HN . 50701 1 202 . 1 . 1 115 115 GLU N N 15 120.6823 . . . . . . . . 115 GLU N . 50701 1 203 . 1 . 1 116 116 ASP H H 1 8.1133 . . . . . . . . 116 ASP HN . 50701 1 204 . 1 . 1 116 116 ASP N N 15 121.0500 . . . . . . . . 116 ASP N . 50701 1 205 . 1 . 1 117 117 GLU H H 1 8.2768 . . . . . . . . 117 GLU HN . 50701 1 206 . 1 . 1 117 117 GLU N N 15 121.8314 . . . . . . . . 117 GLU N . 50701 1 207 . 1 . 1 118 118 ALA H H 1 8.1334 . . . . . . . . 118 ALA HN . 50701 1 208 . 1 . 1 118 118 ALA N N 15 123.5039 . . . . . . . . 118 ALA N . 50701 1 209 . 1 . 1 119 119 ALA H H 1 7.9105 . . . . . . . . 119 ALA HN . 50701 1 210 . 1 . 1 119 119 ALA N N 15 121.5983 . . . . . . . . 119 ALA N . 50701 1 211 . 1 . 1 120 120 GLY H H 1 8.0564 . . . . . . . . 120 GLY HN . 50701 1 212 . 1 . 1 120 120 GLY N N 15 106.6686 . . . . . . . . 120 GLY N . 50701 1 213 . 1 . 1 121 121 HIS H H 1 8.0578 . . . . . . . . 121 HIS HN . 50701 1 214 . 1 . 1 121 121 HIS N N 15 118.1462 . . . . . . . . 121 HIS N . 50701 1 215 . 1 . 1 122 122 VAL H H 1 8.0428 . . . . . . . . 122 VAL HN . 50701 1 216 . 1 . 1 122 122 VAL N N 15 121.2921 . . . . . . . . 122 VAL N . 50701 1 217 . 1 . 1 123 123 THR H H 1 8.1947 . . . . . . . . 123 THR HN . 50701 1 218 . 1 . 1 123 123 THR N N 15 118.4226 . . . . . . . . 123 THR N . 50701 1 219 . 1 . 1 124 124 GLN H H 1 8.3004 . . . . . . . . 124 GLN HN . 50701 1 220 . 1 . 1 124 124 GLN N N 15 122.9099 . . . . . . . . 124 GLN N . 50701 1 221 . 1 . 1 125 125 ALA H H 1 8.2358 . . . . . . . . 125 ALA HN . 50701 1 222 . 1 . 1 125 125 ALA N N 15 124.9875 . . . . . . . . 125 ALA N . 50701 1 223 . 1 . 1 126 126 ARG H H 1 8.1443 . . . . . . . . 126 ARG HN . 50701 1 224 . 1 . 1 126 126 ARG N N 15 119.6799 . . . . . . . . 126 ARG N . 50701 1 225 . 1 . 1 127 127 MET H H 1 8.2339 . . . . . . . . 127 MET HN . 50701 1 226 . 1 . 1 127 127 MET N N 15 121.6539 . . . . . . . . 127 MET N . 50701 1 227 . 1 . 1 128 128 VAL H H 1 8.0734 . . . . . . . . 128 VAL HN . 50701 1 228 . 1 . 1 128 128 VAL N N 15 121.5658 . . . . . . . . 128 VAL N . 50701 1 229 . 1 . 1 129 129 SER H H 1 8.2938 . . . . . . . . 129 SER HN . 50701 1 230 . 1 . 1 129 129 SER N N 15 119.6213 . . . . . . . . 129 SER N . 50701 1 231 . 1 . 1 130 130 LYS H H 1 8.3276 . . . . . . . . 130 LYS HN . 50701 1 232 . 1 . 1 130 130 LYS N N 15 123.7237 . . . . . . . . 130 LYS N . 50701 1 233 . 1 . 1 131 131 SER H H 1 8.2505 . . . . . . . . 131 SER HN . 50701 1 234 . 1 . 1 131 131 SER N N 15 116.9983 . . . . . . . . 131 SER N . 50701 1 235 . 1 . 1 132 132 LYS H H 1 8.3843 . . . . . . . . 132 LYS HN . 50701 1 236 . 1 . 1 132 132 LYS N N 15 123.3830 . . . . . . . . 132 LYS N . 50701 1 237 . 1 . 1 133 133 ASP H H 1 8.1828 . . . . . . . . 133 ASP HN . 50701 1 238 . 1 . 1 133 133 ASP N N 15 120.7448 . . . . . . . . 133 ASP N . 50701 1 239 . 1 . 1 134 134 GLY H H 1 8.2562 . . . . . . . . 134 GLY HN . 50701 1 240 . 1 . 1 134 134 GLY N N 15 109.2531 . . . . . . . . 134 GLY N . 50701 1 241 . 1 . 1 135 135 THR H H 1 8.0960 . . . . . . . . 135 THR HN . 50701 1 242 . 1 . 1 135 135 THR N N 15 112.9442 . . . . . . . . 135 THR N . 50701 1 243 . 1 . 1 136 136 GLY H H 1 8.4759 . . . . . . . . 136 GLY HN . 50701 1 244 . 1 . 1 136 136 GLY N N 15 111.3173 . . . . . . . . 136 GLY N . 50701 1 245 . 1 . 1 137 137 SER H H 1 8.1576 . . . . . . . . 137 SER HN . 50701 1 246 . 1 . 1 137 137 SER N N 15 115.6118 . . . . . . . . 137 SER N . 50701 1 247 . 1 . 1 138 138 ASP H H 1 8.3687 . . . . . . . . 138 ASP HN . 50701 1 248 . 1 . 1 138 138 ASP N N 15 122.1878 . . . . . . . . 138 ASP N . 50701 1 249 . 1 . 1 139 139 ASP H H 1 8.1499 . . . . . . . . 139 ASP HN . 50701 1 250 . 1 . 1 139 139 ASP N N 15 120.8492 . . . . . . . . 139 ASP N . 50701 1 251 . 1 . 1 140 140 LYS H H 1 8.1410 . . . . . . . . 140 LYS HN . 50701 1 252 . 1 . 1 140 140 LYS N N 15 120.9232 . . . . . . . . 140 LYS N . 50701 1 253 . 1 . 1 141 141 LYS H H 1 8.0098 . . . . . . . . 141 LYS HN . 50701 1 254 . 1 . 1 141 141 LYS N N 15 120.8618 . . . . . . . . 141 LYS N . 50701 1 255 . 1 . 1 142 142 ALA H H 1 8.0672 . . . . . . . . 142 ALA HN . 50701 1 256 . 1 . 1 142 142 ALA N N 15 124.4742 . . . . . . . . 142 ALA N . 50701 1 257 . 1 . 1 143 143 LYS H H 1 8.1758 . . . . . . . . 143 LYS HN . 50701 1 258 . 1 . 1 143 143 LYS N N 15 120.4793 . . . . . . . . 143 LYS N . 50701 1 259 . 1 . 1 144 144 GLY H H 1 8.2989 . . . . . . . . 144 GLY HN . 50701 1 260 . 1 . 1 144 144 GLY N N 15 109.7583 . . . . . . . . 144 GLY N . 50701 1 261 . 1 . 1 145 145 ALA H H 1 8.1761 . . . . . . . . 145 ALA HN . 50701 1 262 . 1 . 1 145 145 ALA N N 15 123.8360 . . . . . . . . 145 ALA N . 50701 1 263 . 1 . 1 146 146 ASP H H 1 8.2317 . . . . . . . . 146 ASP HN . 50701 1 264 . 1 . 1 146 146 ASP N N 15 118.8372 . . . . . . . . 146 ASP N . 50701 1 265 . 1 . 1 147 147 GLY H H 1 8.2144 . . . . . . . . 147 GLY HN . 50701 1 266 . 1 . 1 147 147 GLY N N 15 108.8630 . . . . . . . . 147 GLY N . 50701 1 267 . 1 . 1 148 148 LYS H H 1 8.0430 . . . . . . . . 148 LYS HN . 50701 1 268 . 1 . 1 148 148 LYS N N 15 120.3417 . . . . . . . . 148 LYS N . 50701 1 269 . 1 . 1 149 149 THR H H 1 8.0846 . . . . . . . . 149 THR HN . 50701 1 270 . 1 . 1 149 149 THR N N 15 115.6490 . . . . . . . . 149 THR N . 50701 1 271 . 1 . 1 150 150 LYS H H 1 8.2750 . . . . . . . . 150 LYS HN . 50701 1 272 . 1 . 1 150 150 LYS N N 15 124.7048 . . . . . . . . 150 LYS N . 50701 1 273 . 1 . 1 151 151 ILE H H 1 8.0824 . . . . . . . . 151 ILE HN . 50701 1 274 . 1 . 1 151 151 ILE N N 15 122.8499 . . . . . . . . 151 ILE N . 50701 1 275 . 1 . 1 152 152 ALA H H 1 8.3442 . . . . . . . . 152 ALA HN . 50701 1 276 . 1 . 1 152 152 ALA N N 15 128.9863 . . . . . . . . 152 ALA N . 50701 1 277 . 1 . 1 153 153 THR H H 1 8.1069 . . . . . . . . 153 THR HN . 50701 1 278 . 1 . 1 153 153 THR N N 15 116.8330 . . . . . . . . 153 THR N . 50701 1 279 . 1 . 1 155 155 ARG H H 1 8.4124 . . . . . . . . 155 ARG HN . 50701 1 280 . 1 . 1 155 155 ARG N N 15 121.7962 . . . . . . . . 155 ARG N . 50701 1 281 . 1 . 1 156 156 GLY H H 1 8.3347 . . . . . . . . 156 GLY HN . 50701 1 282 . 1 . 1 156 156 GLY N N 15 110.3241 . . . . . . . . 156 GLY N . 50701 1 283 . 1 . 1 157 157 ALA H H 1 8.0110 . . . . . . . . 157 ALA HN . 50701 1 284 . 1 . 1 157 157 ALA N N 15 123.6287 . . . . . . . . 157 ALA N . 50701 1 285 . 1 . 1 158 158 ALA H H 1 8.2031 . . . . . . . . 158 ALA HN . 50701 1 286 . 1 . 1 158 158 ALA N N 15 124.9143 . . . . . . . . 158 ALA N . 50701 1 287 . 1 . 1 161 161 GLY H H 1 8.3711 . . . . . . . . 161 GLY HN . 50701 1 288 . 1 . 1 161 161 GLY N N 15 108.7648 . . . . . . . . 161 GLY N . 50701 1 289 . 1 . 1 162 162 GLN H H 1 8.0770 . . . . . . . . 162 GLN HN . 50701 1 290 . 1 . 1 162 162 GLN N N 15 119.7871 . . . . . . . . 162 GLN N . 50701 1 291 . 1 . 1 163 163 LYS H H 1 8.3774 . . . . . . . . 163 LYS HN . 50701 1 292 . 1 . 1 163 163 LYS N N 15 122.8266 . . . . . . . . 163 LYS N . 50701 1 293 . 1 . 1 164 164 GLY H H 1 8.3775 . . . . . . . . 164 GLY HN . 50701 1 294 . 1 . 1 164 164 GLY N N 15 110.0662 . . . . . . . . 164 GLY N . 50701 1 295 . 1 . 1 165 165 GLN H H 1 8.1393 . . . . . . . . 165 GLN HN . 50701 1 296 . 1 . 1 165 165 GLN N N 15 119.8042 . . . . . . . . 165 GLN N . 50701 1 297 . 1 . 1 166 166 ALA H H 1 8.3456 . . . . . . . . 166 ALA HN . 50701 1 298 . 1 . 1 166 166 ALA N N 15 125.2833 . . . . . . . . 166 ALA N . 50701 1 299 . 1 . 1 167 167 ASN H H 1 8.3126 . . . . . . . . 167 ASN HN . 50701 1 300 . 1 . 1 167 167 ASN N N 15 117.6376 . . . . . . . . 167 ASN N . 50701 1 301 . 1 . 1 168 168 ALA H H 1 8.1290 . . . . . . . . 168 ALA HN . 50701 1 302 . 1 . 1 168 168 ALA N N 15 124.1437 . . . . . . . . 168 ALA N . 50701 1 303 . 1 . 1 169 169 THR H H 1 8.0307 . . . . . . . . 169 THR HN . 50701 1 304 . 1 . 1 169 169 THR N N 15 113.5729 . . . . . . . . 169 THR N . 50701 1 305 . 1 . 1 170 170 ARG H H 1 8.1997 . . . . . . . . 170 ARG HN . 50701 1 306 . 1 . 1 170 170 ARG N N 15 123.9120 . . . . . . . . 170 ARG N . 50701 1 307 . 1 . 1 171 171 ILE H H 1 8.1713 . . . . . . . . 171 ILE HN . 50701 1 308 . 1 . 1 171 171 ILE N N 15 124.3844 . . . . . . . . 171 ILE N . 50701 1 309 . 1 . 1 173 173 ALA H H 1 8.2637 . . . . . . . . 173 ALA HN . 50701 1 310 . 1 . 1 173 173 ALA N N 15 124.5276 . . . . . . . . 173 ALA N . 50701 1 311 . 1 . 1 174 174 LYS H H 1 8.2484 . . . . . . . . 174 LYS HN . 50701 1 312 . 1 . 1 174 174 LYS N N 15 120.9052 . . . . . . . . 174 LYS N . 50701 1 313 . 1 . 1 175 175 THR H H 1 8.1294 . . . . . . . . 175 THR HN . 50701 1 314 . 1 . 1 175 175 THR N N 15 118.5945 . . . . . . . . 175 THR N . 50701 1 315 . 1 . 1 184 184 SER H H 1 8.3633 . . . . . . . . 184 SER HN . 50701 1 316 . 1 . 1 184 184 SER N N 15 116.1324 . . . . . . . . 184 SER N . 50701 1 317 . 1 . 1 185 185 SER H H 1 8.3191 . . . . . . . . 185 SER HN . 50701 1 318 . 1 . 1 185 185 SER N N 15 117.6514 . . . . . . . . 185 SER N . 50701 1 319 . 1 . 1 186 186 GLY H H 1 8.2619 . . . . . . . . 186 GLY HN . 50701 1 320 . 1 . 1 186 186 GLY N N 15 110.5260 . . . . . . . . 186 GLY N . 50701 1 321 . 1 . 1 187 187 GLU H H 1 8.1027 . . . . . . . . 187 GLU HN . 50701 1 322 . 1 . 1 187 187 GLU N N 15 121.7271 . . . . . . . . 187 GLU N . 50701 1 323 . 1 . 1 190 190 LYS H H 1 8.4135 . . . . . . . . 190 LYS HN . 50701 1 324 . 1 . 1 190 190 LYS N N 15 121.8844 . . . . . . . . 190 LYS N . 50701 1 325 . 1 . 1 191 191 SER H H 1 8.2618 . . . . . . . . 191 SER HN . 50701 1 326 . 1 . 1 191 191 SER N N 15 116.6748 . . . . . . . . 191 SER N . 50701 1 327 . 1 . 1 192 192 GLY H H 1 8.3736 . . . . . . . . 192 GLY HN . 50701 1 328 . 1 . 1 192 192 GLY N N 15 110.7863 . . . . . . . . 192 GLY N . 50701 1 329 . 1 . 1 193 193 ASP H H 1 8.1110 . . . . . . . . 193 ASP HN . 50701 1 330 . 1 . 1 193 193 ASP N N 15 120.3461 . . . . . . . . 193 ASP N . 50701 1 331 . 1 . 1 194 194 ARG H H 1 8.3620 . . . . . . . . 194 ARG HN . 50701 1 332 . 1 . 1 194 194 ARG N N 15 121.8708 . . . . . . . . 194 ARG N . 50701 1 333 . 1 . 1 195 195 SER H H 1 8.3012 . . . . . . . . 195 SER HN . 50701 1 334 . 1 . 1 195 195 SER N N 15 116.8209 . . . . . . . . 195 SER N . 50701 1 335 . 1 . 1 196 196 GLY H H 1 8.3161 . . . . . . . . 196 GLY HN . 50701 1 336 . 1 . 1 196 196 GLY N N 15 110.4734 . . . . . . . . 196 GLY N . 50701 1 337 . 1 . 1 197 197 TYR H H 1 7.9144 . . . . . . . . 197 TYR HN . 50701 1 338 . 1 . 1 197 197 TYR N N 15 120.0560 . . . . . . . . 197 TYR N . 50701 1 339 . 1 . 1 198 198 SER H H 1 8.0407 . . . . . . . . 198 SER HN . 50701 1 340 . 1 . 1 198 198 SER N N 15 117.9491 . . . . . . . . 198 SER N . 50701 1 341 . 1 . 1 199 199 SER H H 1 8.1949 . . . . . . . . 199 SER HN . 50701 1 342 . 1 . 1 199 199 SER N N 15 118.7876 . . . . . . . . 199 SER N . 50701 1 343 . 1 . 1 201 201 GLY H H 1 8.3369 . . . . . . . . 201 GLY HN . 50701 1 344 . 1 . 1 201 201 GLY N N 15 109.2007 . . . . . . . . 201 GLY N . 50701 1 345 . 1 . 1 202 202 SER H H 1 8.0350 . . . . . . . . 202 SER HN . 50701 1 346 . 1 . 1 202 202 SER N N 15 116.6811 . . . . . . . . 202 SER N . 50701 1 347 . 1 . 1 204 204 GLY H H 1 8.3386 . . . . . . . . 204 GLY HN . 50701 1 348 . 1 . 1 204 204 GLY N N 15 108.9412 . . . . . . . . 204 GLY N . 50701 1 349 . 1 . 1 205 205 THR H H 1 7.9469 . . . . . . . . 205 THR HN . 50701 1 350 . 1 . 1 205 205 THR N N 15 115.5184 . . . . . . . . 205 THR N . 50701 1 351 . 1 . 1 207 207 GLY H H 1 8.4541 . . . . . . . . 207 GLY HN . 50701 1 352 . 1 . 1 207 207 GLY N N 15 109.3500 . . . . . . . . 207 GLY N . 50701 1 353 . 1 . 1 208 208 SER H H 1 8.0493 . . . . . . . . 208 SER HN . 50701 1 354 . 1 . 1 208 208 SER N N 15 115.4715 . . . . . . . . 208 SER N . 50701 1 355 . 1 . 1 209 209 ARG H H 1 8.3261 . . . . . . . . 209 ARG HN . 50701 1 356 . 1 . 1 209 209 ARG N N 15 122.7357 . . . . . . . . 209 ARG N . 50701 1 357 . 1 . 1 210 210 SER H H 1 8.1896 . . . . . . . . 210 SER HN . 50701 1 358 . 1 . 1 210 210 SER N N 15 116.6638 . . . . . . . . 210 SER N . 50701 1 359 . 1 . 1 211 211 ARG H H 1 8.3192 . . . . . . . . 211 ARG HN . 50701 1 360 . 1 . 1 211 211 ARG N N 15 122.9478 . . . . . . . . 211 ARG N . 50701 1 361 . 1 . 1 214 214 SER H H 1 8.3005 . . . . . . . . 214 SER HN . 50701 1 362 . 1 . 1 214 214 SER N N 15 116.5526 . . . . . . . . 214 SER N . 50701 1 363 . 1 . 1 215 215 LEU H H 1 8.1789 . . . . . . . . 215 LEU HN . 50701 1 364 . 1 . 1 215 215 LEU N N 15 125.3348 . . . . . . . . 215 LEU N . 50701 1 365 . 1 . 1 220 220 THR H H 1 8.1291 . . . . . . . . 220 THR HN . 50701 1 366 . 1 . 1 220 220 THR N N 15 114.7605 . . . . . . . . 220 THR N . 50701 1 367 . 1 . 1 221 221 ARG H H 1 8.2910 . . . . . . . . 221 ARG HN . 50701 1 368 . 1 . 1 221 221 ARG N N 15 123.5311 . . . . . . . . 221 ARG N . 50701 1 369 . 1 . 1 226 226 VAL H H 1 8.0922 . . . . . . . . 226 VAL HN . 50701 1 370 . 1 . 1 226 226 VAL N N 15 122.3298 . . . . . . . . 226 VAL N . 50701 1 371 . 1 . 1 227 227 ALA H H 1 8.2954 . . . . . . . . 227 ALA HN . 50701 1 372 . 1 . 1 227 227 ALA N N 15 128.4928 . . . . . . . . 227 ALA N . 50701 1 373 . 1 . 1 228 228 VAL H H 1 8.0725 . . . . . . . . 228 VAL HN . 50701 1 374 . 1 . 1 228 228 VAL N N 15 120.7580 . . . . . . . . 228 VAL N . 50701 1 375 . 1 . 1 229 229 VAL H H 1 8.2179 . . . . . . . . 229 VAL HN . 50701 1 376 . 1 . 1 229 229 VAL N N 15 125.5647 . . . . . . . . 229 VAL N . 50701 1 377 . 1 . 1 230 230 ARG H H 1 8.4303 . . . . . . . . 230 ARG HN . 50701 1 378 . 1 . 1 230 230 ARG N N 15 126.1098 . . . . . . . . 230 ARG N . 50701 1 379 . 1 . 1 231 231 THR H H 1 8.1814 . . . . . . . . 231 THR HN . 50701 1 380 . 1 . 1 231 231 THR N N 15 118.8852 . . . . . . . . 231 THR N . 50701 1 381 . 1 . 1 238 238 SER H H 1 8.2397 . . . . . . . . 238 SER HN . 50701 1 382 . 1 . 1 238 238 SER N N 15 117.9220 . . . . . . . . 238 SER N . 50701 1 383 . 1 . 1 239 239 ALA H H 1 8.1982 . . . . . . . . 239 ALA HN . 50701 1 384 . 1 . 1 239 239 ALA N N 15 125.8090 . . . . . . . . 239 ALA N . 50701 1 385 . 1 . 1 240 240 LYS H H 1 8.1262 . . . . . . . . 240 LYS HN . 50701 1 386 . 1 . 1 240 240 LYS N N 15 119.8895 . . . . . . . . 240 LYS N . 50701 1 387 . 1 . 1 241 241 SER H H 1 8.1140 . . . . . . . . 241 SER HN . 50701 1 388 . 1 . 1 241 241 SER N N 15 116.4535 . . . . . . . . 241 SER N . 50701 1 389 . 1 . 1 242 242 ARG H H 1 8.2385 . . . . . . . . 242 ARG HN . 50701 1 390 . 1 . 1 242 242 ARG N N 15 122.8377 . . . . . . . . 242 ARG N . 50701 1 391 . 1 . 1 244 244 GLN H H 1 8.2780 . . . . . . . . 244 GLN HN . 50701 1 392 . 1 . 1 244 244 GLN N N 15 121.4324 . . . . . . . . 244 GLN N . 50701 1 393 . 1 . 1 245 245 THR H H 1 8.0235 . . . . . . . . 245 THR HN . 50701 1 394 . 1 . 1 245 245 THR N N 15 115.5724 . . . . . . . . 245 THR N . 50701 1 395 . 1 . 1 246 246 ALA H H 1 8.1934 . . . . . . . . 246 ALA HN . 50701 1 396 . 1 . 1 246 246 ALA N N 15 127.7890 . . . . . . . . 246 ALA N . 50701 1 397 . 1 . 1 252 252 ASP H H 1 8.3101 . . . . . . . . 252 ASP HN . 50701 1 398 . 1 . 1 252 252 ASP N N 15 120.3849 . . . . . . . . 252 ASP N . 50701 1 399 . 1 . 1 253 253 LEU H H 1 8.1411 . . . . . . . . 253 LEU HN . 50701 1 400 . 1 . 1 253 253 LEU N N 15 123.4949 . . . . . . . . 253 LEU N . 50701 1 401 . 1 . 1 254 254 LYS H H 1 8.1799 . . . . . . . . 254 LYS HN . 50701 1 402 . 1 . 1 254 254 LYS N N 15 120.2648 . . . . . . . . 254 LYS N . 50701 1 403 . 1 . 1 255 255 ASN H H 1 8.1665 . . . . . . . . 255 ASN HN . 50701 1 404 . 1 . 1 255 255 ASN N N 15 118.4810 . . . . . . . . 255 ASN N . 50701 1 405 . 1 . 1 256 256 VAL H H 1 7.8652 . . . . . . . . 256 VAL HN . 50701 1 406 . 1 . 1 256 256 VAL N N 15 120.1826 . . . . . . . . 256 VAL N . 50701 1 407 . 1 . 1 257 257 LYS H H 1 8.3049 . . . . . . . . 257 LYS HN . 50701 1 408 . 1 . 1 257 257 LYS N N 15 124.6040 . . . . . . . . 257 LYS N . 50701 1 409 . 1 . 1 258 258 SER H H 1 8.1379 . . . . . . . . 258 SER HN . 50701 1 410 . 1 . 1 258 258 SER N N 15 116.8034 . . . . . . . . 258 SER N . 50701 1 411 . 1 . 1 259 259 LYS H H 1 8.2879 . . . . . . . . 259 LYS HN . 50701 1 412 . 1 . 1 259 259 LYS N N 15 123.4132 . . . . . . . . 259 LYS N . 50701 1 413 . 1 . 1 260 260 ILE H H 1 8.0578 . . . . . . . . 260 ILE HN . 50701 1 414 . 1 . 1 260 260 ILE N N 15 122.0619 . . . . . . . . 260 ILE N . 50701 1 415 . 1 . 1 261 261 GLY H H 1 8.4302 . . . . . . . . 261 GLY HN . 50701 1 416 . 1 . 1 261 261 GLY N N 15 113.1929 . . . . . . . . 261 GLY N . 50701 1 417 . 1 . 1 262 262 SER H H 1 8.1415 . . . . . . . . 262 SER HN . 50701 1 418 . 1 . 1 262 262 SER N N 15 115.5533 . . . . . . . . 262 SER N . 50701 1 419 . 1 . 1 263 263 THR H H 1 8.2360 . . . . . . . . 263 THR HN . 50701 1 420 . 1 . 1 263 263 THR N N 15 115.6467 . . . . . . . . 263 THR N . 50701 1 421 . 1 . 1 264 264 GLU H H 1 8.3004 . . . . . . . . 264 GLU HN . 50701 1 422 . 1 . 1 264 264 GLU N N 15 122.8272 . . . . . . . . 264 GLU N . 50701 1 423 . 1 . 1 265 265 ASN H H 1 8.3293 . . . . . . . . 265 ASN HN . 50701 1 424 . 1 . 1 265 265 ASN N N 15 119.1330 . . . . . . . . 265 ASN N . 50701 1 425 . 1 . 1 266 266 LEU H H 1 8.0071 . . . . . . . . 266 LEU HN . 50701 1 426 . 1 . 1 266 266 LEU N N 15 121.9863 . . . . . . . . 266 LEU N . 50701 1 427 . 1 . 1 267 267 LYS H H 1 8.0448 . . . . . . . . 267 LYS HN . 50701 1 428 . 1 . 1 267 267 LYS N N 15 120.6661 . . . . . . . . 267 LYS N . 50701 1 429 . 1 . 1 268 268 HIS H H 1 8.1807 . . . . . . . . 268 HIS HN . 50701 1 430 . 1 . 1 268 268 HIS N N 15 119.1742 . . . . . . . . 268 HIS N . 50701 1 431 . 1 . 1 269 269 GLN H H 1 8.3025 . . . . . . . . 269 GLN HN . 50701 1 432 . 1 . 1 269 269 GLN N N 15 122.9100 . . . . . . . . 269 GLN N . 50701 1 433 . 1 . 1 271 271 GLY H H 1 8.5382 . . . . . . . . 271 GLY HN . 50701 1 434 . 1 . 1 271 271 GLY N N 15 109.9680 . . . . . . . . 271 GLY N . 50701 1 435 . 1 . 1 272 272 GLY H H 1 8.2424 . . . . . . . . 272 GLY HN . 50701 1 436 . 1 . 1 272 272 GLY N N 15 108.6002 . . . . . . . . 272 GLY N . 50701 1 437 . 1 . 1 273 273 GLY H H 1 8.2353 . . . . . . . . 273 GLY HN . 50701 1 438 . 1 . 1 273 273 GLY N N 15 108.5093 . . . . . . . . 273 GLY N . 50701 1 439 . 1 . 1 274 274 LYS H H 1 8.0700 . . . . . . . . 274 LYS HN . 50701 1 440 . 1 . 1 274 274 LYS N N 15 120.7034 . . . . . . . . 274 LYS N . 50701 1 441 . 1 . 1 277 277 ILE H H 1 8.2261 . . . . . . . . 277 ILE HN . 50701 1 442 . 1 . 1 277 277 ILE N N 15 123.8853 . . . . . . . . 277 ILE N . 50701 1 443 . 1 . 1 278 278 ILE H H 1 8.2009 . . . . . . . . 278 ILE HN . 50701 1 444 . 1 . 1 278 278 ILE N N 15 125.7794 . . . . . . . . 278 ILE N . 50701 1 445 . 1 . 1 279 279 ASN H H 1 8.4545 . . . . . . . . 279 ASN HN . 50701 1 446 . 1 . 1 279 279 ASN N N 15 123.7378 . . . . . . . . 279 ASN N . 50701 1 447 . 1 . 1 280 280 LYS H H 1 8.2470 . . . . . . . . 280 LYS HN . 50701 1 448 . 1 . 1 280 280 LYS N N 15 122.7133 . . . . . . . . 280 LYS N . 50701 1 449 . 1 . 1 281 281 LYS H H 1 8.2091 . . . . . . . . 281 LYS HN . 50701 1 450 . 1 . 1 281 281 LYS N N 15 122.3925 . . . . . . . . 281 LYS N . 50701 1 451 . 1 . 1 282 282 LEU H H 1 8.0730 . . . . . . . . 282 LEU HN . 50701 1 452 . 1 . 1 282 282 LEU N N 15 123.4875 . . . . . . . . 282 LEU N . 50701 1 453 . 1 . 1 283 283 ASP H H 1 8.2501 . . . . . . . . 283 ASP HN . 50701 1 454 . 1 . 1 283 283 ASP N N 15 121.9226 . . . . . . . . 283 ASP N . 50701 1 455 . 1 . 1 284 284 LEU H H 1 8.2458 . . . . . . . . 284 LEU HN . 50701 1 456 . 1 . 1 284 284 LEU N N 15 123.7760 . . . . . . . . 284 LEU N . 50701 1 457 . 1 . 1 285 285 SER H H 1 8.2647 . . . . . . . . 285 SER HN . 50701 1 458 . 1 . 1 285 285 SER N N 15 115.8519 . . . . . . . . 285 SER N . 50701 1 459 . 1 . 1 286 286 ASN H H 1 8.2023 . . . . . . . . 286 ASN HN . 50701 1 460 . 1 . 1 286 286 ASN N N 15 120.1645 . . . . . . . . 286 ASN N . 50701 1 461 . 1 . 1 287 287 VAL H H 1 7.8468 . . . . . . . . 287 VAL HN . 50701 1 462 . 1 . 1 287 287 VAL N N 15 119.8187 . . . . . . . . 287 VAL N . 50701 1 463 . 1 . 1 288 288 GLN H H 1 8.3358 . . . . . . . . 288 GLN HN . 50701 1 464 . 1 . 1 288 288 GLN N N 15 123.3338 . . . . . . . . 288 GLN N . 50701 1 465 . 1 . 1 289 289 SER H H 1 8.2060 . . . . . . . . 289 SER HN . 50701 1 466 . 1 . 1 289 289 SER N N 15 116.9386 . . . . . . . . 289 SER N . 50701 1 467 . 1 . 1 290 290 LYS H H 1 8.2949 . . . . . . . . 290 LYS HN . 50701 1 468 . 1 . 1 290 290 LYS N N 15 123.0821 . . . . . . . . 290 LYS N . 50701 1 469 . 1 . 1 292 292 GLY H H 1 8.4202 . . . . . . . . 292 GLY HN . 50701 1 470 . 1 . 1 292 292 GLY N N 15 111.4952 . . . . . . . . 292 GLY N . 50701 1 471 . 1 . 1 293 293 SER H H 1 8.1434 . . . . . . . . 293 SER HN . 50701 1 472 . 1 . 1 293 293 SER N N 15 115.6616 . . . . . . . . 293 SER N . 50701 1 473 . 1 . 1 294 294 LYS H H 1 8.3815 . . . . . . . . 294 LYS HN . 50701 1 474 . 1 . 1 294 294 LYS N N 15 123.0121 . . . . . . . . 294 LYS N . 50701 1 475 . 1 . 1 295 295 ASP H H 1 8.1137 . . . . . . . . 295 ASP HN . 50701 1 476 . 1 . 1 295 295 ASP N N 15 120.2943 . . . . . . . . 295 ASP N . 50701 1 477 . 1 . 1 296 296 ASN H H 1 8.2089 . . . . . . . . 296 ASN HN . 50701 1 478 . 1 . 1 296 296 ASN N N 15 118.6585 . . . . . . . . 296 ASN N . 50701 1 479 . 1 . 1 297 297 ILE H H 1 7.8568 . . . . . . . . 297 ILE HN . 50701 1 480 . 1 . 1 297 297 ILE N N 15 120.6348 . . . . . . . . 297 ILE N . 50701 1 481 . 1 . 1 298 298 LYS H H 1 8.2112 . . . . . . . . 298 LYS HN . 50701 1 482 . 1 . 1 298 298 LYS N N 15 124.8502 . . . . . . . . 298 LYS N . 50701 1 483 . 1 . 1 299 299 HIS H H 1 8.3570 . . . . . . . . 299 HIS HN . 50701 1 484 . 1 . 1 299 299 HIS N N 15 121.0356 . . . . . . . . 299 HIS N . 50701 1 485 . 1 . 1 300 300 VAL H H 1 8.1322 . . . . . . . . 300 VAL HN . 50701 1 486 . 1 . 1 300 300 VAL N N 15 123.5010 . . . . . . . . 300 VAL N . 50701 1 487 . 1 . 1 307 307 GLN H H 1 8.3964 . . . . . . . . 307 GLN HN . 50701 1 488 . 1 . 1 307 307 GLN N N 15 125.0476 . . . . . . . . 307 GLN N . 50701 1 489 . 1 . 1 309 309 VAL H H 1 8.0874 . . . . . . . . 309 VAL HN . 50701 1 490 . 1 . 1 309 309 VAL N N 15 125.3127 . . . . . . . . 309 VAL N . 50701 1 491 . 1 . 1 310 310 TYR H H 1 8.3207 . . . . . . . . 310 TYR HN . 50701 1 492 . 1 . 1 310 310 TYR N N 15 125.8893 . . . . . . . . 310 TYR N . 50701 1 493 . 1 . 1 311 311 LYS H H 1 8.0772 . . . . . . . . 311 LYS HN . 50701 1 494 . 1 . 1 311 311 LYS N N 15 125.6476 . . . . . . . . 311 LYS N . 50701 1 495 . 1 . 1 313 313 VAL H H 1 8.0735 . . . . . . . . 313 VAL HN . 50701 1 496 . 1 . 1 313 313 VAL N N 15 120.2694 . . . . . . . . 313 VAL N . 50701 1 497 . 1 . 1 314 314 ASP H H 1 8.2773 . . . . . . . . 314 ASP HN . 50701 1 498 . 1 . 1 314 314 ASP N N 15 124.1586 . . . . . . . . 314 ASP N . 50701 1 499 . 1 . 1 315 315 LEU H H 1 8.4059 . . . . . . . . 315 LEU HN . 50701 1 500 . 1 . 1 315 315 LEU N N 15 125.1383 . . . . . . . . 315 LEU N . 50701 1 501 . 1 . 1 316 316 SER H H 1 8.3566 . . . . . . . . 316 SER HN . 50701 1 502 . 1 . 1 316 316 SER N N 15 115.9488 . . . . . . . . 316 SER N . 50701 1 503 . 1 . 1 317 317 LYS H H 1 7.8539 . . . . . . . . 317 LYS HN . 50701 1 504 . 1 . 1 317 317 LYS N N 15 121.7742 . . . . . . . . 317 LYS N . 50701 1 505 . 1 . 1 318 318 VAL H H 1 7.8037 . . . . . . . . 318 VAL HN . 50701 1 506 . 1 . 1 318 318 VAL N N 15 120.4413 . . . . . . . . 318 VAL N . 50701 1 507 . 1 . 1 319 319 THR H H 1 8.1118 . . . . . . . . 319 THR HN . 50701 1 508 . 1 . 1 319 319 THR N N 15 117.4713 . . . . . . . . 319 THR N . 50701 1 509 . 1 . 1 320 320 SER H H 1 8.1817 . . . . . . . . 320 SER HN . 50701 1 510 . 1 . 1 320 320 SER N N 15 118.1011 . . . . . . . . 320 SER N . 50701 1 511 . 1 . 1 322 322 CYS H H 1 8.2579 . . . . . . . . 322 CYS HN . 50701 1 512 . 1 . 1 322 322 CYS N N 15 119.8000 . . . . . . . . 322 CYS N . 50701 1 513 . 1 . 1 323 323 GLY H H 1 8.3783 . . . . . . . . 323 GLY HN . 50701 1 514 . 1 . 1 323 323 GLY N N 15 111.3584 . . . . . . . . 323 GLY N . 50701 1 515 . 1 . 1 324 324 SER H H 1 8.1592 . . . . . . . . 324 SER HN . 50701 1 516 . 1 . 1 324 324 SER N N 15 115.6613 . . . . . . . . 324 SER N . 50701 1 517 . 1 . 1 325 325 LEU H H 1 8.2519 . . . . . . . . 325 LEU HN . 50701 1 518 . 1 . 1 325 325 LEU N N 15 123.7224 . . . . . . . . 325 LEU N . 50701 1 519 . 1 . 1 326 326 GLY H H 1 8.2229 . . . . . . . . 326 GLY HN . 50701 1 520 . 1 . 1 326 326 GLY N N 15 108.5467 . . . . . . . . 326 GLY N . 50701 1 521 . 1 . 1 327 327 ASN H H 1 8.1679 . . . . . . . . 327 ASN HN . 50701 1 522 . 1 . 1 327 327 ASN N N 15 118.5388 . . . . . . . . 327 ASN N . 50701 1 523 . 1 . 1 328 328 ILE H H 1 7.8757 . . . . . . . . 328 ILE HN . 50701 1 524 . 1 . 1 328 328 ILE N N 15 120.2359 . . . . . . . . 328 ILE N . 50701 1 525 . 1 . 1 329 329 HIS H H 1 8.3564 . . . . . . . . 329 HIS HN . 50701 1 526 . 1 . 1 329 329 HIS N N 15 122.2116 . . . . . . . . 329 HIS N . 50701 1 527 . 1 . 1 333 333 GLY H H 1 8.5141 . . . . . . . . 333 GLY HN . 50701 1 528 . 1 . 1 333 333 GLY N N 15 110.0412 . . . . . . . . 333 GLY N . 50701 1 529 . 1 . 1 334 334 GLY H H 1 8.2434 . . . . . . . . 334 GLY HN . 50701 1 530 . 1 . 1 334 334 GLY N N 15 108.5941 . . . . . . . . 334 GLY N . 50701 1 531 . 1 . 1 336 336 GLN H H 1 8.1758 . . . . . . . . 336 GLN HN . 50701 1 532 . 1 . 1 336 336 GLN N N 15 119.8280 . . . . . . . . 336 GLN N . 50701 1 533 . 1 . 1 337 337 VAL H H 1 8.1121 . . . . . . . . 337 VAL HN . 50701 1 534 . 1 . 1 337 337 VAL N N 15 121.4916 . . . . . . . . 337 VAL N . 50701 1 535 . 1 . 1 338 338 GLU H H 1 8.4037 . . . . . . . . 338 GLU HN . 50701 1 536 . 1 . 1 338 338 GLU N N 15 125.3054 . . . . . . . . 338 GLU N . 50701 1 537 . 1 . 1 339 339 VAL H H 1 8.2294 . . . . . . . . 339 VAL HN . 50701 1 538 . 1 . 1 339 339 VAL N N 15 123.1876 . . . . . . . . 339 VAL N . 50701 1 539 . 1 . 1 340 340 LYS H H 1 8.3919 . . . . . . . . 340 LYS HN . 50701 1 540 . 1 . 1 340 340 LYS N N 15 126.0208 . . . . . . . . 340 LYS N . 50701 1 541 . 1 . 1 341 341 SER H H 1 8.2724 . . . . . . . . 341 SER HN . 50701 1 542 . 1 . 1 341 341 SER N N 15 117.4828 . . . . . . . . 341 SER N . 50701 1 543 . 1 . 1 342 342 GLU H H 1 8.4414 . . . . . . . . 342 GLU HN . 50701 1 544 . 1 . 1 342 342 GLU N N 15 123.3480 . . . . . . . . 342 GLU N . 50701 1 545 . 1 . 1 343 343 LYS H H 1 8.2229 . . . . . . . . 343 LYS HN . 50701 1 546 . 1 . 1 343 343 LYS N N 15 122.0705 . . . . . . . . 343 LYS N . 50701 1 547 . 1 . 1 344 344 LEU H H 1 8.1155 . . . . . . . . 344 LEU HN . 50701 1 548 . 1 . 1 344 344 LEU N N 15 123.4552 . . . . . . . . 344 LEU N . 50701 1 549 . 1 . 1 345 345 ASP H H 1 8.2041 . . . . . . . . 345 ASP HN . 50701 1 550 . 1 . 1 345 345 ASP N N 15 121.1455 . . . . . . . . 345 ASP N . 50701 1 551 . 1 . 1 346 346 PHE H H 1 8.0843 . . . . . . . . 346 PHE HN . 50701 1 552 . 1 . 1 346 346 PHE N N 15 120.9324 . . . . . . . . 346 PHE N . 50701 1 553 . 1 . 1 347 347 LYS H H 1 8.1110 . . . . . . . . 347 LYS HN . 50701 1 554 . 1 . 1 347 347 LYS N N 15 121.6469 . . . . . . . . 347 LYS N . 50701 1 555 . 1 . 1 348 348 ASP H H 1 8.0570 . . . . . . . . 348 ASP HN . 50701 1 556 . 1 . 1 348 348 ASP N N 15 119.9365 . . . . . . . . 348 ASP N . 50701 1 557 . 1 . 1 349 349 ARG H H 1 7.9660 . . . . . . . . 349 ARG HN . 50701 1 558 . 1 . 1 349 349 ARG N N 15 120.6513 . . . . . . . . 349 ARG N . 50701 1 559 . 1 . 1 350 350 VAL H H 1 8.0289 . . . . . . . . 350 VAL HN . 50701 1 560 . 1 . 1 350 350 VAL N N 15 121.0879 . . . . . . . . 350 VAL N . 50701 1 561 . 1 . 1 351 351 GLN H H 1 8.3742 . . . . . . . . 351 GLN HN . 50701 1 562 . 1 . 1 351 351 GLN N N 15 123.9271 . . . . . . . . 351 GLN N . 50701 1 563 . 1 . 1 352 352 SER H H 1 8.2253 . . . . . . . . 352 SER HN . 50701 1 564 . 1 . 1 352 352 SER N N 15 117.1951 . . . . . . . . 352 SER N . 50701 1 565 . 1 . 1 353 353 LYS H H 1 8.2650 . . . . . . . . 353 LYS HN . 50701 1 566 . 1 . 1 353 353 LYS N N 15 123.1917 . . . . . . . . 353 LYS N . 50701 1 567 . 1 . 1 354 354 ILE H H 1 8.0398 . . . . . . . . 354 ILE HN . 50701 1 568 . 1 . 1 354 354 ILE N N 15 121.9033 . . . . . . . . 354 ILE N . 50701 1 569 . 1 . 1 355 355 GLY H H 1 8.4100 . . . . . . . . 355 GLY HN . 50701 1 570 . 1 . 1 355 355 GLY N N 15 113.1455 . . . . . . . . 355 GLY N . 50701 1 571 . 1 . 1 356 356 SER H H 1 8.0603 . . . . . . . . 356 SER HN . 50701 1 572 . 1 . 1 356 356 SER N N 15 115.3914 . . . . . . . . 356 SER N . 50701 1 573 . 1 . 1 357 357 LEU H H 1 8.2993 . . . . . . . . 357 LEU HN . 50701 1 574 . 1 . 1 357 357 LEU N N 15 123.8129 . . . . . . . . 357 LEU N . 50701 1 575 . 1 . 1 358 358 ASP H H 1 8.0971 . . . . . . . . 358 ASP HN . 50701 1 576 . 1 . 1 358 358 ASP N N 15 120.1190 . . . . . . . . 358 ASP N . 50701 1 577 . 1 . 1 359 359 ASN H H 1 8.1880 . . . . . . . . 359 ASN HN . 50701 1 578 . 1 . 1 359 359 ASN N N 15 118.4333 . . . . . . . . 359 ASN N . 50701 1 579 . 1 . 1 360 360 ILE H H 1 7.9143 . . . . . . . . 360 ILE HN . 50701 1 580 . 1 . 1 360 360 ILE N N 15 120.2349 . . . . . . . . 360 ILE N . 50701 1 581 . 1 . 1 361 361 THR H H 1 8.1007 . . . . . . . . 361 THR HN . 50701 1 582 . 1 . 1 361 361 THR N N 15 117.5583 . . . . . . . . 361 THR N . 50701 1 583 . 1 . 1 362 362 HIS H H 1 8.3187 . . . . . . . . 362 HIS HN . 50701 1 584 . 1 . 1 362 362 HIS N N 15 121.8170 . . . . . . . . 362 HIS N . 50701 1 585 . 1 . 1 363 363 VAL H H 1 8.1094 . . . . . . . . 363 VAL HN . 50701 1 586 . 1 . 1 363 363 VAL N N 15 123.3441 . . . . . . . . 363 VAL N . 50701 1 587 . 1 . 1 365 365 GLY H H 1 8.5415 . . . . . . . . 365 GLY HN . 50701 1 588 . 1 . 1 365 365 GLY N N 15 110.2937 . . . . . . . . 365 GLY N . 50701 1 589 . 1 . 1 366 366 GLY H H 1 8.2667 . . . . . . . . 366 GLY HN . 50701 1 590 . 1 . 1 366 366 GLY N N 15 108.6349 . . . . . . . . 366 GLY N . 50701 1 591 . 1 . 1 368 368 ASN H H 1 8.2584 . . . . . . . . 368 ASN HN . 50701 1 592 . 1 . 1 368 368 ASN N N 15 118.4514 . . . . . . . . 368 ASN N . 50701 1 593 . 1 . 1 369 369 LYS H H 1 8.1898 . . . . . . . . 369 LYS HN . 50701 1 594 . 1 . 1 369 369 LYS N N 15 121.7273 . . . . . . . . 369 LYS N . 50701 1 595 . 1 . 1 370 370 LYS H H 1 8.2466 . . . . . . . . 370 LYS HN . 50701 1 596 . 1 . 1 370 370 LYS N N 15 123.0565 . . . . . . . . 370 LYS N . 50701 1 597 . 1 . 1 371 371 ILE H H 1 8.1123 . . . . . . . . 371 ILE HN . 50701 1 598 . 1 . 1 371 371 ILE N N 15 123.0587 . . . . . . . . 371 ILE N . 50701 1 599 . 1 . 1 372 372 GLU H H 1 8.4383 . . . . . . . . 372 GLU HN . 50701 1 600 . 1 . 1 372 372 GLU N N 15 125.9106 . . . . . . . . 372 GLU N . 50701 1 601 . 1 . 1 373 373 THR H H 1 8.1458 . . . . . . . . 373 THR HN . 50701 1 602 . 1 . 1 373 373 THR N N 15 115.8058 . . . . . . . . 373 THR N . 50701 1 603 . 1 . 1 374 374 HIS H H 1 8.4239 . . . . . . . . 374 HIS HN . 50701 1 604 . 1 . 1 374 374 HIS N N 15 121.1146 . . . . . . . . 374 HIS N . 50701 1 605 . 1 . 1 376 376 LEU H H 1 8.2495 . . . . . . . . 376 LEU HN . 50701 1 606 . 1 . 1 376 376 LEU N N 15 123.6391 . . . . . . . . 376 LEU N . 50701 1 607 . 1 . 1 377 377 THR H H 1 7.9928 . . . . . . . . 377 THR HN . 50701 1 608 . 1 . 1 377 377 THR N N 15 114.8114 . . . . . . . . 377 THR N . 50701 1 609 . 1 . 1 378 378 PHE H H 1 8.1878 . . . . . . . . 378 PHE HN . 50701 1 610 . 1 . 1 378 378 PHE N N 15 122.5487 . . . . . . . . 378 PHE N . 50701 1 611 . 1 . 1 379 379 ARG H H 1 8.0979 . . . . . . . . 379 ARG HN . 50701 1 612 . 1 . 1 379 379 ARG N N 15 122.7664 . . . . . . . . 379 ARG N . 50701 1 613 . 1 . 1 380 380 GLU H H 1 8.2825 . . . . . . . . 380 GLU HN . 50701 1 614 . 1 . 1 380 380 GLU N N 15 121.9823 . . . . . . . . 380 GLU N . 50701 1 615 . 1 . 1 381 381 ASN H H 1 8.3823 . . . . . . . . 381 ASN HN . 50701 1 616 . 1 . 1 381 381 ASN N N 15 119.7782 . . . . . . . . 381 ASN N . 50701 1 617 . 1 . 1 382 382 ALA H H 1 8.1450 . . . . . . . . 382 ALA HN . 50701 1 618 . 1 . 1 382 382 ALA N N 15 124.2790 . . . . . . . . 382 ALA N . 50701 1 619 . 1 . 1 383 383 LYS H H 1 8.0816 . . . . . . . . 383 LYS HN . 50701 1 620 . 1 . 1 383 383 LYS N N 15 119.9376 . . . . . . . . 383 LYS N . 50701 1 621 . 1 . 1 384 384 ALA H H 1 8.0842 . . . . . . . . 384 ALA HN . 50701 1 622 . 1 . 1 384 384 ALA N N 15 124.7213 . . . . . . . . 384 ALA N . 50701 1 623 . 1 . 1 385 385 LYS H H 1 8.2128 . . . . . . . . 385 LYS HN . 50701 1 624 . 1 . 1 385 385 LYS N N 15 120.6240 . . . . . . . . 385 LYS N . 50701 1 625 . 1 . 1 386 386 THR H H 1 8.0339 . . . . . . . . 386 THR HN . 50701 1 626 . 1 . 1 386 386 THR N N 15 114.4667 . . . . . . . . 386 THR N . 50701 1 627 . 1 . 1 387 387 ASP H H 1 8.2305 . . . . . . . . 387 ASP HN . 50701 1 628 . 1 . 1 387 387 ASP N N 15 122.5377 . . . . . . . . 387 ASP N . 50701 1 629 . 1 . 1 388 388 HIS H H 1 8.3820 . . . . . . . . 388 HIS HN . 50701 1 630 . 1 . 1 388 388 HIS N N 15 119.2912 . . . . . . . . 388 HIS N . 50701 1 631 . 1 . 1 389 389 GLY H H 1 8.4145 . . . . . . . . 389 GLY HN . 50701 1 632 . 1 . 1 389 389 GLY N N 15 109.7516 . . . . . . . . 389 GLY N . 50701 1 633 . 1 . 1 390 390 ALA H H 1 8.0615 . . . . . . . . 390 ALA HN . 50701 1 634 . 1 . 1 390 390 ALA N N 15 123.5668 . . . . . . . . 390 ALA N . 50701 1 635 . 1 . 1 391 391 GLU H H 1 8.2849 . . . . . . . . 391 GLU HN . 50701 1 636 . 1 . 1 391 391 GLU N N 15 120.0863 . . . . . . . . 391 GLU N . 50701 1 637 . 1 . 1 392 392 ILE H H 1 8.0498 . . . . . . . . 392 ILE HN . 50701 1 638 . 1 . 1 392 392 ILE N N 15 122.7539 . . . . . . . . 392 ILE N . 50701 1 639 . 1 . 1 393 393 VAL H H 1 8.0133 . . . . . . . . 393 VAL HN . 50701 1 640 . 1 . 1 393 393 VAL N N 15 124.9213 . . . . . . . . 393 VAL N . 50701 1 641 . 1 . 1 394 394 TYR H H 1 8.2700 . . . . . . . . 394 TYR HN . 50701 1 642 . 1 . 1 394 394 TYR N N 15 125.3802 . . . . . . . . 394 TYR N . 50701 1 643 . 1 . 1 395 395 LYS H H 1 8.0114 . . . . . . . . 395 LYS HN . 50701 1 644 . 1 . 1 395 395 LYS N N 15 124.4132 . . . . . . . . 395 LYS N . 50701 1 645 . 1 . 1 396 396 SER H H 1 8.2109 . . . . . . . . 396 SER HN . 50701 1 646 . 1 . 1 396 396 SER N N 15 119.0713 . . . . . . . . 396 SER N . 50701 1 647 . 1 . 1 398 398 VAL H H 1 8.0710 . . . . . . . . 398 VAL HN . 50701 1 648 . 1 . 1 398 398 VAL N N 15 120.6937 . . . . . . . . 398 VAL N . 50701 1 649 . 1 . 1 399 399 VAL H H 1 8.1758 . . . . . . . . 399 VAL HN . 50701 1 650 . 1 . 1 399 399 VAL N N 15 124.5745 . . . . . . . . 399 VAL N . 50701 1 651 . 1 . 1 400 400 SER H H 1 8.3238 . . . . . . . . 400 SER HN . 50701 1 652 . 1 . 1 400 400 SER N N 15 119.8767 . . . . . . . . 400 SER N . 50701 1 653 . 1 . 1 401 401 GLY H H 1 8.3530 . . . . . . . . 401 GLY HN . 50701 1 654 . 1 . 1 401 401 GLY N N 15 111.1193 . . . . . . . . 401 GLY N . 50701 1 655 . 1 . 1 402 402 ASP H H 1 8.1553 . . . . . . . . 402 ASP HN . 50701 1 656 . 1 . 1 402 402 ASP N N 15 120.4212 . . . . . . . . 402 ASP N . 50701 1 657 . 1 . 1 403 403 THR H H 1 8.0932 . . . . . . . . 403 THR HN . 50701 1 658 . 1 . 1 403 403 THR N N 15 114.1293 . . . . . . . . 403 THR N . 50701 1 659 . 1 . 1 408 408 LEU H H 1 8.1944 . . . . . . . . 408 LEU HN . 50701 1 660 . 1 . 1 408 408 LEU N N 15 123.6690 . . . . . . . . 408 LEU N . 50701 1 661 . 1 . 1 409 409 SER H H 1 8.2274 . . . . . . . . 409 SER HN . 50701 1 662 . 1 . 1 409 409 SER N N 15 116.1716 . . . . . . . . 409 SER N . 50701 1 663 . 1 . 1 410 410 ASN H H 1 8.3851 . . . . . . . . 410 ASN HN . 50701 1 664 . 1 . 1 410 410 ASN N N 15 120.6728 . . . . . . . . 410 ASN N . 50701 1 665 . 1 . 1 411 411 VAL H H 1 7.9541 . . . . . . . . 411 VAL HN . 50701 1 666 . 1 . 1 411 411 VAL N N 15 119.5122 . . . . . . . . 411 VAL N . 50701 1 667 . 1 . 1 412 412 SER H H 1 8.3208 . . . . . . . . 412 SER HN . 50701 1 668 . 1 . 1 412 412 SER N N 15 119.2195 . . . . . . . . 412 SER N . 50701 1 669 . 1 . 1 413 413 SER H H 1 8.3727 . . . . . . . . 413 SER HN . 50701 1 670 . 1 . 1 413 413 SER N N 15 118.1065 . . . . . . . . 413 SER N . 50701 1 671 . 1 . 1 414 414 THR H H 1 8.1040 . . . . . . . . 414 THR HN . 50701 1 672 . 1 . 1 414 414 THR N N 15 114.7317 . . . . . . . . 414 THR N . 50701 1 673 . 1 . 1 415 415 GLY H H 1 8.2366 . . . . . . . . 415 GLY HN . 50701 1 674 . 1 . 1 415 415 GLY N N 15 110.9966 . . . . . . . . 415 GLY N . 50701 1 675 . 1 . 1 416 416 SER H H 1 8.0575 . . . . . . . . 416 SER HN . 50701 1 676 . 1 . 1 416 416 SER N N 15 115.5976 . . . . . . . . 416 SER N . 50701 1 677 . 1 . 1 417 417 ILE H H 1 8.1202 . . . . . . . . 417 ILE HN . 50701 1 678 . 1 . 1 417 417 ILE N N 15 121.9109 . . . . . . . . 417 ILE N . 50701 1 679 . 1 . 1 418 418 ASP H H 1 8.2356 . . . . . . . . 418 ASP HN . 50701 1 680 . 1 . 1 418 418 ASP N N 15 123.5785 . . . . . . . . 418 ASP N . 50701 1 681 . 1 . 1 419 419 MET H H 1 8.1341 . . . . . . . . 419 MET HN . 50701 1 682 . 1 . 1 419 419 MET N N 15 120.7647 . . . . . . . . 419 MET N . 50701 1 683 . 1 . 1 420 420 VAL H H 1 8.0088 . . . . . . . . 420 VAL HN . 50701 1 684 . 1 . 1 420 420 VAL N N 15 120.9246 . . . . . . . . 420 VAL N . 50701 1 685 . 1 . 1 421 421 ASP H H 1 8.2808 . . . . . . . . 421 ASP HN . 50701 1 686 . 1 . 1 421 421 ASP N N 15 123.3504 . . . . . . . . 421 ASP N . 50701 1 687 . 1 . 1 422 422 SER H H 1 8.0344 . . . . . . . . 422 SER HN . 50701 1 688 . 1 . 1 422 422 SER N N 15 116.7302 . . . . . . . . 422 SER N . 50701 1 689 . 1 . 1 424 424 GLN H H 1 8.3545 . . . . . . . . 424 GLN HN . 50701 1 690 . 1 . 1 424 424 GLN N N 15 120.1871 . . . . . . . . 424 GLN N . 50701 1 691 . 1 . 1 425 425 LEU H H 1 8.0933 . . . . . . . . 425 LEU HN . 50701 1 692 . 1 . 1 425 425 LEU N N 15 123.4086 . . . . . . . . 425 LEU N . 50701 1 693 . 1 . 1 426 426 ALA H H 1 8.1776 . . . . . . . . 426 ALA HN . 50701 1 694 . 1 . 1 426 426 ALA N N 15 124.5720 . . . . . . . . 426 ALA N . 50701 1 695 . 1 . 1 427 427 THR H H 1 7.9765 . . . . . . . . 427 THR HN . 50701 1 696 . 1 . 1 427 427 THR N N 15 113.1922 . . . . . . . . 427 THR N . 50701 1 697 . 1 . 1 428 428 LEU H H 1 8.1269 . . . . . . . . 428 LEU HN . 50701 1 698 . 1 . 1 428 428 LEU N N 15 124.4380 . . . . . . . . 428 LEU N . 50701 1 699 . 1 . 1 429 429 ALA H H 1 8.1535 . . . . . . . . 429 ALA HN . 50701 1 700 . 1 . 1 429 429 ALA N N 15 124.2130 . . . . . . . . 429 ALA N . 50701 1 701 . 1 . 1 430 430 ASP H H 1 8.1014 . . . . . . . . 430 ASP HN . 50701 1 702 . 1 . 1 430 430 ASP N N 15 119.2024 . . . . . . . . 430 ASP N . 50701 1 703 . 1 . 1 431 431 GLU H H 1 8.2226 . . . . . . . . 431 GLU HN . 50701 1 704 . 1 . 1 431 431 GLU N N 15 120.9902 . . . . . . . . 431 GLU N . 50701 1 705 . 1 . 1 432 432 VAL H H 1 8.0461 . . . . . . . . 432 VAL HN . 50701 1 706 . 1 . 1 432 432 VAL N N 15 120.9323 . . . . . . . . 432 VAL N . 50701 1 707 . 1 . 1 433 433 SER H H 1 8.2134 . . . . . . . . 433 SER HN . 50701 1 708 . 1 . 1 433 433 SER N N 15 118.1250 . . . . . . . . 433 SER N . 50701 1 709 . 1 . 1 434 434 ALA H H 1 8.1802 . . . . . . . . 434 ALA HN . 50701 1 710 . 1 . 1 434 434 ALA N N 15 125.4867 . . . . . . . . 434 ALA N . 50701 1 711 . 1 . 1 435 435 SER H H 1 7.9964 . . . . . . . . 435 SER HN . 50701 1 712 . 1 . 1 435 435 SER N N 15 114.0582 . . . . . . . . 435 SER N . 50701 1 713 . 1 . 1 436 436 LEU H H 1 7.9188 . . . . . . . . 436 LEU HN . 50701 1 714 . 1 . 1 436 436 LEU N N 15 123.4181 . . . . . . . . 436 LEU N . 50701 1 715 . 1 . 1 437 437 ALA H H 1 7.9282 . . . . . . . . 437 ALA HN . 50701 1 716 . 1 . 1 437 437 ALA N N 15 123.3260 . . . . . . . . 437 ALA N . 50701 1 717 . 1 . 1 438 438 LYS H H 1 7.9514 . . . . . . . . 438 LYS HN . 50701 1 718 . 1 . 1 438 438 LYS N N 15 119.6075 . . . . . . . . 438 LYS N . 50701 1 719 . 1 . 1 439 439 GLN H H 1 8.1281 . . . . . . . . 439 GLN HN . 50701 1 720 . 1 . 1 439 439 GLN N N 15 120.7193 . . . . . . . . 439 GLN N . 50701 1 721 . 1 . 1 440 440 GLY H H 1 8.2577 . . . . . . . . 440 GLY HN . 50701 1 722 . 1 . 1 440 440 GLY N N 15 110.2815 . . . . . . . . 440 GLY N . 50701 1 723 . 1 . 1 441 441 LEU H H 1 7.6442 . . . . . . . . 441 LEU HN . 50701 1 724 . 1 . 1 441 441 LEU N N 15 126.9762 . . . . . . . . 441 LEU N . 50701 1 stop_ save_