data_52667 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52667 _Entry.Title ; Backbone 1H, 13C and 15N Chemical Shift Assignments and Relaxation Parameters for USP14-USP domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-10-26 _Entry.Accession_date 2024-10-26 _Entry.Last_release_date 2024-10-28 _Entry.Original_release_date 2024-10-28 _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 . _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 Johannes Salomonsson . . . . 52667 2 Linda Sjostrand . . . . 52667 3 Arvid Eskilson . . . . 52667 4 Dean Derbyshire . . . . 52667 5 Padraig D'Arcy . . . . 52667 6 Maria Sunnerhagen . . . . 52667 7 Alexandra Ahlner . . . . 52667 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52667 heteronucl_NOEs 1 52667 heteronucl_T1_relaxation 2 52667 heteronucl_T2_relaxation 2 52667 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1010 52667 '15N chemical shifts' 311 52667 '1H chemical shifts' 311 52667 'T1 relaxation values' 538 52667 'T2 relaxation values' 526 52667 'heteronuclear NOE values' 280 52667 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 . . 2025-04-07 . original BMRB . 52667 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52667 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 40095364 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Dynamic networks connect the USP14 active site region with the proteasome interaction surface ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full . _Citation.Journal_volume 34 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1469-896X _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 e70077 _Citation.Page_last e70077 _Citation.Year 2025 _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 Johannes Salomonsson . . . . 52667 1 2 Linda Sjostrand . . . . 52667 1 3 Arvid Eskilson . . . . 52667 1 4 Dean Derbyshire . . . . 52667 1 5 Padraig D'Arcy . . . . 52667 1 6 Maria Sunnerhagen . . . . 52667 1 7 Alexandra Ahlner . . . . 52667 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52667 _Assembly.ID 1 _Assembly.Name 'USP14-USP monomer' _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 'USP14-USP monomer' 1 $entity_1 . . yes native no no . . . 52667 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52667 _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 ; MPLYSVTVKWGKEKFEGVEL NTDEPPMVFKAQLFALTGVQ PARQKVMVKGGTLKDDDWGN IKIKNGMTLLMMGSADALPE EPSAKTVFVEDMTEEQLASA MELPCGLTNLGNTCYMNATV QCIRSVPELKDALKRYAGAL RASGEMASAQYITAALRDLF DSMDKTSSSIPPIILLQFLH MAFPQFAEKGEQGQYLQQDA NECWIQMMRVLQQKLEAIED DSVKETDSSSASAATPSKKK SLIDQFFGVEFETTMKCTES EEEEVTKGKENQLQLSCFIN QEVKYLFTGLKLRLQEEITK QSPTLQRNALYIKSSKISRL PAYLTIQMVRFFYKEKESVN AKVLKDVKFPLMLDMYELCT PELQEKMVSFRSKFKDLEDK KVNQQPNTSDKKSSPQKEVK YEPFSFADDIGSNNCGYYDL QAVLTHQGRSSSSGHYVSWV KRKQDEWIKFDDDKVSIVTP EDILRLSGGGDWHIAYVLLY GPRRVEIMEEESEQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 494 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 52667 1 2 . PRO . 52667 1 3 . LEU . 52667 1 4 . TYR . 52667 1 5 . SER . 52667 1 6 . VAL . 52667 1 7 . THR . 52667 1 8 . VAL . 52667 1 9 . LYS . 52667 1 10 . TRP . 52667 1 11 . GLY . 52667 1 12 . LYS . 52667 1 13 . GLU . 52667 1 14 . LYS . 52667 1 15 . PHE . 52667 1 16 . GLU . 52667 1 17 . GLY . 52667 1 18 . VAL . 52667 1 19 . GLU . 52667 1 20 . LEU . 52667 1 21 . ASN . 52667 1 22 . THR . 52667 1 23 . ASP . 52667 1 24 . GLU . 52667 1 25 . PRO . 52667 1 26 . PRO . 52667 1 27 . MET . 52667 1 28 . VAL . 52667 1 29 . PHE . 52667 1 30 . LYS . 52667 1 31 . ALA . 52667 1 32 . GLN . 52667 1 33 . LEU . 52667 1 34 . PHE . 52667 1 35 . ALA . 52667 1 36 . LEU . 52667 1 37 . THR . 52667 1 38 . GLY . 52667 1 39 . VAL . 52667 1 40 . GLN . 52667 1 41 . PRO . 52667 1 42 . ALA . 52667 1 43 . ARG . 52667 1 44 . GLN . 52667 1 45 . LYS . 52667 1 46 . VAL . 52667 1 47 . MET . 52667 1 48 . VAL . 52667 1 49 . LYS . 52667 1 50 . GLY . 52667 1 51 . GLY . 52667 1 52 . THR . 52667 1 53 . LEU . 52667 1 54 . LYS . 52667 1 55 . ASP . 52667 1 56 . ASP . 52667 1 57 . ASP . 52667 1 58 . TRP . 52667 1 59 . GLY . 52667 1 60 . ASN . 52667 1 61 . ILE . 52667 1 62 . LYS . 52667 1 63 . ILE . 52667 1 64 . LYS . 52667 1 65 . ASN . 52667 1 66 . GLY . 52667 1 67 . MET . 52667 1 68 . THR . 52667 1 69 . LEU . 52667 1 70 . LEU . 52667 1 71 . MET . 52667 1 72 . MET . 52667 1 73 . GLY . 52667 1 74 . SER . 52667 1 75 . ALA . 52667 1 76 . ASP . 52667 1 77 . ALA . 52667 1 78 . LEU . 52667 1 79 . PRO . 52667 1 80 . GLU . 52667 1 81 . GLU . 52667 1 82 . PRO . 52667 1 83 . SER . 52667 1 84 . ALA . 52667 1 85 . LYS . 52667 1 86 . THR . 52667 1 87 . VAL . 52667 1 88 . PHE . 52667 1 89 . VAL . 52667 1 90 . GLU . 52667 1 91 . ASP . 52667 1 92 . MET . 52667 1 93 . THR . 52667 1 94 . GLU . 52667 1 95 . GLU . 52667 1 96 . GLN . 52667 1 97 . LEU . 52667 1 98 . ALA . 52667 1 99 . SER . 52667 1 100 . ALA . 52667 1 101 . MET . 52667 1 102 . GLU . 52667 1 103 . LEU . 52667 1 104 . PRO . 52667 1 105 . CYS . 52667 1 106 . GLY . 52667 1 107 . LEU . 52667 1 108 . THR . 52667 1 109 . ASN . 52667 1 110 . LEU . 52667 1 111 . GLY . 52667 1 112 . ASN . 52667 1 113 . THR . 52667 1 114 . CYS . 52667 1 115 . TYR . 52667 1 116 . MET . 52667 1 117 . ASN . 52667 1 118 . ALA . 52667 1 119 . THR . 52667 1 120 . VAL . 52667 1 121 . GLN . 52667 1 122 . CYS . 52667 1 123 . ILE . 52667 1 124 . ARG . 52667 1 125 . SER . 52667 1 126 . VAL . 52667 1 127 . PRO . 52667 1 128 . GLU . 52667 1 129 . LEU . 52667 1 130 . LYS . 52667 1 131 . ASP . 52667 1 132 . ALA . 52667 1 133 . LEU . 52667 1 134 . LYS . 52667 1 135 . ARG . 52667 1 136 . TYR . 52667 1 137 . ALA . 52667 1 138 . GLY . 52667 1 139 . ALA . 52667 1 140 . LEU . 52667 1 141 . ARG . 52667 1 142 . ALA . 52667 1 143 . SER . 52667 1 144 . GLY . 52667 1 145 . GLU . 52667 1 146 . MET . 52667 1 147 . ALA . 52667 1 148 . SER . 52667 1 149 . ALA . 52667 1 150 . GLN . 52667 1 151 . TYR . 52667 1 152 . ILE . 52667 1 153 . THR . 52667 1 154 . ALA . 52667 1 155 . ALA . 52667 1 156 . LEU . 52667 1 157 . ARG . 52667 1 158 . ASP . 52667 1 159 . LEU . 52667 1 160 . PHE . 52667 1 161 . ASP . 52667 1 162 . SER . 52667 1 163 . MET . 52667 1 164 . ASP . 52667 1 165 . LYS . 52667 1 166 . THR . 52667 1 167 . SER . 52667 1 168 . SER . 52667 1 169 . SER . 52667 1 170 . ILE . 52667 1 171 . PRO . 52667 1 172 . PRO . 52667 1 173 . ILE . 52667 1 174 . ILE . 52667 1 175 . LEU . 52667 1 176 . LEU . 52667 1 177 . GLN . 52667 1 178 . PHE . 52667 1 179 . LEU . 52667 1 180 . HIS . 52667 1 181 . MET . 52667 1 182 . ALA . 52667 1 183 . PHE . 52667 1 184 . PRO . 52667 1 185 . GLN . 52667 1 186 . PHE . 52667 1 187 . ALA . 52667 1 188 . GLU . 52667 1 189 . LYS . 52667 1 190 . GLY . 52667 1 191 . GLU . 52667 1 192 . GLN . 52667 1 193 . GLY . 52667 1 194 . GLN . 52667 1 195 . TYR . 52667 1 196 . LEU . 52667 1 197 . GLN . 52667 1 198 . GLN . 52667 1 199 . ASP . 52667 1 200 . ALA . 52667 1 201 . ASN . 52667 1 202 . GLU . 52667 1 203 . CYS . 52667 1 204 . TRP . 52667 1 205 . ILE . 52667 1 206 . GLN . 52667 1 207 . MET . 52667 1 208 . MET . 52667 1 209 . ARG . 52667 1 210 . VAL . 52667 1 211 . LEU . 52667 1 212 . GLN . 52667 1 213 . GLN . 52667 1 214 . LYS . 52667 1 215 . LEU . 52667 1 216 . GLU . 52667 1 217 . ALA . 52667 1 218 . ILE . 52667 1 219 . GLU . 52667 1 220 . ASP . 52667 1 221 . ASP . 52667 1 222 . SER . 52667 1 223 . VAL . 52667 1 224 . LYS . 52667 1 225 . GLU . 52667 1 226 . THR . 52667 1 227 . ASP . 52667 1 228 . SER . 52667 1 229 . SER . 52667 1 230 . SER . 52667 1 231 . ALA . 52667 1 232 . SER . 52667 1 233 . ALA . 52667 1 234 . ALA . 52667 1 235 . THR . 52667 1 236 . PRO . 52667 1 237 . SER . 52667 1 238 . LYS . 52667 1 239 . LYS . 52667 1 240 . LYS . 52667 1 241 . SER . 52667 1 242 . LEU . 52667 1 243 . ILE . 52667 1 244 . ASP . 52667 1 245 . GLN . 52667 1 246 . PHE . 52667 1 247 . PHE . 52667 1 248 . GLY . 52667 1 249 . VAL . 52667 1 250 . GLU . 52667 1 251 . PHE . 52667 1 252 . GLU . 52667 1 253 . THR . 52667 1 254 . THR . 52667 1 255 . MET . 52667 1 256 . LYS . 52667 1 257 . CYS . 52667 1 258 . THR . 52667 1 259 . GLU . 52667 1 260 . SER . 52667 1 261 . GLU . 52667 1 262 . GLU . 52667 1 263 . GLU . 52667 1 264 . GLU . 52667 1 265 . VAL . 52667 1 266 . THR . 52667 1 267 . LYS . 52667 1 268 . GLY . 52667 1 269 . LYS . 52667 1 270 . GLU . 52667 1 271 . ASN . 52667 1 272 . GLN . 52667 1 273 . LEU . 52667 1 274 . GLN . 52667 1 275 . LEU . 52667 1 276 . SER . 52667 1 277 . CYS . 52667 1 278 . PHE . 52667 1 279 . ILE . 52667 1 280 . ASN . 52667 1 281 . GLN . 52667 1 282 . GLU . 52667 1 283 . VAL . 52667 1 284 . LYS . 52667 1 285 . TYR . 52667 1 286 . LEU . 52667 1 287 . PHE . 52667 1 288 . THR . 52667 1 289 . GLY . 52667 1 290 . LEU . 52667 1 291 . LYS . 52667 1 292 . LEU . 52667 1 293 . ARG . 52667 1 294 . LEU . 52667 1 295 . GLN . 52667 1 296 . GLU . 52667 1 297 . GLU . 52667 1 298 . ILE . 52667 1 299 . THR . 52667 1 300 . LYS . 52667 1 301 . GLN . 52667 1 302 . SER . 52667 1 303 . PRO . 52667 1 304 . THR . 52667 1 305 . LEU . 52667 1 306 . GLN . 52667 1 307 . ARG . 52667 1 308 . ASN . 52667 1 309 . ALA . 52667 1 310 . LEU . 52667 1 311 . TYR . 52667 1 312 . ILE . 52667 1 313 . LYS . 52667 1 314 . SER . 52667 1 315 . SER . 52667 1 316 . LYS . 52667 1 317 . ILE . 52667 1 318 . SER . 52667 1 319 . ARG . 52667 1 320 . LEU . 52667 1 321 . PRO . 52667 1 322 . ALA . 52667 1 323 . TYR . 52667 1 324 . LEU . 52667 1 325 . THR . 52667 1 326 . ILE . 52667 1 327 . GLN . 52667 1 328 . MET . 52667 1 329 . VAL . 52667 1 330 . ARG . 52667 1 331 . PHE . 52667 1 332 . PHE . 52667 1 333 . TYR . 52667 1 334 . LYS . 52667 1 335 . GLU . 52667 1 336 . LYS . 52667 1 337 . GLU . 52667 1 338 . SER . 52667 1 339 . VAL . 52667 1 340 . ASN . 52667 1 341 . ALA . 52667 1 342 . LYS . 52667 1 343 . VAL . 52667 1 344 . LEU . 52667 1 345 . LYS . 52667 1 346 . ASP . 52667 1 347 . VAL . 52667 1 348 . LYS . 52667 1 349 . PHE . 52667 1 350 . PRO . 52667 1 351 . LEU . 52667 1 352 . MET . 52667 1 353 . LEU . 52667 1 354 . ASP . 52667 1 355 . MET . 52667 1 356 . TYR . 52667 1 357 . GLU . 52667 1 358 . LEU . 52667 1 359 . CYS . 52667 1 360 . THR . 52667 1 361 . PRO . 52667 1 362 . GLU . 52667 1 363 . LEU . 52667 1 364 . GLN . 52667 1 365 . GLU . 52667 1 366 . LYS . 52667 1 367 . MET . 52667 1 368 . VAL . 52667 1 369 . SER . 52667 1 370 . PHE . 52667 1 371 . ARG . 52667 1 372 . SER . 52667 1 373 . LYS . 52667 1 374 . PHE . 52667 1 375 . LYS . 52667 1 376 . ASP . 52667 1 377 . LEU . 52667 1 378 . GLU . 52667 1 379 . ASP . 52667 1 380 . LYS . 52667 1 381 . LYS . 52667 1 382 . VAL . 52667 1 383 . ASN . 52667 1 384 . GLN . 52667 1 385 . GLN . 52667 1 386 . PRO . 52667 1 387 . ASN . 52667 1 388 . THR . 52667 1 389 . SER . 52667 1 390 . ASP . 52667 1 391 . LYS . 52667 1 392 . LYS . 52667 1 393 . SER . 52667 1 394 . SER . 52667 1 395 . PRO . 52667 1 396 . GLN . 52667 1 397 . LYS . 52667 1 398 . GLU . 52667 1 399 . VAL . 52667 1 400 . LYS . 52667 1 401 . TYR . 52667 1 402 . GLU . 52667 1 403 . PRO . 52667 1 404 . PHE . 52667 1 405 . SER . 52667 1 406 . PHE . 52667 1 407 . ALA . 52667 1 408 . ASP . 52667 1 409 . ASP . 52667 1 410 . ILE . 52667 1 411 . GLY . 52667 1 412 . SER . 52667 1 413 . ASN . 52667 1 414 . ASN . 52667 1 415 . CYS . 52667 1 416 . GLY . 52667 1 417 . TYR . 52667 1 418 . TYR . 52667 1 419 . ASP . 52667 1 420 . LEU . 52667 1 421 . GLN . 52667 1 422 . ALA . 52667 1 423 . VAL . 52667 1 424 . LEU . 52667 1 425 . THR . 52667 1 426 . HIS . 52667 1 427 . GLN . 52667 1 428 . GLY . 52667 1 429 . ARG . 52667 1 430 . SER . 52667 1 431 . SER . 52667 1 432 . SER . 52667 1 433 . SER . 52667 1 434 . GLY . 52667 1 435 . HIS . 52667 1 436 . TYR . 52667 1 437 . VAL . 52667 1 438 . SER . 52667 1 439 . TRP . 52667 1 440 . VAL . 52667 1 441 . LYS . 52667 1 442 . ARG . 52667 1 443 . LYS . 52667 1 444 . GLN . 52667 1 445 . ASP . 52667 1 446 . GLU . 52667 1 447 . TRP . 52667 1 448 . ILE . 52667 1 449 . LYS . 52667 1 450 . PHE . 52667 1 451 . ASP . 52667 1 452 . ASP . 52667 1 453 . ASP . 52667 1 454 . LYS . 52667 1 455 . VAL . 52667 1 456 . SER . 52667 1 457 . ILE . 52667 1 458 . VAL . 52667 1 459 . THR . 52667 1 460 . PRO . 52667 1 461 . GLU . 52667 1 462 . ASP . 52667 1 463 . ILE . 52667 1 464 . LEU . 52667 1 465 . ARG . 52667 1 466 . LEU . 52667 1 467 . SER . 52667 1 468 . GLY . 52667 1 469 . GLY . 52667 1 470 . GLY . 52667 1 471 . ASP . 52667 1 472 . TRP . 52667 1 473 . HIS . 52667 1 474 . ILE . 52667 1 475 . ALA . 52667 1 476 . TYR . 52667 1 477 . VAL . 52667 1 478 . LEU . 52667 1 479 . LEU . 52667 1 480 . TYR . 52667 1 481 . GLY . 52667 1 482 . PRO . 52667 1 483 . ARG . 52667 1 484 . ARG . 52667 1 485 . VAL . 52667 1 486 . GLU . 52667 1 487 . ILE . 52667 1 488 . MET . 52667 1 489 . GLU . 52667 1 490 . GLU . 52667 1 491 . GLU . 52667 1 492 . SER . 52667 1 493 . GLU . 52667 1 494 . GLN . 52667 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 52667 1 . PRO 2 2 52667 1 . LEU 3 3 52667 1 . TYR 4 4 52667 1 . SER 5 5 52667 1 . VAL 6 6 52667 1 . THR 7 7 52667 1 . VAL 8 8 52667 1 . LYS 9 9 52667 1 . TRP 10 10 52667 1 . GLY 11 11 52667 1 . LYS 12 12 52667 1 . GLU 13 13 52667 1 . LYS 14 14 52667 1 . PHE 15 15 52667 1 . GLU 16 16 52667 1 . GLY 17 17 52667 1 . VAL 18 18 52667 1 . GLU 19 19 52667 1 . LEU 20 20 52667 1 . ASN 21 21 52667 1 . THR 22 22 52667 1 . ASP 23 23 52667 1 . GLU 24 24 52667 1 . PRO 25 25 52667 1 . PRO 26 26 52667 1 . MET 27 27 52667 1 . VAL 28 28 52667 1 . PHE 29 29 52667 1 . LYS 30 30 52667 1 . ALA 31 31 52667 1 . GLN 32 32 52667 1 . LEU 33 33 52667 1 . PHE 34 34 52667 1 . ALA 35 35 52667 1 . LEU 36 36 52667 1 . THR 37 37 52667 1 . GLY 38 38 52667 1 . VAL 39 39 52667 1 . GLN 40 40 52667 1 . PRO 41 41 52667 1 . ALA 42 42 52667 1 . ARG 43 43 52667 1 . GLN 44 44 52667 1 . LYS 45 45 52667 1 . VAL 46 46 52667 1 . MET 47 47 52667 1 . VAL 48 48 52667 1 . LYS 49 49 52667 1 . GLY 50 50 52667 1 . GLY 51 51 52667 1 . THR 52 52 52667 1 . LEU 53 53 52667 1 . LYS 54 54 52667 1 . ASP 55 55 52667 1 . ASP 56 56 52667 1 . ASP 57 57 52667 1 . TRP 58 58 52667 1 . GLY 59 59 52667 1 . ASN 60 60 52667 1 . ILE 61 61 52667 1 . LYS 62 62 52667 1 . ILE 63 63 52667 1 . LYS 64 64 52667 1 . ASN 65 65 52667 1 . GLY 66 66 52667 1 . MET 67 67 52667 1 . THR 68 68 52667 1 . LEU 69 69 52667 1 . LEU 70 70 52667 1 . MET 71 71 52667 1 . MET 72 72 52667 1 . GLY 73 73 52667 1 . SER 74 74 52667 1 . ALA 75 75 52667 1 . ASP 76 76 52667 1 . ALA 77 77 52667 1 . LEU 78 78 52667 1 . PRO 79 79 52667 1 . GLU 80 80 52667 1 . GLU 81 81 52667 1 . PRO 82 82 52667 1 . SER 83 83 52667 1 . ALA 84 84 52667 1 . LYS 85 85 52667 1 . THR 86 86 52667 1 . VAL 87 87 52667 1 . PHE 88 88 52667 1 . VAL 89 89 52667 1 . GLU 90 90 52667 1 . ASP 91 91 52667 1 . MET 92 92 52667 1 . THR 93 93 52667 1 . GLU 94 94 52667 1 . GLU 95 95 52667 1 . GLN 96 96 52667 1 . LEU 97 97 52667 1 . ALA 98 98 52667 1 . SER 99 99 52667 1 . ALA 100 100 52667 1 . MET 101 101 52667 1 . GLU 102 102 52667 1 . LEU 103 103 52667 1 . PRO 104 104 52667 1 . CYS 105 105 52667 1 . GLY 106 106 52667 1 . LEU 107 107 52667 1 . THR 108 108 52667 1 . ASN 109 109 52667 1 . LEU 110 110 52667 1 . GLY 111 111 52667 1 . ASN 112 112 52667 1 . THR 113 113 52667 1 . CYS 114 114 52667 1 . TYR 115 115 52667 1 . MET 116 116 52667 1 . ASN 117 117 52667 1 . ALA 118 118 52667 1 . THR 119 119 52667 1 . VAL 120 120 52667 1 . GLN 121 121 52667 1 . CYS 122 122 52667 1 . ILE 123 123 52667 1 . ARG 124 124 52667 1 . SER 125 125 52667 1 . VAL 126 126 52667 1 . PRO 127 127 52667 1 . GLU 128 128 52667 1 . LEU 129 129 52667 1 . LYS 130 130 52667 1 . ASP 131 131 52667 1 . ALA 132 132 52667 1 . LEU 133 133 52667 1 . LYS 134 134 52667 1 . ARG 135 135 52667 1 . TYR 136 136 52667 1 . ALA 137 137 52667 1 . GLY 138 138 52667 1 . ALA 139 139 52667 1 . LEU 140 140 52667 1 . ARG 141 141 52667 1 . ALA 142 142 52667 1 . SER 143 143 52667 1 . GLY 144 144 52667 1 . GLU 145 145 52667 1 . MET 146 146 52667 1 . ALA 147 147 52667 1 . SER 148 148 52667 1 . ALA 149 149 52667 1 . GLN 150 150 52667 1 . TYR 151 151 52667 1 . ILE 152 152 52667 1 . THR 153 153 52667 1 . ALA 154 154 52667 1 . ALA 155 155 52667 1 . LEU 156 156 52667 1 . ARG 157 157 52667 1 . ASP 158 158 52667 1 . LEU 159 159 52667 1 . PHE 160 160 52667 1 . ASP 161 161 52667 1 . SER 162 162 52667 1 . MET 163 163 52667 1 . ASP 164 164 52667 1 . LYS 165 165 52667 1 . THR 166 166 52667 1 . SER 167 167 52667 1 . SER 168 168 52667 1 . SER 169 169 52667 1 . ILE 170 170 52667 1 . PRO 171 171 52667 1 . PRO 172 172 52667 1 . ILE 173 173 52667 1 . ILE 174 174 52667 1 . LEU 175 175 52667 1 . LEU 176 176 52667 1 . GLN 177 177 52667 1 . PHE 178 178 52667 1 . LEU 179 179 52667 1 . HIS 180 180 52667 1 . MET 181 181 52667 1 . ALA 182 182 52667 1 . PHE 183 183 52667 1 . PRO 184 184 52667 1 . GLN 185 185 52667 1 . PHE 186 186 52667 1 . ALA 187 187 52667 1 . GLU 188 188 52667 1 . LYS 189 189 52667 1 . GLY 190 190 52667 1 . GLU 191 191 52667 1 . GLN 192 192 52667 1 . GLY 193 193 52667 1 . GLN 194 194 52667 1 . TYR 195 195 52667 1 . LEU 196 196 52667 1 . GLN 197 197 52667 1 . GLN 198 198 52667 1 . ASP 199 199 52667 1 . ALA 200 200 52667 1 . ASN 201 201 52667 1 . GLU 202 202 52667 1 . CYS 203 203 52667 1 . TRP 204 204 52667 1 . ILE 205 205 52667 1 . GLN 206 206 52667 1 . MET 207 207 52667 1 . MET 208 208 52667 1 . ARG 209 209 52667 1 . VAL 210 210 52667 1 . LEU 211 211 52667 1 . GLN 212 212 52667 1 . GLN 213 213 52667 1 . LYS 214 214 52667 1 . LEU 215 215 52667 1 . GLU 216 216 52667 1 . ALA 217 217 52667 1 . ILE 218 218 52667 1 . GLU 219 219 52667 1 . ASP 220 220 52667 1 . ASP 221 221 52667 1 . SER 222 222 52667 1 . VAL 223 223 52667 1 . LYS 224 224 52667 1 . GLU 225 225 52667 1 . THR 226 226 52667 1 . ASP 227 227 52667 1 . SER 228 228 52667 1 . SER 229 229 52667 1 . SER 230 230 52667 1 . ALA 231 231 52667 1 . SER 232 232 52667 1 . ALA 233 233 52667 1 . ALA 234 234 52667 1 . THR 235 235 52667 1 . PRO 236 236 52667 1 . SER 237 237 52667 1 . LYS 238 238 52667 1 . LYS 239 239 52667 1 . LYS 240 240 52667 1 . SER 241 241 52667 1 . LEU 242 242 52667 1 . ILE 243 243 52667 1 . ASP 244 244 52667 1 . GLN 245 245 52667 1 . PHE 246 246 52667 1 . PHE 247 247 52667 1 . GLY 248 248 52667 1 . VAL 249 249 52667 1 . GLU 250 250 52667 1 . PHE 251 251 52667 1 . GLU 252 252 52667 1 . THR 253 253 52667 1 . THR 254 254 52667 1 . MET 255 255 52667 1 . LYS 256 256 52667 1 . CYS 257 257 52667 1 . THR 258 258 52667 1 . GLU 259 259 52667 1 . SER 260 260 52667 1 . GLU 261 261 52667 1 . GLU 262 262 52667 1 . GLU 263 263 52667 1 . GLU 264 264 52667 1 . VAL 265 265 52667 1 . THR 266 266 52667 1 . LYS 267 267 52667 1 . GLY 268 268 52667 1 . LYS 269 269 52667 1 . GLU 270 270 52667 1 . ASN 271 271 52667 1 . GLN 272 272 52667 1 . LEU 273 273 52667 1 . GLN 274 274 52667 1 . LEU 275 275 52667 1 . SER 276 276 52667 1 . CYS 277 277 52667 1 . PHE 278 278 52667 1 . ILE 279 279 52667 1 . ASN 280 280 52667 1 . GLN 281 281 52667 1 . GLU 282 282 52667 1 . VAL 283 283 52667 1 . LYS 284 284 52667 1 . TYR 285 285 52667 1 . LEU 286 286 52667 1 . PHE 287 287 52667 1 . THR 288 288 52667 1 . GLY 289 289 52667 1 . LEU 290 290 52667 1 . LYS 291 291 52667 1 . LEU 292 292 52667 1 . ARG 293 293 52667 1 . LEU 294 294 52667 1 . GLN 295 295 52667 1 . GLU 296 296 52667 1 . GLU 297 297 52667 1 . ILE 298 298 52667 1 . THR 299 299 52667 1 . LYS 300 300 52667 1 . GLN 301 301 52667 1 . SER 302 302 52667 1 . PRO 303 303 52667 1 . THR 304 304 52667 1 . LEU 305 305 52667 1 . GLN 306 306 52667 1 . ARG 307 307 52667 1 . ASN 308 308 52667 1 . ALA 309 309 52667 1 . LEU 310 310 52667 1 . TYR 311 311 52667 1 . ILE 312 312 52667 1 . LYS 313 313 52667 1 . SER 314 314 52667 1 . SER 315 315 52667 1 . LYS 316 316 52667 1 . ILE 317 317 52667 1 . SER 318 318 52667 1 . ARG 319 319 52667 1 . LEU 320 320 52667 1 . PRO 321 321 52667 1 . ALA 322 322 52667 1 . TYR 323 323 52667 1 . LEU 324 324 52667 1 . THR 325 325 52667 1 . ILE 326 326 52667 1 . GLN 327 327 52667 1 . MET 328 328 52667 1 . VAL 329 329 52667 1 . ARG 330 330 52667 1 . PHE 331 331 52667 1 . PHE 332 332 52667 1 . TYR 333 333 52667 1 . LYS 334 334 52667 1 . GLU 335 335 52667 1 . LYS 336 336 52667 1 . GLU 337 337 52667 1 . SER 338 338 52667 1 . VAL 339 339 52667 1 . ASN 340 340 52667 1 . ALA 341 341 52667 1 . LYS 342 342 52667 1 . VAL 343 343 52667 1 . LEU 344 344 52667 1 . LYS 345 345 52667 1 . ASP 346 346 52667 1 . VAL 347 347 52667 1 . LYS 348 348 52667 1 . PHE 349 349 52667 1 . PRO 350 350 52667 1 . LEU 351 351 52667 1 . MET 352 352 52667 1 . LEU 353 353 52667 1 . ASP 354 354 52667 1 . MET 355 355 52667 1 . TYR 356 356 52667 1 . GLU 357 357 52667 1 . LEU 358 358 52667 1 . CYS 359 359 52667 1 . THR 360 360 52667 1 . PRO 361 361 52667 1 . GLU 362 362 52667 1 . LEU 363 363 52667 1 . GLN 364 364 52667 1 . GLU 365 365 52667 1 . LYS 366 366 52667 1 . MET 367 367 52667 1 . VAL 368 368 52667 1 . SER 369 369 52667 1 . PHE 370 370 52667 1 . ARG 371 371 52667 1 . SER 372 372 52667 1 . LYS 373 373 52667 1 . PHE 374 374 52667 1 . LYS 375 375 52667 1 . ASP 376 376 52667 1 . LEU 377 377 52667 1 . GLU 378 378 52667 1 . ASP 379 379 52667 1 . LYS 380 380 52667 1 . LYS 381 381 52667 1 . VAL 382 382 52667 1 . ASN 383 383 52667 1 . GLN 384 384 52667 1 . GLN 385 385 52667 1 . PRO 386 386 52667 1 . ASN 387 387 52667 1 . THR 388 388 52667 1 . SER 389 389 52667 1 . ASP 390 390 52667 1 . LYS 391 391 52667 1 . LYS 392 392 52667 1 . SER 393 393 52667 1 . SER 394 394 52667 1 . PRO 395 395 52667 1 . GLN 396 396 52667 1 . LYS 397 397 52667 1 . GLU 398 398 52667 1 . VAL 399 399 52667 1 . LYS 400 400 52667 1 . TYR 401 401 52667 1 . GLU 402 402 52667 1 . PRO 403 403 52667 1 . PHE 404 404 52667 1 . SER 405 405 52667 1 . PHE 406 406 52667 1 . ALA 407 407 52667 1 . ASP 408 408 52667 1 . ASP 409 409 52667 1 . ILE 410 410 52667 1 . GLY 411 411 52667 1 . SER 412 412 52667 1 . ASN 413 413 52667 1 . ASN 414 414 52667 1 . CYS 415 415 52667 1 . GLY 416 416 52667 1 . TYR 417 417 52667 1 . TYR 418 418 52667 1 . ASP 419 419 52667 1 . LEU 420 420 52667 1 . GLN 421 421 52667 1 . ALA 422 422 52667 1 . VAL 423 423 52667 1 . LEU 424 424 52667 1 . THR 425 425 52667 1 . HIS 426 426 52667 1 . GLN 427 427 52667 1 . GLY 428 428 52667 1 . ARG 429 429 52667 1 . SER 430 430 52667 1 . SER 431 431 52667 1 . SER 432 432 52667 1 . SER 433 433 52667 1 . GLY 434 434 52667 1 . HIS 435 435 52667 1 . TYR 436 436 52667 1 . VAL 437 437 52667 1 . SER 438 438 52667 1 . TRP 439 439 52667 1 . VAL 440 440 52667 1 . LYS 441 441 52667 1 . ARG 442 442 52667 1 . LYS 443 443 52667 1 . GLN 444 444 52667 1 . ASP 445 445 52667 1 . GLU 446 446 52667 1 . TRP 447 447 52667 1 . ILE 448 448 52667 1 . LYS 449 449 52667 1 . PHE 450 450 52667 1 . ASP 451 451 52667 1 . ASP 452 452 52667 1 . ASP 453 453 52667 1 . LYS 454 454 52667 1 . VAL 455 455 52667 1 . SER 456 456 52667 1 . ILE 457 457 52667 1 . VAL 458 458 52667 1 . THR 459 459 52667 1 . PRO 460 460 52667 1 . GLU 461 461 52667 1 . ASP 462 462 52667 1 . ILE 463 463 52667 1 . LEU 464 464 52667 1 . ARG 465 465 52667 1 . LEU 466 466 52667 1 . SER 467 467 52667 1 . GLY 468 468 52667 1 . GLY 469 469 52667 1 . GLY 470 470 52667 1 . ASP 471 471 52667 1 . TRP 472 472 52667 1 . HIS 473 473 52667 1 . ILE 474 474 52667 1 . ALA 475 475 52667 1 . TYR 476 476 52667 1 . VAL 477 477 52667 1 . LEU 478 478 52667 1 . LEU 479 479 52667 1 . TYR 480 480 52667 1 . GLY 481 481 52667 1 . PRO 482 482 52667 1 . ARG 483 483 52667 1 . ARG 484 484 52667 1 . VAL 485 485 52667 1 . GLU 486 486 52667 1 . ILE 487 487 52667 1 . MET 488 488 52667 1 . GLU 489 489 52667 1 . GLU 490 490 52667 1 . GLU 491 491 52667 1 . SER 492 492 52667 1 . GLU 493 493 52667 1 . GLN 494 494 52667 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 52667 _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 . . . . . . . . . . . . . 52667 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 52667 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pNIC-28-Bsa4 . . . 52667 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52667 _Sample.ID 1 _Sample.Name USP14_91-494 _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 USP14_91-494 '[U-99% 13C; U-99% 15N, U-99% 2H]' . . 1 $entity_1 . . 0.47 . . mM . . . . 52667 1 2 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 52667 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 52667 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 52667 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . mM . . . . 52667 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 52667 _Sample.ID 2 _Sample.Name USP14_99-494 _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 USP14_99-494 '[U-99% 15N, U-99% 2H]' . . 1 $entity_1 . . 0.89 . . mM . . . . 52667 2 2 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 52667 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 52667 2 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 52667 2 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . mM . . . . 52667 2 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 52667 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_condition_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.5 . pH 52667 1 pressure 1 . atm 52667 1 temperature 303.15 . K 52667 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 52667 _Sample_condition_list.ID 2 _Sample_condition_list.Name sample_condition_2 _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 pH 7.5 . pH 52667 2 pressure 1 . atm 52667 2 temperature 298.15 . K 52667 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52667 _Software.ID 1 _Software.Type . _Software.Name MddNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 52667 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52667 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 52667 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 52667 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52667 3 'peak picking' . 52667 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 52667 _Software.ID 4 _Software.Type . _Software.Name COMPASS _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52667 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 52667 _Software.ID 5 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52667 5 'peak picking' . 52667 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 52667 _Software.ID 6 _Software.Type . _Software.Name PINT _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 52667 6 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 52667 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name spectrometer_1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52667 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name spectrometer_2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 52667 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 2 '3D HNCA TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 3 '3D HN(CO)CA TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 4 '3D HNCACB TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 5 '3D HN(CO)CACB TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 6 '3D HNCO TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 7 '3D HN(CA)CO TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 8 '3D 1H-13C NOESY TROSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 9 '2D 1H-15N TROSY' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52667 1 10 'T1/R1 relaxation' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52667 1 11 'T2/R2 relaxation' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52667 1 12 '15N-(1H) NOE' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52667 1 13 'T1/R1 relaxation' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 1 14 'T2/R2 relaxation' no no . . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52667 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 52667 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Reference_1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 na indirect 0.251449530 . . . . . 52667 1 H 1 water protons . . . . ppm 4.773 internal direct 1 . . . . . 52667 1 N 15 DSS 'methyl protons' . . . . ppm 0 na indirect 0.101329118 . . . . . 52667 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 52667 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name chemical_shifts _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N TROSY' . . . 52667 1 2 '3D HNCA TROSY' . . . 52667 1 3 '3D HN(CO)CA TROSY' . . . 52667 1 4 '3D HNCACB TROSY' . . . 52667 1 5 '3D HN(CO)CACB TROSY' . . . 52667 1 6 '3D HNCO TROSY' . . . 52667 1 7 '3D HN(CA)CO TROSY' . . . 52667 1 8 '3D 1H-13C NOESY TROSY' . . . 52667 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 3 $software_3 . . 52667 1 4 $software_4 . . 52667 1 5 $software_5 . . 52667 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 91 91 ASP C C 13 176.131 0 . 1 . . . . . 91 ASP C . 52667 1 2 . 1 . 1 91 91 ASP CA C 13 54.054 0.014 . 1 . . . . . 91 ASP CA . 52667 1 3 . 1 . 1 91 91 ASP CB C 13 40.494 0 . 1 . . . . . 91 ASP CB . 52667 1 4 . 1 . 1 92 92 MET H H 1 8.199 0.001 . 1 . . . . . 92 MET H . 52667 1 5 . 1 . 1 92 92 MET C C 13 176.583 0.004 . 1 . . . . . 92 MET C . 52667 1 6 . 1 . 1 92 92 MET CA C 13 55.203 0.017 . 1 . . . . . 92 MET CA . 52667 1 7 . 1 . 1 92 92 MET CB C 13 32.303 0.003 . 1 . . . . . 92 MET CB . 52667 1 8 . 1 . 1 92 92 MET N N 15 121.197 0.02 . 1 . . . . . 92 MET N . 52667 1 9 . 1 . 1 93 93 THR H H 1 8.2 0.001 . 1 . . . . . 93 THR H . 52667 1 10 . 1 . 1 93 93 THR C C 13 175.051 0.005 . 1 . . . . . 93 THR C . 52667 1 11 . 1 . 1 93 93 THR CA C 13 61.702 0.006 . 1 . . . . . 93 THR CA . 52667 1 12 . 1 . 1 93 93 THR CB C 13 69.594 0.004 . 1 . . . . . 93 THR CB . 52667 1 13 . 1 . 1 93 93 THR N N 15 115.132 0.003 . 1 . . . . . 93 THR N . 52667 1 14 . 1 . 1 94 94 GLU H H 1 8.467 0 . 1 . . . . . 94 GLU H . 52667 1 15 . 1 . 1 94 94 GLU C C 13 177.539 0.002 . 1 . . . . . 94 GLU C . 52667 1 16 . 1 . 1 94 94 GLU CA C 13 57.382 0.018 . 1 . . . . . 94 GLU CA . 52667 1 17 . 1 . 1 94 94 GLU CB C 13 29.118 0.019 . 1 . . . . . 94 GLU CB . 52667 1 18 . 1 . 1 94 94 GLU N N 15 122.551 0.01 . 1 . . . . . 94 GLU N . 52667 1 19 . 1 . 1 95 95 GLU H H 1 8.373 0.002 . 1 . . . . . 95 GLU H . 52667 1 20 . 1 . 1 95 95 GLU C C 13 177.485 0.003 . 1 . . . . . 95 GLU C . 52667 1 21 . 1 . 1 95 95 GLU CA C 13 57.352 0.009 . 1 . . . . . 95 GLU CA . 52667 1 22 . 1 . 1 95 95 GLU CB C 13 29.074 0.026 . 1 . . . . . 95 GLU CB . 52667 1 23 . 1 . 1 95 95 GLU N N 15 121.376 0.012 . 1 . . . . . 95 GLU N . 52667 1 24 . 1 . 1 96 96 GLN H H 1 8.091 0.001 . 1 . . . . . 96 GLN H . 52667 1 25 . 1 . 1 96 96 GLN C C 13 177.072 0.002 . 1 . . . . . 96 GLN C . 52667 1 26 . 1 . 1 96 96 GLN CA C 13 56.252 0.008 . 1 . . . . . 96 GLN CA . 52667 1 27 . 1 . 1 96 96 GLN CB C 13 28.339 0.009 . 1 . . . . . 96 GLN CB . 52667 1 28 . 1 . 1 96 96 GLN N N 15 121.228 0.007 . 1 . . . . . 96 GLN N . 52667 1 29 . 1 . 1 97 97 LEU H H 1 8.142 0 . 1 . . . . . 97 LEU H . 52667 1 30 . 1 . 1 97 97 LEU C C 13 177.965 0.008 . 1 . . . . . 97 LEU C . 52667 1 31 . 1 . 1 97 97 LEU CA C 13 55.556 0.006 . 1 . . . . . 97 LEU CA . 52667 1 32 . 1 . 1 97 97 LEU CB C 13 41.166 0.006 . 1 . . . . . 97 LEU CB . 52667 1 33 . 1 . 1 97 97 LEU N N 15 123.066 0.002 . 1 . . . . . 97 LEU N . 52667 1 34 . 1 . 1 98 98 ALA H H 1 8.066 0.003 . 1 . . . . . 98 ALA H . 52667 1 35 . 1 . 1 98 98 ALA C C 13 178.66 0.013 . 1 . . . . . 98 ALA C . 52667 1 36 . 1 . 1 98 98 ALA CA C 13 52.889 0.021 . 1 . . . . . 98 ALA CA . 52667 1 37 . 1 . 1 98 98 ALA CB C 13 17.961 0.014 . 1 . . . . . 98 ALA CB . 52667 1 38 . 1 . 1 98 98 ALA N N 15 123.825 0.013 . 1 . . . . . 98 ALA N . 52667 1 39 . 1 . 1 99 99 SER H H 1 7.96 0.004 . 1 . . . . . 99 SER H . 52667 1 40 . 1 . 1 99 99 SER C C 13 174.87 0.006 . 1 . . . . . 99 SER C . 52667 1 41 . 1 . 1 99 99 SER CA C 13 58.515 0.015 . 1 . . . . . 99 SER CA . 52667 1 42 . 1 . 1 99 99 SER CB C 13 62.976 0.001 . 1 . . . . . 99 SER CB . 52667 1 43 . 1 . 1 99 99 SER N N 15 114.362 0.013 . 1 . . . . . 99 SER N . 52667 1 44 . 1 . 1 100 100 ALA H H 1 7.976 0.001 . 1 . . . . . 100 ALA H . 52667 1 45 . 1 . 1 100 100 ALA C C 13 177.799 0.006 . 1 . . . . . 100 ALA C . 52667 1 46 . 1 . 1 100 100 ALA CA C 13 52.408 0.009 . 1 . . . . . 100 ALA CA . 52667 1 47 . 1 . 1 100 100 ALA CB C 13 18.217 0.007 . 1 . . . . . 100 ALA CB . 52667 1 48 . 1 . 1 100 100 ALA N N 15 125.465 0.016 . 1 . . . . . 100 ALA N . 52667 1 49 . 1 . 1 101 101 MET H H 1 7.959 0 . 1 . . . . . 101 MET H . 52667 1 50 . 1 . 1 101 101 MET C C 13 176.029 0.002 . 1 . . . . . 101 MET C . 52667 1 51 . 1 . 1 101 101 MET CA C 13 55.125 0.015 . 1 . . . . . 101 MET CA . 52667 1 52 . 1 . 1 101 101 MET CB C 13 32.159 0.001 . 1 . . . . . 101 MET CB . 52667 1 53 . 1 . 1 101 101 MET N N 15 118.551 0.004 . 1 . . . . . 101 MET N . 52667 1 54 . 1 . 1 102 102 GLU H H 1 8.109 0.002 . 1 . . . . . 102 GLU H . 52667 1 55 . 1 . 1 102 102 GLU C C 13 176.043 0.009 . 1 . . . . . 102 GLU C . 52667 1 56 . 1 . 1 102 102 GLU CA C 13 55.981 0.009 . 1 . . . . . 102 GLU CA . 52667 1 57 . 1 . 1 102 102 GLU CB C 13 29.235 0 . 1 . . . . . 102 GLU CB . 52667 1 58 . 1 . 1 102 102 GLU N N 15 122.251 0.011 . 1 . . . . . 102 GLU N . 52667 1 59 . 1 . 1 103 103 LEU H H 1 8.223 0.002 . 1 . . . . . 103 LEU H . 52667 1 60 . 1 . 1 103 103 LEU C C 13 174.604 0 . 1 . . . . . 103 LEU C . 52667 1 61 . 1 . 1 103 103 LEU CA C 13 52.301 0.009 . 1 . . . . . 103 LEU CA . 52667 1 62 . 1 . 1 103 103 LEU CB C 13 40.874 0 . 1 . . . . . 103 LEU CB . 52667 1 63 . 1 . 1 103 103 LEU N N 15 124.354 0.021 . 1 . . . . . 103 LEU N . 52667 1 64 . 1 . 1 104 104 PRO C C 13 174.958 0 . 1 . . . . . 104 PRO C . 52667 1 65 . 1 . 1 104 104 PRO CA C 13 61.409 0.007 . 1 . . . . . 104 PRO CA . 52667 1 66 . 1 . 1 104 104 PRO CB C 13 31.567 0 . 1 . . . . . 104 PRO CB . 52667 1 67 . 1 . 1 105 105 CYS H H 1 8.213 0.001 . 1 . . . . . 105 CYS H . 52667 1 68 . 1 . 1 105 105 CYS C C 13 175.404 0.003 . 1 . . . . . 105 CYS C . 52667 1 69 . 1 . 1 105 105 CYS CA C 13 58.973 0.008 . 1 . . . . . 105 CYS CA . 52667 1 70 . 1 . 1 105 105 CYS CB C 13 28.354 0.016 . 1 . . . . . 105 CYS CB . 52667 1 71 . 1 . 1 105 105 CYS N N 15 118.272 0.009 . 1 . . . . . 105 CYS N . 52667 1 72 . 1 . 1 106 106 GLY H H 1 8.185 0.005 . 1 . . . . . 106 GLY H . 52667 1 73 . 1 . 1 106 106 GLY C C 13 171.058 0.01 . 1 . . . . . 106 GLY C . 52667 1 74 . 1 . 1 106 106 GLY CA C 13 42.976 0.007 . 1 . . . . . 106 GLY CA . 52667 1 75 . 1 . 1 106 106 GLY N N 15 112.328 0.015 . 1 . . . . . 106 GLY N . 52667 1 76 . 1 . 1 107 107 LEU H H 1 6.706 0.002 . 1 . . . . . 107 LEU H . 52667 1 77 . 1 . 1 107 107 LEU C C 13 174.85 0.012 . 1 . . . . . 107 LEU C . 52667 1 78 . 1 . 1 107 107 LEU CA C 13 52.806 0.017 . 1 . . . . . 107 LEU CA . 52667 1 79 . 1 . 1 107 107 LEU CB C 13 44.206 0.008 . 1 . . . . . 107 LEU CB . 52667 1 80 . 1 . 1 107 107 LEU N N 15 118.276 0.008 . 1 . . . . . 107 LEU N . 52667 1 81 . 1 . 1 108 108 THR H H 1 7.383 0.003 . 1 . . . . . 108 THR H . 52667 1 82 . 1 . 1 108 108 THR C C 13 174.643 0.011 . 1 . . . . . 108 THR C . 52667 1 83 . 1 . 1 108 108 THR CA C 13 62.758 0.013 . 1 . . . . . 108 THR CA . 52667 1 84 . 1 . 1 108 108 THR CB C 13 69.109 0 . 1 . . . . . 108 THR CB . 52667 1 85 . 1 . 1 108 108 THR N N 15 114.663 0.025 . 1 . . . . . 108 THR N . 52667 1 86 . 1 . 1 109 109 ASN H H 1 9.314 0.002 . 1 . . . . . 109 ASN H . 52667 1 87 . 1 . 1 109 109 ASN C C 13 175.415 0 . 1 . . . . . 109 ASN C . 52667 1 88 . 1 . 1 109 109 ASN CA C 13 53.253 0.002 . 1 . . . . . 109 ASN CA . 52667 1 89 . 1 . 1 109 109 ASN CB C 13 37.872 0 . 1 . . . . . 109 ASN CB . 52667 1 90 . 1 . 1 109 109 ASN N N 15 127.348 0.01 . 1 . . . . . 109 ASN N . 52667 1 91 . 1 . 1 110 110 LEU C C 13 175.835 0.015 . 1 . . . . . 110 LEU C . 52667 1 92 . 1 . 1 110 110 LEU CA C 13 54.121 0.03 . 1 . . . . . 110 LEU CA . 52667 1 93 . 1 . 1 110 110 LEU CB C 13 40.068 0 . 1 . . . . . 110 LEU CB . 52667 1 94 . 1 . 1 111 111 GLY H H 1 8.839 0.005 . 1 . . . . . 111 GLY H . 52667 1 95 . 1 . 1 111 111 GLY C C 13 171.294 0.041 . 1 . . . . . 111 GLY C . 52667 1 96 . 1 . 1 111 111 GLY CA C 13 46.306 0.012 . 1 . . . . . 111 GLY CA . 52667 1 97 . 1 . 1 111 111 GLY N N 15 111.401 0 . 1 . . . . . 111 GLY N . 52667 1 98 . 1 . 1 112 112 ASN H H 1 8.868 0.007 . 1 . . . . . 112 ASN H . 52667 1 99 . 1 . 1 112 112 ASN C C 13 174.968 0.024 . 1 . . . . . 112 ASN C . 52667 1 100 . 1 . 1 112 112 ASN CA C 13 54.433 0.015 . 1 . . . . . 112 ASN CA . 52667 1 101 . 1 . 1 112 112 ASN CB C 13 36.819 0 . 1 . . . . . 112 ASN CB . 52667 1 102 . 1 . 1 112 112 ASN N N 15 120.257 0.008 . 1 . . . . . 112 ASN N . 52667 1 103 . 1 . 1 113 113 THR H H 1 8.176 0.002 . 1 . . . . . 113 THR H . 52667 1 104 . 1 . 1 113 113 THR C C 13 175.78 0 . 1 . . . . . 113 THR C . 52667 1 105 . 1 . 1 113 113 THR CA C 13 61.776 0.054 . 1 . . . . . 113 THR CA . 52667 1 106 . 1 . 1 113 113 THR CB C 13 66.521 0.012 . 1 . . . . . 113 THR CB . 52667 1 107 . 1 . 1 113 113 THR N N 15 102.512 0.014 . 1 . . . . . 113 THR N . 52667 1 108 . 1 . 1 114 114 CYS H H 1 8.432 0.002 . 1 . . . . . 114 CYS H . 52667 1 109 . 1 . 1 114 114 CYS C C 13 178.433 0.045 . 1 . . . . . 114 CYS C . 52667 1 110 . 1 . 1 114 114 CYS CA C 13 58.739 0.027 . 1 . . . . . 114 CYS CA . 52667 1 111 . 1 . 1 114 114 CYS CB C 13 27.713 0.01 . 1 . . . . . 114 CYS CB . 52667 1 112 . 1 . 1 114 114 CYS N N 15 124.694 0.015 . 1 . . . . . 114 CYS N . 52667 1 113 . 1 . 1 115 115 TYR H H 1 7.151 0.003 . 1 . . . . . 115 TYR H . 52667 1 114 . 1 . 1 115 115 TYR C C 13 174.998 0.001 . 1 . . . . . 115 TYR C . 52667 1 115 . 1 . 1 115 115 TYR CA C 13 59.879 0.028 . 1 . . . . . 115 TYR CA . 52667 1 116 . 1 . 1 115 115 TYR CB C 13 35.792 0 . 1 . . . . . 115 TYR CB . 52667 1 117 . 1 . 1 115 115 TYR N N 15 119.559 0.024 . 1 . . . . . 115 TYR N . 52667 1 118 . 1 . 1 116 116 MET H H 1 5.766 0.005 . 1 . . . . . 116 MET H . 52667 1 119 . 1 . 1 116 116 MET C C 13 177.404 0.032 . 1 . . . . . 116 MET C . 52667 1 120 . 1 . 1 116 116 MET CA C 13 56.552 0.068 . 1 . . . . . 116 MET CA . 52667 1 121 . 1 . 1 116 116 MET CB C 13 31.769 0.058 . 1 . . . . . 116 MET CB . 52667 1 122 . 1 . 1 116 116 MET N N 15 124.764 0.022 . 1 . . . . . 116 MET N . 52667 1 123 . 1 . 1 117 117 ASN H H 1 7.456 0.006 . 1 . . . . . 117 ASN H . 52667 1 124 . 1 . 1 117 117 ASN C C 13 176.324 0.005 . 1 . . . . . 117 ASN C . 52667 1 125 . 1 . 1 117 117 ASN CA C 13 55.336 0.045 . 1 . . . . . 117 ASN CA . 52667 1 126 . 1 . 1 117 117 ASN CB C 13 36.638 0.04 . 1 . . . . . 117 ASN CB . 52667 1 127 . 1 . 1 117 117 ASN N N 15 120.407 0.047 . 1 . . . . . 117 ASN N . 52667 1 128 . 1 . 1 118 118 ALA H H 1 8.762 0.005 . 1 . . . . . 118 ALA H . 52667 1 129 . 1 . 1 118 118 ALA C C 13 180.107 0.013 . 1 . . . . . 118 ALA C . 52667 1 130 . 1 . 1 118 118 ALA CA C 13 54.216 0.03 . 1 . . . . . 118 ALA CA . 52667 1 131 . 1 . 1 118 118 ALA CB C 13 17.35 0.047 . 1 . . . . . 118 ALA CB . 52667 1 132 . 1 . 1 118 118 ALA N N 15 119.026 0.03 . 1 . . . . . 118 ALA N . 52667 1 133 . 1 . 1 119 119 THR H H 1 6.753 0.007 . 1 . . . . . 119 THR H . 52667 1 134 . 1 . 1 119 119 THR C C 13 176.07 0 . 1 . . . . . 119 THR C . 52667 1 135 . 1 . 1 119 119 THR CA C 13 67.752 0.013 . 1 . . . . . 119 THR CA . 52667 1 136 . 1 . 1 119 119 THR N N 15 117.152 0.006 . 1 . . . . . 119 THR N . 52667 1 137 . 1 . 1 120 120 VAL H H 1 8.24 0.004 . 1 . . . . . 120 VAL H . 52667 1 138 . 1 . 1 120 120 VAL C C 13 177.527 0.014 . 1 . . . . . 120 VAL C . 52667 1 139 . 1 . 1 120 120 VAL CA C 13 66.686 0.033 . 1 . . . . . 120 VAL CA . 52667 1 140 . 1 . 1 120 120 VAL CB C 13 29.845 0.035 . 1 . . . . . 120 VAL CB . 52667 1 141 . 1 . 1 120 120 VAL N N 15 119.591 0.026 . 1 . . . . . 120 VAL N . 52667 1 142 . 1 . 1 121 121 GLN H H 1 7.928 0.003 . 1 . . . . . 121 GLN H . 52667 1 143 . 1 . 1 121 121 GLN C C 13 179.769 0.005 . 1 . . . . . 121 GLN C . 52667 1 144 . 1 . 1 121 121 GLN CA C 13 57.932 0.022 . 1 . . . . . 121 GLN CA . 52667 1 145 . 1 . 1 121 121 GLN CB C 13 26.34 0 . 1 . . . . . 121 GLN CB . 52667 1 146 . 1 . 1 121 121 GLN N N 15 115.675 0.027 . 1 . . . . . 121 GLN N . 52667 1 147 . 1 . 1 122 122 CYS H H 1 7.247 0.004 . 1 . . . . . 122 CYS H . 52667 1 148 . 1 . 1 122 122 CYS C C 13 177.968 0.004 . 1 . . . . . 122 CYS C . 52667 1 149 . 1 . 1 122 122 CYS CA C 13 64.126 0.051 . 1 . . . . . 122 CYS CA . 52667 1 150 . 1 . 1 122 122 CYS CB C 13 27.106 0.016 . 1 . . . . . 122 CYS CB . 52667 1 151 . 1 . 1 122 122 CYS N N 15 114.352 0.015 . 1 . . . . . 122 CYS N . 52667 1 152 . 1 . 1 123 123 ILE H H 1 7.796 0.003 . 1 . . . . . 123 ILE H . 52667 1 153 . 1 . 1 123 123 ILE C C 13 175.929 0.009 . 1 . . . . . 123 ILE C . 52667 1 154 . 1 . 1 123 123 ILE CA C 13 65.558 0.03 . 1 . . . . . 123 ILE CA . 52667 1 155 . 1 . 1 123 123 ILE CB C 13 36.152 0.04 . 1 . . . . . 123 ILE CB . 52667 1 156 . 1 . 1 123 123 ILE N N 15 120.433 0.011 . 1 . . . . . 123 ILE N . 52667 1 157 . 1 . 1 124 124 ARG H H 1 7.717 0.003 . 1 . . . . . 124 ARG H . 52667 1 158 . 1 . 1 124 124 ARG C C 13 174.685 0.011 . 1 . . . . . 124 ARG C . 52667 1 159 . 1 . 1 124 124 ARG CA C 13 56.676 0.054 . 1 . . . . . 124 ARG CA . 52667 1 160 . 1 . 1 124 124 ARG CB C 13 29.177 0 . 1 . . . . . 124 ARG CB . 52667 1 161 . 1 . 1 124 124 ARG N N 15 118.23 0.022 . 1 . . . . . 124 ARG N . 52667 1 162 . 1 . 1 125 125 SER H H 1 6.998 0.005 . 1 . . . . . 125 SER H . 52667 1 163 . 1 . 1 125 125 SER C C 13 173.242 0 . 1 . . . . . 125 SER C . 52667 1 164 . 1 . 1 125 125 SER CA C 13 59.253 0.057 . 1 . . . . . 125 SER CA . 52667 1 165 . 1 . 1 125 125 SER CB C 13 64.385 0.026 . 1 . . . . . 125 SER CB . 52667 1 166 . 1 . 1 125 125 SER N N 15 111.217 0.014 . 1 . . . . . 125 SER N . 52667 1 167 . 1 . 1 126 126 VAL H H 1 7.259 0.004 . 1 . . . . . 126 VAL H . 52667 1 168 . 1 . 1 126 126 VAL C C 13 174.464 0 . 1 . . . . . 126 VAL C . 52667 1 169 . 1 . 1 126 126 VAL CA C 13 59.996 0.003 . 1 . . . . . 126 VAL CA . 52667 1 170 . 1 . 1 126 126 VAL CB C 13 29.361 0 . 1 . . . . . 126 VAL CB . 52667 1 171 . 1 . 1 126 126 VAL N N 15 125.684 0.043 . 1 . . . . . 126 VAL N . 52667 1 172 . 1 . 1 127 127 PRO C C 13 178.956 0 . 1 . . . . . 127 PRO C . 52667 1 173 . 1 . 1 127 127 PRO CA C 13 65.639 0.009 . 1 . . . . . 127 PRO CA . 52667 1 174 . 1 . 1 127 127 PRO CB C 13 30.959 0.056 . 1 . . . . . 127 PRO CB . 52667 1 175 . 1 . 1 128 128 GLU H H 1 9.767 0.006 . 1 . . . . . 128 GLU H . 52667 1 176 . 1 . 1 128 128 GLU C C 13 180 0.007 . 1 . . . . . 128 GLU C . 52667 1 177 . 1 . 1 128 128 GLU CA C 13 60.928 0.039 . 1 . . . . . 128 GLU CA . 52667 1 178 . 1 . 1 128 128 GLU CB C 13 26.632 0.067 . 1 . . . . . 128 GLU CB . 52667 1 179 . 1 . 1 128 128 GLU N N 15 117.214 0.044 . 1 . . . . . 128 GLU N . 52667 1 180 . 1 . 1 129 129 LEU H H 1 6.886 0.002 . 1 . . . . . 129 LEU H . 52667 1 181 . 1 . 1 129 129 LEU C C 13 177.581 0.055 . 1 . . . . . 129 LEU C . 52667 1 182 . 1 . 1 129 129 LEU CA C 13 56.656 0.042 . 1 . . . . . 129 LEU CA . 52667 1 183 . 1 . 1 129 129 LEU CB C 13 40.764 0.058 . 1 . . . . . 129 LEU CB . 52667 1 184 . 1 . 1 129 129 LEU N N 15 118.287 0.025 . 1 . . . . . 129 LEU N . 52667 1 185 . 1 . 1 130 130 LYS H H 1 7.641 0.004 . 1 . . . . . 130 LYS H . 52667 1 186 . 1 . 1 130 130 LYS C C 13 179.913 0.016 . 1 . . . . . 130 LYS C . 52667 1 187 . 1 . 1 130 130 LYS CA C 13 60.624 0.034 . 1 . . . . . 130 LYS CA . 52667 1 188 . 1 . 1 130 130 LYS CB C 13 30.967 0.021 . 1 . . . . . 130 LYS CB . 52667 1 189 . 1 . 1 130 130 LYS N N 15 119.962 0.034 . 1 . . . . . 130 LYS N . 52667 1 190 . 1 . 1 131 131 ASP H H 1 8.347 0.002 . 1 . . . . . 131 ASP H . 52667 1 191 . 1 . 1 131 131 ASP C C 13 177.895 0.01 . 1 . . . . . 131 ASP C . 52667 1 192 . 1 . 1 131 131 ASP CA C 13 57.032 0.044 . 1 . . . . . 131 ASP CA . 52667 1 193 . 1 . 1 131 131 ASP CB C 13 40.175 0.059 . 1 . . . . . 131 ASP CB . 52667 1 194 . 1 . 1 131 131 ASP N N 15 118.53 0.016 . 1 . . . . . 131 ASP N . 52667 1 195 . 1 . 1 132 132 ALA H H 1 7.336 0.003 . 1 . . . . . 132 ALA H . 52667 1 196 . 1 . 1 132 132 ALA C C 13 180.96 0.023 . 1 . . . . . 132 ALA C . 52667 1 197 . 1 . 1 132 132 ALA CA C 13 54.334 0.012 . 1 . . . . . 132 ALA CA . 52667 1 198 . 1 . 1 132 132 ALA CB C 13 19.445 0.033 . 1 . . . . . 132 ALA CB . 52667 1 199 . 1 . 1 132 132 ALA N N 15 121.588 0.022 . 1 . . . . . 132 ALA N . 52667 1 200 . 1 . 1 133 133 LEU H H 1 8.128 0.003 . 1 . . . . . 133 LEU H . 52667 1 201 . 1 . 1 133 133 LEU C C 13 178.297 0 . 1 . . . . . 133 LEU C . 52667 1 202 . 1 . 1 133 133 LEU CA C 13 57.318 0.063 . 1 . . . . . 133 LEU CA . 52667 1 203 . 1 . 1 133 133 LEU CB C 13 40.968 0.038 . 1 . . . . . 133 LEU CB . 52667 1 204 . 1 . 1 133 133 LEU N N 15 118.809 0.027 . 1 . . . . . 133 LEU N . 52667 1 205 . 1 . 1 134 134 LYS H H 1 7.402 0.003 . 1 . . . . . 134 LYS H . 52667 1 206 . 1 . 1 134 134 LYS C C 13 178.489 0.009 . 1 . . . . . 134 LYS C . 52667 1 207 . 1 . 1 134 134 LYS CA C 13 58.744 0.023 . 1 . . . . . 134 LYS CA . 52667 1 208 . 1 . 1 134 134 LYS CB C 13 31.517 0.03 . 1 . . . . . 134 LYS CB . 52667 1 209 . 1 . 1 134 134 LYS N N 15 116.83 0.025 . 1 . . . . . 134 LYS N . 52667 1 210 . 1 . 1 135 135 ARG H H 1 7.064 0.005 . 1 . . . . . 135 ARG H . 52667 1 211 . 1 . 1 135 135 ARG C C 13 175.969 0.021 . 1 . . . . . 135 ARG C . 52667 1 212 . 1 . 1 135 135 ARG CA C 13 55.591 0.011 . 1 . . . . . 135 ARG CA . 52667 1 213 . 1 . 1 135 135 ARG CB C 13 29.979 0.006 . 1 . . . . . 135 ARG CB . 52667 1 214 . 1 . 1 135 135 ARG N N 15 114.172 0.024 . 1 . . . . . 135 ARG N . 52667 1 215 . 1 . 1 136 136 TYR H H 1 7.517 0.004 . 1 . . . . . 136 TYR H . 52667 1 216 . 1 . 1 136 136 TYR CA C 13 59.114 0.005 . 1 . . . . . 136 TYR CA . 52667 1 217 . 1 . 1 136 136 TYR CB C 13 37.53 0 . 1 . . . . . 136 TYR CB . 52667 1 218 . 1 . 1 136 136 TYR N N 15 123.463 0.028 . 1 . . . . . 136 TYR N . 52667 1 219 . 1 . 1 137 137 ALA H H 1 8.236 0 . 1 . . . . . 137 ALA H . 52667 1 220 . 1 . 1 137 137 ALA N N 15 133.075 0 . 1 . . . . . 137 ALA N . 52667 1 221 . 1 . 1 138 138 GLY C C 13 172.684 0.009 . 1 . . . . . 138 GLY C . 52667 1 222 . 1 . 1 138 138 GLY CA C 13 44.936 0.055 . 1 . . . . . 138 GLY CA . 52667 1 223 . 1 . 1 139 139 ALA H H 1 8.042 0.004 . 1 . . . . . 139 ALA H . 52667 1 224 . 1 . 1 139 139 ALA C C 13 177.519 0.02 . 1 . . . . . 139 ALA C . 52667 1 225 . 1 . 1 139 139 ALA CA C 13 51.132 0.047 . 1 . . . . . 139 ALA CA . 52667 1 226 . 1 . 1 139 139 ALA CB C 13 19.295 0.032 . 1 . . . . . 139 ALA CB . 52667 1 227 . 1 . 1 139 139 ALA N N 15 124.944 0.002 . 1 . . . . . 139 ALA N . 52667 1 228 . 1 . 1 140 140 LEU H H 1 8.232 0.004 . 1 . . . . . 140 LEU H . 52667 1 229 . 1 . 1 140 140 LEU CA C 13 55.017 0.005 . 1 . . . . . 140 LEU CA . 52667 1 230 . 1 . 1 140 140 LEU CB C 13 41.212 0 . 1 . . . . . 140 LEU CB . 52667 1 231 . 1 . 1 140 140 LEU N N 15 121.473 0.004 . 1 . . . . . 140 LEU N . 52667 1 232 . 1 . 1 141 141 ARG C C 13 176.166 0.001 . 1 . . . . . 141 ARG C . 52667 1 233 . 1 . 1 141 141 ARG CA C 13 55.087 0.003 . 1 . . . . . 141 ARG CA . 52667 1 234 . 1 . 1 141 141 ARG CB C 13 24.006 0.005 . 1 . . . . . 141 ARG CB . 52667 1 235 . 1 . 1 142 142 ALA H H 1 7.771 0.002 . 1 . . . . . 142 ALA H . 52667 1 236 . 1 . 1 142 142 ALA CA C 13 52.309 0.001 . 1 . . . . . 142 ALA CA . 52667 1 237 . 1 . 1 142 142 ALA N N 15 125.263 0 . 1 . . . . . 142 ALA N . 52667 1 238 . 1 . 1 148 148 SER C C 13 173.276 0 . 1 . . . . . 148 SER C . 52667 1 239 . 1 . 1 148 148 SER CA C 13 57.824 0.042 . 1 . . . . . 148 SER CA . 52667 1 240 . 1 . 1 148 148 SER CB C 13 63.339 0.017 . 1 . . . . . 148 SER CB . 52667 1 241 . 1 . 1 149 149 ALA H H 1 7.814 0.002 . 1 . . . . . 149 ALA H . 52667 1 242 . 1 . 1 149 149 ALA CA C 13 53.468 0.011 . 1 . . . . . 149 ALA CA . 52667 1 243 . 1 . 1 149 149 ALA CB C 13 19.229 0 . 1 . . . . . 149 ALA CB . 52667 1 244 . 1 . 1 149 149 ALA N N 15 131.789 0.013 . 1 . . . . . 149 ALA N . 52667 1 245 . 1 . 1 150 150 GLN C C 13 177.162 0 . 1 . . . . . 150 GLN C . 52667 1 246 . 1 . 1 150 150 GLN CA C 13 58.138 0.017 . 1 . . . . . 150 GLN CA . 52667 1 247 . 1 . 1 150 150 GLN CB C 13 27.306 0.009 . 1 . . . . . 150 GLN CB . 52667 1 248 . 1 . 1 151 151 TYR H H 1 7.511 0.003 . 1 . . . . . 151 TYR H . 52667 1 249 . 1 . 1 151 151 TYR C C 13 178.421 0.028 . 1 . . . . . 151 TYR C . 52667 1 250 . 1 . 1 151 151 TYR CA C 13 58.62 0.021 . 1 . . . . . 151 TYR CA . 52667 1 251 . 1 . 1 151 151 TYR CB C 13 35.239 0.017 . 1 . . . . . 151 TYR CB . 52667 1 252 . 1 . 1 151 151 TYR N N 15 117.493 0.018 . 1 . . . . . 151 TYR N . 52667 1 253 . 1 . 1 152 152 ILE H H 1 7.894 0.003 . 1 . . . . . 152 ILE H . 52667 1 254 . 1 . 1 152 152 ILE C C 13 176.457 0.005 . 1 . . . . . 152 ILE C . 52667 1 255 . 1 . 1 152 152 ILE CA C 13 64.88 0.015 . 1 . . . . . 152 ILE CA . 52667 1 256 . 1 . 1 152 152 ILE CB C 13 36.32 0.036 . 1 . . . . . 152 ILE CB . 52667 1 257 . 1 . 1 152 152 ILE N N 15 118.674 0.016 . 1 . . . . . 152 ILE N . 52667 1 258 . 1 . 1 153 153 THR H H 1 7.205 0.005 . 1 . . . . . 153 THR H . 52667 1 259 . 1 . 1 153 153 THR C C 13 175.722 0 . 1 . . . . . 153 THR C . 52667 1 260 . 1 . 1 153 153 THR CA C 13 68.01 0.058 . 1 . . . . . 153 THR CA . 52667 1 261 . 1 . 1 153 153 THR CB C 13 66.744 0.054 . 1 . . . . . 153 THR CB . 52667 1 262 . 1 . 1 153 153 THR N N 15 116.958 0.026 . 1 . . . . . 153 THR N . 52667 1 263 . 1 . 1 154 154 ALA H H 1 8.029 0.003 . 1 . . . . . 154 ALA H . 52667 1 264 . 1 . 1 154 154 ALA C C 13 178.307 0.018 . 1 . . . . . 154 ALA C . 52667 1 265 . 1 . 1 154 154 ALA CA C 13 54.814 0.033 . 1 . . . . . 154 ALA CA . 52667 1 266 . 1 . 1 154 154 ALA CB C 13 17.506 0.025 . 1 . . . . . 154 ALA CB . 52667 1 267 . 1 . 1 154 154 ALA N N 15 122.244 0.016 . 1 . . . . . 154 ALA N . 52667 1 268 . 1 . 1 155 155 ALA H H 1 8.183 0.004 . 1 . . . . . 155 ALA H . 52667 1 269 . 1 . 1 155 155 ALA C C 13 181.125 0.011 . 1 . . . . . 155 ALA C . 52667 1 270 . 1 . 1 155 155 ALA CA C 13 54.328 0.028 . 1 . . . . . 155 ALA CA . 52667 1 271 . 1 . 1 155 155 ALA CB C 13 17.328 0.017 . 1 . . . . . 155 ALA CB . 52667 1 272 . 1 . 1 155 155 ALA N N 15 119.175 0.043 . 1 . . . . . 155 ALA N . 52667 1 273 . 1 . 1 156 156 LEU H H 1 8.37 0.003 . 1 . . . . . 156 LEU H . 52667 1 274 . 1 . 1 156 156 LEU C C 13 177.219 0.003 . 1 . . . . . 156 LEU C . 52667 1 275 . 1 . 1 156 156 LEU CA C 13 57.251 0.033 . 1 . . . . . 156 LEU CA . 52667 1 276 . 1 . 1 156 156 LEU CB C 13 40.698 0.053 . 1 . . . . . 156 LEU CB . 52667 1 277 . 1 . 1 156 156 LEU N N 15 122.491 0.01 . 1 . . . . . 156 LEU N . 52667 1 278 . 1 . 1 157 157 ARG H H 1 7.893 0.002 . 1 . . . . . 157 ARG H . 52667 1 279 . 1 . 1 157 157 ARG C C 13 179.391 0.008 . 1 . . . . . 157 ARG C . 52667 1 280 . 1 . 1 157 157 ARG CA C 13 59.223 0.045 . 1 . . . . . 157 ARG CA . 52667 1 281 . 1 . 1 157 157 ARG CB C 13 28.055 0.033 . 1 . . . . . 157 ARG CB . 52667 1 282 . 1 . 1 157 157 ARG N N 15 119.889 0.02 . 1 . . . . . 157 ARG N . 52667 1 283 . 1 . 1 158 158 ASP H H 1 8.495 0.005 . 1 . . . . . 158 ASP H . 52667 1 284 . 1 . 1 158 158 ASP C C 13 178.889 0.003 . 1 . . . . . 158 ASP C . 52667 1 285 . 1 . 1 158 158 ASP CA C 13 56.893 0.028 . 1 . . . . . 158 ASP CA . 52667 1 286 . 1 . 1 158 158 ASP CB C 13 38.955 0.033 . 1 . . . . . 158 ASP CB . 52667 1 287 . 1 . 1 158 158 ASP N N 15 120.584 0.062 . 1 . . . . . 158 ASP N . 52667 1 288 . 1 . 1 159 159 LEU H H 1 8.307 0.004 . 1 . . . . . 159 LEU H . 52667 1 289 . 1 . 1 159 159 LEU C C 13 179.047 0 . 1 . . . . . 159 LEU C . 52667 1 290 . 1 . 1 159 159 LEU CA C 13 57.3 0.017 . 1 . . . . . 159 LEU CA . 52667 1 291 . 1 . 1 159 159 LEU CB C 13 40.165 0.027 . 1 . . . . . 159 LEU CB . 52667 1 292 . 1 . 1 159 159 LEU N N 15 123.373 0.079 . 1 . . . . . 159 LEU N . 52667 1 293 . 1 . 1 160 160 PHE H H 1 8.673 0.004 . 1 . . . . . 160 PHE H . 52667 1 294 . 1 . 1 160 160 PHE C C 13 178.086 0.004 . 1 . . . . . 160 PHE C . 52667 1 295 . 1 . 1 160 160 PHE CA C 13 57.793 0.016 . 1 . . . . . 160 PHE CA . 52667 1 296 . 1 . 1 160 160 PHE CB C 13 34.964 0.013 . 1 . . . . . 160 PHE CB . 52667 1 297 . 1 . 1 160 160 PHE N N 15 119.889 0.024 . 1 . . . . . 160 PHE N . 52667 1 298 . 1 . 1 161 161 ASP H H 1 7.983 0.005 . 1 . . . . . 161 ASP H . 52667 1 299 . 1 . 1 161 161 ASP C C 13 178.501 0.007 . 1 . . . . . 161 ASP C . 52667 1 300 . 1 . 1 161 161 ASP CA C 13 57.531 0.052 . 1 . . . . . 161 ASP CA . 52667 1 301 . 1 . 1 161 161 ASP CB C 13 40.906 0 . 1 . . . . . 161 ASP CB . 52667 1 302 . 1 . 1 161 161 ASP N N 15 119.412 0.021 . 1 . . . . . 161 ASP N . 52667 1 303 . 1 . 1 162 162 SER H H 1 7.916 0.005 . 1 . . . . . 162 SER H . 52667 1 304 . 1 . 1 162 162 SER C C 13 177.705 0.191 . 1 . . . . . 162 SER C . 52667 1 305 . 1 . 1 162 162 SER CA C 13 62.031 0.182 . 1 . . . . . 162 SER CA . 52667 1 306 . 1 . 1 162 162 SER CB C 13 62.332 0 . 1 . . . . . 162 SER CB . 52667 1 307 . 1 . 1 162 162 SER N N 15 115.101 0.019 . 1 . . . . . 162 SER N . 52667 1 308 . 1 . 1 163 163 MET H H 1 8.803 0.003 . 1 . . . . . 163 MET H . 52667 1 309 . 1 . 1 163 163 MET C C 13 177.278 0.044 . 1 . . . . . 163 MET C . 52667 1 310 . 1 . 1 163 163 MET CA C 13 58.557 0.013 . 1 . . . . . 163 MET CA . 52667 1 311 . 1 . 1 163 163 MET CB C 13 34.018 0.026 . 1 . . . . . 163 MET CB . 52667 1 312 . 1 . 1 163 163 MET N N 15 122.683 0.026 . 1 . . . . . 163 MET N . 52667 1 313 . 1 . 1 164 164 ASP H H 1 7.623 0.002 . 1 . . . . . 164 ASP H . 52667 1 314 . 1 . 1 164 164 ASP C C 13 177.476 0.02 . 1 . . . . . 164 ASP C . 52667 1 315 . 1 . 1 164 164 ASP CA C 13 55.882 0.041 . 1 . . . . . 164 ASP CA . 52667 1 316 . 1 . 1 164 164 ASP CB C 13 40.096 0.025 . 1 . . . . . 164 ASP CB . 52667 1 317 . 1 . 1 164 164 ASP N N 15 116.895 0.015 . 1 . . . . . 164 ASP N . 52667 1 318 . 1 . 1 165 165 LYS H H 1 7.098 0.003 . 1 . . . . . 165 LYS H . 52667 1 319 . 1 . 1 165 165 LYS C C 13 175.434 0.017 . 1 . . . . . 165 LYS C . 52667 1 320 . 1 . 1 165 165 LYS CA C 13 55.667 0.032 . 1 . . . . . 165 LYS CA . 52667 1 321 . 1 . 1 165 165 LYS CB C 13 33.27 0.03 . 1 . . . . . 165 LYS CB . 52667 1 322 . 1 . 1 165 165 LYS N N 15 116.26 0.021 . 1 . . . . . 165 LYS N . 52667 1 323 . 1 . 1 166 166 THR H H 1 7.278 0.003 . 1 . . . . . 166 THR H . 52667 1 324 . 1 . 1 166 166 THR C C 13 171.712 0 . 1 . . . . . 166 THR C . 52667 1 325 . 1 . 1 166 166 THR CA C 13 60.538 0.006 . 1 . . . . . 166 THR CA . 52667 1 326 . 1 . 1 166 166 THR CB C 13 69.984 0 . 1 . . . . . 166 THR CB . 52667 1 327 . 1 . 1 166 166 THR N N 15 115.634 0.029 . 1 . . . . . 166 THR N . 52667 1 328 . 1 . 1 167 167 SER C C 13 174.63 0.004 . 1 . . . . . 167 SER C . 52667 1 329 . 1 . 1 167 167 SER CA C 13 57.572 0.035 . 1 . . . . . 167 SER CA . 52667 1 330 . 1 . 1 167 167 SER CB C 13 63.859 0.05 . 1 . . . . . 167 SER CB . 52667 1 331 . 1 . 1 168 168 SER H H 1 8.067 0.005 . 1 . . . . . 168 SER H . 52667 1 332 . 1 . 1 168 168 SER C C 13 172.675 0.014 . 1 . . . . . 168 SER C . 52667 1 333 . 1 . 1 168 168 SER CA C 13 57.088 0.021 . 1 . . . . . 168 SER CA . 52667 1 334 . 1 . 1 168 168 SER CB C 13 62.802 0.004 . 1 . . . . . 168 SER CB . 52667 1 335 . 1 . 1 168 168 SER N N 15 119.237 0.05 . 1 . . . . . 168 SER N . 52667 1 336 . 1 . 1 169 169 SER H H 1 8.067 0.003 . 1 . . . . . 169 SER H . 52667 1 337 . 1 . 1 169 169 SER C C 13 173.798 0.006 . 1 . . . . . 169 SER C . 52667 1 338 . 1 . 1 169 169 SER CA C 13 58.27 0.011 . 1 . . . . . 169 SER CA . 52667 1 339 . 1 . 1 169 169 SER CB C 13 64.009 0.003 . 1 . . . . . 169 SER CB . 52667 1 340 . 1 . 1 169 169 SER N N 15 115.527 0.017 . 1 . . . . . 169 SER N . 52667 1 341 . 1 . 1 170 170 ILE H H 1 7.401 0.004 . 1 . . . . . 170 ILE H . 52667 1 342 . 1 . 1 170 170 ILE C C 13 174.421 0 . 1 . . . . . 170 ILE C . 52667 1 343 . 1 . 1 170 170 ILE CA C 13 57.118 0.007 . 1 . . . . . 170 ILE CA . 52667 1 344 . 1 . 1 170 170 ILE CB C 13 41.998 0 . 1 . . . . . 170 ILE CB . 52667 1 345 . 1 . 1 170 170 ILE N N 15 121.722 0.02 . 1 . . . . . 170 ILE N . 52667 1 346 . 1 . 1 184 184 PRO C C 13 179.245 0 . 1 . . . . . 184 PRO C . 52667 1 347 . 1 . 1 184 184 PRO CA C 13 64.26 0.001 . 1 . . . . . 184 PRO CA . 52667 1 348 . 1 . 1 184 184 PRO CB C 13 30.694 0 . 1 . . . . . 184 PRO CB . 52667 1 349 . 1 . 1 185 185 GLN H H 1 9.423 0.004 . 1 . . . . . 185 GLN H . 52667 1 350 . 1 . 1 185 185 GLN C C 13 177.927 0.007 . 1 . . . . . 185 GLN C . 52667 1 351 . 1 . 1 185 185 GLN CA C 13 57.785 0.03 . 1 . . . . . 185 GLN CA . 52667 1 352 . 1 . 1 185 185 GLN CB C 13 26.064 0.01 . 1 . . . . . 185 GLN CB . 52667 1 353 . 1 . 1 185 185 GLN N N 15 120.965 0.014 . 1 . . . . . 185 GLN N . 52667 1 354 . 1 . 1 186 186 PHE H H 1 8.128 0.004 . 1 . . . . . 186 PHE H . 52667 1 355 . 1 . 1 186 186 PHE C C 13 175.625 0.016 . 1 . . . . . 186 PHE C . 52667 1 356 . 1 . 1 186 186 PHE CA C 13 55.361 0.061 . 1 . . . . . 186 PHE CA . 52667 1 357 . 1 . 1 186 186 PHE CB C 13 37.126 0.001 . 1 . . . . . 186 PHE CB . 52667 1 358 . 1 . 1 186 186 PHE N N 15 117.716 0.024 . 1 . . . . . 186 PHE N . 52667 1 359 . 1 . 1 187 187 ALA H H 1 7.664 0.004 . 1 . . . . . 187 ALA H . 52667 1 360 . 1 . 1 187 187 ALA C C 13 176.079 0.008 . 1 . . . . . 187 ALA C . 52667 1 361 . 1 . 1 187 187 ALA CA C 13 50.645 0.021 . 1 . . . . . 187 ALA CA . 52667 1 362 . 1 . 1 187 187 ALA CB C 13 18.582 0.036 . 1 . . . . . 187 ALA CB . 52667 1 363 . 1 . 1 187 187 ALA N N 15 122.571 0.032 . 1 . . . . . 187 ALA N . 52667 1 364 . 1 . 1 188 188 GLU H H 1 6.669 0.009 . 1 . . . . . 188 GLU H . 52667 1 365 . 1 . 1 188 188 GLU C C 13 175.519 0.003 . 1 . . . . . 188 GLU C . 52667 1 366 . 1 . 1 188 188 GLU CA C 13 56.987 0.013 . 1 . . . . . 188 GLU CA . 52667 1 367 . 1 . 1 188 188 GLU CB C 13 29.761 0.009 . 1 . . . . . 188 GLU CB . 52667 1 368 . 1 . 1 188 188 GLU N N 15 119.386 0.02 . 1 . . . . . 188 GLU N . 52667 1 369 . 1 . 1 189 189 LYS H H 1 8.267 0.002 . 1 . . . . . 189 LYS H . 52667 1 370 . 1 . 1 189 189 LYS C C 13 178.13 0.004 . 1 . . . . . 189 LYS C . 52667 1 371 . 1 . 1 189 189 LYS CA C 13 54.463 0.002 . 1 . . . . . 189 LYS CA . 52667 1 372 . 1 . 1 189 189 LYS CB C 13 35.073 0.016 . 1 . . . . . 189 LYS CB . 52667 1 373 . 1 . 1 189 189 LYS N N 15 122.177 0.005 . 1 . . . . . 189 LYS N . 52667 1 374 . 1 . 1 190 190 GLY H H 1 8.659 0.003 . 1 . . . . . 190 GLY H . 52667 1 375 . 1 . 1 190 190 GLY C C 13 175.888 0 . 1 . . . . . 190 GLY C . 52667 1 376 . 1 . 1 190 190 GLY CA C 13 43.448 0 . 1 . . . . . 190 GLY CA . 52667 1 377 . 1 . 1 190 190 GLY N N 15 107.664 0.023 . 1 . . . . . 190 GLY N . 52667 1 378 . 1 . 1 192 192 GLN C C 13 176.477 0 . 1 . . . . . 192 GLN C . 52667 1 379 . 1 . 1 192 192 GLN CA C 13 55.323 0.056 . 1 . . . . . 192 GLN CA . 52667 1 380 . 1 . 1 192 192 GLN CB C 13 26.949 0 . 1 . . . . . 192 GLN CB . 52667 1 381 . 1 . 1 193 193 GLY H H 1 7.955 0.002 . 1 . . . . . 193 GLY H . 52667 1 382 . 1 . 1 193 193 GLY C C 13 173.116 0.011 . 1 . . . . . 193 GLY C . 52667 1 383 . 1 . 1 193 193 GLY CA C 13 45.265 0.012 . 1 . . . . . 193 GLY CA . 52667 1 384 . 1 . 1 193 193 GLY N N 15 107.828 0.019 . 1 . . . . . 193 GLY N . 52667 1 385 . 1 . 1 194 194 GLN H H 1 8.8 0.004 . 1 . . . . . 194 GLN H . 52667 1 386 . 1 . 1 194 194 GLN C C 13 175.77 0.016 . 1 . . . . . 194 GLN C . 52667 1 387 . 1 . 1 194 194 GLN CA C 13 53.67 0.019 . 1 . . . . . 194 GLN CA . 52667 1 388 . 1 . 1 194 194 GLN CB C 13 28.451 0.002 . 1 . . . . . 194 GLN CB . 52667 1 389 . 1 . 1 194 194 GLN N N 15 122.75 0.028 . 1 . . . . . 194 GLN N . 52667 1 390 . 1 . 1 195 195 TYR H H 1 8.123 0.003 . 1 . . . . . 195 TYR H . 52667 1 391 . 1 . 1 195 195 TYR C C 13 176.298 0.016 . 1 . . . . . 195 TYR C . 52667 1 392 . 1 . 1 195 195 TYR CA C 13 58.55 0.01 . 1 . . . . . 195 TYR CA . 52667 1 393 . 1 . 1 195 195 TYR CB C 13 37.029 0.006 . 1 . . . . . 195 TYR CB . 52667 1 394 . 1 . 1 195 195 TYR N N 15 122.111 0.022 . 1 . . . . . 195 TYR N . 52667 1 395 . 1 . 1 196 196 LEU H H 1 8.6 0.003 . 1 . . . . . 196 LEU H . 52667 1 396 . 1 . 1 196 196 LEU C C 13 178.027 0.001 . 1 . . . . . 196 LEU C . 52667 1 397 . 1 . 1 196 196 LEU CA C 13 53.768 0.015 . 1 . . . . . 196 LEU CA . 52667 1 398 . 1 . 1 196 196 LEU CB C 13 42.087 0.025 . 1 . . . . . 196 LEU CB . 52667 1 399 . 1 . 1 196 196 LEU N N 15 121.759 0.02 . 1 . . . . . 196 LEU N . 52667 1 400 . 1 . 1 197 197 GLN H H 1 8.469 0.002 . 1 . . . . . 197 GLN H . 52667 1 401 . 1 . 1 197 197 GLN C C 13 173.909 0 . 1 . . . . . 197 GLN C . 52667 1 402 . 1 . 1 197 197 GLN CA C 13 55.528 0.031 . 1 . . . . . 197 GLN CA . 52667 1 403 . 1 . 1 197 197 GLN CB C 13 29.767 0.058 . 1 . . . . . 197 GLN CB . 52667 1 404 . 1 . 1 197 197 GLN N N 15 124.691 0.038 . 1 . . . . . 197 GLN N . 52667 1 405 . 1 . 1 198 198 GLN H H 1 8.295 0.003 . 1 . . . . . 198 GLN H . 52667 1 406 . 1 . 1 198 198 GLN C C 13 174.471 0.007 . 1 . . . . . 198 GLN C . 52667 1 407 . 1 . 1 198 198 GLN CA C 13 51.815 0.012 . 1 . . . . . 198 GLN CA . 52667 1 408 . 1 . 1 198 198 GLN CB C 13 29.184 0.009 . 1 . . . . . 198 GLN CB . 52667 1 409 . 1 . 1 198 198 GLN N N 15 122.894 0.034 . 1 . . . . . 198 GLN N . 52667 1 410 . 1 . 1 199 199 ASP H H 1 8.424 0.002 . 1 . . . . . 199 ASP H . 52667 1 411 . 1 . 1 199 199 ASP C C 13 178.374 0.027 . 1 . . . . . 199 ASP C . 52667 1 412 . 1 . 1 199 199 ASP CA C 13 52.742 0.034 . 1 . . . . . 199 ASP CA . 52667 1 413 . 1 . 1 199 199 ASP CB C 13 39.761 0.025 . 1 . . . . . 199 ASP CB . 52667 1 414 . 1 . 1 199 199 ASP N N 15 117.186 0.016 . 1 . . . . . 199 ASP N . 52667 1 415 . 1 . 1 200 200 ALA H H 1 7.138 0.004 . 1 . . . . . 200 ALA H . 52667 1 416 . 1 . 1 200 200 ALA C C 13 178.555 0.005 . 1 . . . . . 200 ALA C . 52667 1 417 . 1 . 1 200 200 ALA CA C 13 55.178 0.015 . 1 . . . . . 200 ALA CA . 52667 1 418 . 1 . 1 200 200 ALA CB C 13 19.634 0.082 . 1 . . . . . 200 ALA CB . 52667 1 419 . 1 . 1 200 200 ALA N N 15 128.621 0.014 . 1 . . . . . 200 ALA N . 52667 1 420 . 1 . 1 201 201 ASN H H 1 8.444 0.003 . 1 . . . . . 201 ASN H . 52667 1 421 . 1 . 1 201 201 ASN C C 13 177.053 0.034 . 1 . . . . . 201 ASN C . 52667 1 422 . 1 . 1 201 201 ASN CA C 13 56.194 0.008 . 1 . . . . . 201 ASN CA . 52667 1 423 . 1 . 1 201 201 ASN CB C 13 38.178 0.01 . 1 . . . . . 201 ASN CB . 52667 1 424 . 1 . 1 201 201 ASN N N 15 113.312 0.023 . 1 . . . . . 201 ASN N . 52667 1 425 . 1 . 1 202 202 GLU H H 1 7.021 0.003 . 1 . . . . . 202 GLU H . 52667 1 426 . 1 . 1 202 202 GLU C C 13 178.597 0.014 . 1 . . . . . 202 GLU C . 52667 1 427 . 1 . 1 202 202 GLU CA C 13 58.068 0.027 . 1 . . . . . 202 GLU CA . 52667 1 428 . 1 . 1 202 202 GLU CB C 13 28.206 0.032 . 1 . . . . . 202 GLU CB . 52667 1 429 . 1 . 1 202 202 GLU N N 15 118.29 0.014 . 1 . . . . . 202 GLU N . 52667 1 430 . 1 . 1 203 203 CYS H H 1 7.16 0.004 . 1 . . . . . 203 CYS H . 52667 1 431 . 1 . 1 203 203 CYS C C 13 174.495 0.001 . 1 . . . . . 203 CYS C . 52667 1 432 . 1 . 1 203 203 CYS CA C 13 62.867 0.021 . 1 . . . . . 203 CYS CA . 52667 1 433 . 1 . 1 203 203 CYS CB C 13 25.613 0.043 . 1 . . . . . 203 CYS CB . 52667 1 434 . 1 . 1 203 203 CYS N N 15 118.655 0.017 . 1 . . . . . 203 CYS N . 52667 1 435 . 1 . 1 204 204 TRP H H 1 8.501 0.004 . 1 . . . . . 204 TRP H . 52667 1 436 . 1 . 1 204 204 TRP C C 13 177.905 0.009 . 1 . . . . . 204 TRP C . 52667 1 437 . 1 . 1 204 204 TRP CA C 13 60.978 0.017 . 1 . . . . . 204 TRP CA . 52667 1 438 . 1 . 1 204 204 TRP CB C 13 26.662 0.022 . 1 . . . . . 204 TRP CB . 52667 1 439 . 1 . 1 204 204 TRP N N 15 121.074 0.02 . 1 . . . . . 204 TRP N . 52667 1 440 . 1 . 1 205 205 ILE H H 1 8.644 0.004 . 1 . . . . . 205 ILE H . 52667 1 441 . 1 . 1 205 205 ILE C C 13 178.919 0.014 . 1 . . . . . 205 ILE C . 52667 1 442 . 1 . 1 205 205 ILE CA C 13 63.847 0.039 . 1 . . . . . 205 ILE CA . 52667 1 443 . 1 . 1 205 205 ILE CB C 13 36.857 0.085 . 1 . . . . . 205 ILE CB . 52667 1 444 . 1 . 1 205 205 ILE N N 15 118.04 0.033 . 1 . . . . . 205 ILE N . 52667 1 445 . 1 . 1 206 206 GLN H H 1 8.017 0.004 . 1 . . . . . 206 GLN H . 52667 1 446 . 1 . 1 206 206 GLN C C 13 179.624 0.001 . 1 . . . . . 206 GLN C . 52667 1 447 . 1 . 1 206 206 GLN CA C 13 57.461 0.035 . 1 . . . . . 206 GLN CA . 52667 1 448 . 1 . 1 206 206 GLN CB C 13 25.353 0.018 . 1 . . . . . 206 GLN CB . 52667 1 449 . 1 . 1 206 206 GLN N N 15 117.965 0.022 . 1 . . . . . 206 GLN N . 52667 1 450 . 1 . 1 207 207 MET H H 1 8.544 0.003 . 1 . . . . . 207 MET H . 52667 1 451 . 1 . 1 207 207 MET C C 13 178.365 0.025 . 1 . . . . . 207 MET C . 52667 1 452 . 1 . 1 207 207 MET CA C 13 59.075 0.014 . 1 . . . . . 207 MET CA . 52667 1 453 . 1 . 1 207 207 MET CB C 13 30.774 0 . 1 . . . . . 207 MET CB . 52667 1 454 . 1 . 1 207 207 MET N N 15 118.237 0.015 . 1 . . . . . 207 MET N . 52667 1 455 . 1 . 1 208 208 MET H H 1 8.342 0.004 . 1 . . . . . 208 MET H . 52667 1 456 . 1 . 1 208 208 MET C C 13 178.561 0.024 . 1 . . . . . 208 MET C . 52667 1 457 . 1 . 1 208 208 MET CA C 13 57.182 0.012 . 1 . . . . . 208 MET CA . 52667 1 458 . 1 . 1 208 208 MET CB C 13 30.8 0.004 . 1 . . . . . 208 MET CB . 52667 1 459 . 1 . 1 208 208 MET N N 15 117.473 0.003 . 1 . . . . . 208 MET N . 52667 1 460 . 1 . 1 209 209 ARG H H 1 8.023 0.003 . 1 . . . . . 209 ARG H . 52667 1 461 . 1 . 1 209 209 ARG C C 13 180.109 0.025 . 1 . . . . . 209 ARG C . 52667 1 462 . 1 . 1 209 209 ARG CA C 13 58.728 0.012 . 1 . . . . . 209 ARG CA . 52667 1 463 . 1 . 1 209 209 ARG CB C 13 28.887 0.041 . 1 . . . . . 209 ARG CB . 52667 1 464 . 1 . 1 209 209 ARG N N 15 119.203 0.027 . 1 . . . . . 209 ARG N . 52667 1 465 . 1 . 1 210 210 VAL H H 1 7.728 0.005 . 1 . . . . . 210 VAL H . 52667 1 466 . 1 . 1 210 210 VAL C C 13 178.001 0.003 . 1 . . . . . 210 VAL C . 52667 1 467 . 1 . 1 210 210 VAL CA C 13 66.008 0.02 . 1 . . . . . 210 VAL CA . 52667 1 468 . 1 . 1 210 210 VAL CB C 13 30.245 0.025 . 1 . . . . . 210 VAL CB . 52667 1 469 . 1 . 1 210 210 VAL N N 15 120.272 0.007 . 1 . . . . . 210 VAL N . 52667 1 470 . 1 . 1 211 211 LEU H H 1 7.938 0.004 . 1 . . . . . 211 LEU H . 52667 1 471 . 1 . 1 211 211 LEU C C 13 179.45 0.01 . 1 . . . . . 211 LEU C . 52667 1 472 . 1 . 1 211 211 LEU CA C 13 57.266 0.034 . 1 . . . . . 211 LEU CA . 52667 1 473 . 1 . 1 211 211 LEU CB C 13 39.93 0.073 . 1 . . . . . 211 LEU CB . 52667 1 474 . 1 . 1 211 211 LEU N N 15 119.077 0.007 . 1 . . . . . 211 LEU N . 52667 1 475 . 1 . 1 212 212 GLN H H 1 8.6 0.004 . 1 . . . . . 212 GLN H . 52667 1 476 . 1 . 1 212 212 GLN C C 13 177.15 0.006 . 1 . . . . . 212 GLN C . 52667 1 477 . 1 . 1 212 212 GLN CA C 13 57.214 0.007 . 1 . . . . . 212 GLN CA . 52667 1 478 . 1 . 1 212 212 GLN CB C 13 28.654 0.034 . 1 . . . . . 212 GLN CB . 52667 1 479 . 1 . 1 212 212 GLN N N 15 121.67 0.068 . 1 . . . . . 212 GLN N . 52667 1 480 . 1 . 1 213 213 GLN H H 1 7.27 0.002 . 1 . . . . . 213 GLN H . 52667 1 481 . 1 . 1 213 213 GLN C C 13 177.587 0.012 . 1 . . . . . 213 GLN C . 52667 1 482 . 1 . 1 213 213 GLN CA C 13 57.021 0.016 . 1 . . . . . 213 GLN CA . 52667 1 483 . 1 . 1 213 213 GLN CB C 13 28.849 0.064 . 1 . . . . . 213 GLN CB . 52667 1 484 . 1 . 1 213 213 GLN N N 15 114.377 0.017 . 1 . . . . . 213 GLN N . 52667 1 485 . 1 . 1 214 214 LYS H H 1 6.995 0.003 . 1 . . . . . 214 LYS H . 52667 1 486 . 1 . 1 214 214 LYS C C 13 176.397 0.027 . 1 . . . . . 214 LYS C . 52667 1 487 . 1 . 1 214 214 LYS CA C 13 54.172 0.026 . 1 . . . . . 214 LYS CA . 52667 1 488 . 1 . 1 214 214 LYS CB C 13 33.58 0.021 . 1 . . . . . 214 LYS CB . 52667 1 489 . 1 . 1 214 214 LYS N N 15 113.92 0.021 . 1 . . . . . 214 LYS N . 52667 1 490 . 1 . 1 215 215 LEU H H 1 8.223 0.002 . 1 . . . . . 215 LEU H . 52667 1 491 . 1 . 1 215 215 LEU C C 13 176.235 0.02 . 1 . . . . . 215 LEU C . 52667 1 492 . 1 . 1 215 215 LEU CA C 13 53.248 0.011 . 1 . . . . . 215 LEU CA . 52667 1 493 . 1 . 1 215 215 LEU CB C 13 39.723 0.009 . 1 . . . . . 215 LEU CB . 52667 1 494 . 1 . 1 215 215 LEU N N 15 118.565 0.017 . 1 . . . . . 215 LEU N . 52667 1 495 . 1 . 1 216 216 GLU H H 1 8.61 0.002 . 1 . . . . . 216 GLU H . 52667 1 496 . 1 . 1 216 216 GLU C C 13 175.699 0.015 . 1 . . . . . 216 GLU C . 52667 1 497 . 1 . 1 216 216 GLU CA C 13 56.387 0.024 . 1 . . . . . 216 GLU CA . 52667 1 498 . 1 . 1 216 216 GLU CB C 13 29.57 0.002 . 1 . . . . . 216 GLU CB . 52667 1 499 . 1 . 1 216 216 GLU N N 15 127.841 0.012 . 1 . . . . . 216 GLU N . 52667 1 500 . 1 . 1 217 217 ALA H H 1 8.106 0.004 . 1 . . . . . 217 ALA H . 52667 1 501 . 1 . 1 217 217 ALA C C 13 178.178 0.021 . 1 . . . . . 217 ALA C . 52667 1 502 . 1 . 1 217 217 ALA CA C 13 51.86 0.011 . 1 . . . . . 217 ALA CA . 52667 1 503 . 1 . 1 217 217 ALA CB C 13 18.182 0.011 . 1 . . . . . 217 ALA CB . 52667 1 504 . 1 . 1 217 217 ALA N N 15 123.098 0.013 . 1 . . . . . 217 ALA N . 52667 1 505 . 1 . 1 218 218 ILE H H 1 9.309 0.003 . 1 . . . . . 218 ILE H . 52667 1 506 . 1 . 1 218 218 ILE C C 13 176.56 0.009 . 1 . . . . . 218 ILE C . 52667 1 507 . 1 . 1 218 218 ILE CA C 13 61.327 0.006 . 1 . . . . . 218 ILE CA . 52667 1 508 . 1 . 1 218 218 ILE CB C 13 37.748 0.027 . 1 . . . . . 218 ILE CB . 52667 1 509 . 1 . 1 218 218 ILE N N 15 122.904 0.042 . 1 . . . . . 218 ILE N . 52667 1 510 . 1 . 1 219 219 GLU H H 1 8.459 0.002 . 1 . . . . . 219 GLU H . 52667 1 511 . 1 . 1 219 219 GLU C C 13 175.447 0.014 . 1 . . . . . 219 GLU C . 52667 1 512 . 1 . 1 219 219 GLU CA C 13 55.298 0.017 . 1 . . . . . 219 GLU CA . 52667 1 513 . 1 . 1 219 219 GLU CB C 13 30.792 0.009 . 1 . . . . . 219 GLU CB . 52667 1 514 . 1 . 1 219 219 GLU N N 15 125.793 0.011 . 1 . . . . . 219 GLU N . 52667 1 515 . 1 . 1 220 220 ASP H H 1 8.295 0.003 . 1 . . . . . 220 ASP H . 52667 1 516 . 1 . 1 220 220 ASP C C 13 176.214 0.006 . 1 . . . . . 220 ASP C . 52667 1 517 . 1 . 1 220 220 ASP CA C 13 53.429 0.014 . 1 . . . . . 220 ASP CA . 52667 1 518 . 1 . 1 220 220 ASP CB C 13 41.191 0.002 . 1 . . . . . 220 ASP CB . 52667 1 519 . 1 . 1 220 220 ASP N N 15 122.188 0.028 . 1 . . . . . 220 ASP N . 52667 1 520 . 1 . 1 221 221 ASP H H 1 8.392 0.002 . 1 . . . . . 221 ASP H . 52667 1 521 . 1 . 1 221 221 ASP C C 13 176.798 0.005 . 1 . . . . . 221 ASP C . 52667 1 522 . 1 . 1 221 221 ASP CA C 13 54.416 0.011 . 1 . . . . . 221 ASP CA . 52667 1 523 . 1 . 1 221 221 ASP CB C 13 40.22 0.002 . 1 . . . . . 221 ASP CB . 52667 1 524 . 1 . 1 221 221 ASP N N 15 122.773 0.007 . 1 . . . . . 221 ASP N . 52667 1 525 . 1 . 1 222 222 SER H H 1 8.31 0.001 . 1 . . . . . 222 SER H . 52667 1 526 . 1 . 1 222 222 SER C C 13 174.935 0 . 1 . . . . . 222 SER C . 52667 1 527 . 1 . 1 222 222 SER CA C 13 59.068 0.007 . 1 . . . . . 222 SER CA . 52667 1 528 . 1 . 1 222 222 SER CB C 13 63.102 0.002 . 1 . . . . . 222 SER CB . 52667 1 529 . 1 . 1 222 222 SER N N 15 116.318 0.011 . 1 . . . . . 222 SER N . 52667 1 530 . 1 . 1 223 223 VAL H H 1 7.798 0.002 . 1 . . . . . 223 VAL H . 52667 1 531 . 1 . 1 223 223 VAL C C 13 176.182 0.008 . 1 . . . . . 223 VAL C . 52667 1 532 . 1 . 1 223 223 VAL CA C 13 62.153 0.021 . 1 . . . . . 223 VAL CA . 52667 1 533 . 1 . 1 223 223 VAL CB C 13 31.312 0 . 1 . . . . . 223 VAL CB . 52667 1 534 . 1 . 1 223 223 VAL N N 15 121.726 0.038 . 1 . . . . . 223 VAL N . 52667 1 535 . 1 . 1 224 224 LYS H H 1 8.136 0.001 . 1 . . . . . 224 LYS H . 52667 1 536 . 1 . 1 224 224 LYS C C 13 176.681 0.006 . 1 . . . . . 224 LYS C . 52667 1 537 . 1 . 1 224 224 LYS CA C 13 55.584 0.012 . 1 . . . . . 224 LYS CA . 52667 1 538 . 1 . 1 224 224 LYS CB C 13 32.144 0.036 . 1 . . . . . 224 LYS CB . 52667 1 539 . 1 . 1 224 224 LYS N N 15 125.236 0.015 . 1 . . . . . 224 LYS N . 52667 1 540 . 1 . 1 225 225 GLU H H 1 8.349 0.002 . 1 . . . . . 225 GLU H . 52667 1 541 . 1 . 1 225 225 GLU C C 13 176.736 0.01 . 1 . . . . . 225 GLU C . 52667 1 542 . 1 . 1 225 225 GLU CA C 13 56.286 0.017 . 1 . . . . . 225 GLU CA . 52667 1 543 . 1 . 1 225 225 GLU CB C 13 29.272 0.02 . 1 . . . . . 225 GLU CB . 52667 1 544 . 1 . 1 225 225 GLU N N 15 122.391 0.017 . 1 . . . . . 225 GLU N . 52667 1 545 . 1 . 1 226 226 THR H H 1 8.062 0.006 . 1 . . . . . 226 THR H . 52667 1 546 . 1 . 1 226 226 THR C C 13 174.394 0 . 1 . . . . . 226 THR C . 52667 1 547 . 1 . 1 226 226 THR CA C 13 61.513 0.004 . 1 . . . . . 226 THR CA . 52667 1 548 . 1 . 1 226 226 THR CB C 13 69.409 0 . 1 . . . . . 226 THR CB . 52667 1 549 . 1 . 1 226 226 THR N N 15 114.958 0.02 . 1 . . . . . 226 THR N . 52667 1 550 . 1 . 1 230 230 SER H H 1 9.215 0 . 1 . . . . . 230 SER H . 52667 1 551 . 1 . 1 230 230 SER N N 15 123.059 0 . 1 . . . . . 230 SER N . 52667 1 552 . 1 . 1 233 233 ALA H H 1 8.04 0 . 1 . . . . . 233 ALA H . 52667 1 553 . 1 . 1 233 233 ALA C C 13 177.379 0.047 . 1 . . . . . 233 ALA C . 52667 1 554 . 1 . 1 233 233 ALA CA C 13 52.028 0.025 . 1 . . . . . 233 ALA CA . 52667 1 555 . 1 . 1 233 233 ALA N N 15 125.902 0 . 1 . . . . . 233 ALA N . 52667 1 556 . 1 . 1 234 234 ALA H H 1 8.042 0.002 . 1 . . . . . 234 ALA H . 52667 1 557 . 1 . 1 234 234 ALA C C 13 177.67 0 . 1 . . . . . 234 ALA C . 52667 1 558 . 1 . 1 234 234 ALA CA C 13 51.933 0.038 . 1 . . . . . 234 ALA CA . 52667 1 559 . 1 . 1 234 234 ALA CB C 13 18.349 0.103 . 1 . . . . . 234 ALA CB . 52667 1 560 . 1 . 1 234 234 ALA N N 15 122.836 0 . 1 . . . . . 234 ALA N . 52667 1 561 . 1 . 1 235 235 THR H H 1 7.953 0.005 . 1 . . . . . 235 THR H . 52667 1 562 . 1 . 1 235 235 THR C C 13 172.975 0 . 1 . . . . . 235 THR C . 52667 1 563 . 1 . 1 235 235 THR CA C 13 59.358 0.017 . 1 . . . . . 235 THR CA . 52667 1 564 . 1 . 1 235 235 THR CB C 13 69.246 0 . 1 . . . . . 235 THR CB . 52667 1 565 . 1 . 1 235 235 THR N N 15 116.093 0.039 . 1 . . . . . 235 THR N . 52667 1 566 . 1 . 1 237 237 SER C C 13 174.471 0.001 . 1 . . . . . 237 SER C . 52667 1 567 . 1 . 1 237 237 SER CA C 13 57.933 0.013 . 1 . . . . . 237 SER CA . 52667 1 568 . 1 . 1 237 237 SER CB C 13 41.355 0.18 . 1 . . . . . 237 SER CB . 52667 1 569 . 1 . 1 238 238 LYS H H 1 8.153 0.003 . 1 . . . . . 238 LYS H . 52667 1 570 . 1 . 1 238 238 LYS C C 13 176.366 0.147 . 1 . . . . . 238 LYS C . 52667 1 571 . 1 . 1 238 238 LYS CA C 13 55.671 0.069 . 1 . . . . . 238 LYS CA . 52667 1 572 . 1 . 1 238 238 LYS CB C 13 32.082 0.077 . 1 . . . . . 238 LYS CB . 52667 1 573 . 1 . 1 238 238 LYS N N 15 123.909 0.023 . 1 . . . . . 238 LYS N . 52667 1 574 . 1 . 1 239 239 LYS H H 1 8.417 0.001 . 1 . . . . . 239 LYS H . 52667 1 575 . 1 . 1 239 239 LYS C C 13 176.687 0.016 . 1 . . . . . 239 LYS C . 52667 1 576 . 1 . 1 239 239 LYS CA C 13 55.514 0.033 . 1 . . . . . 239 LYS CA . 52667 1 577 . 1 . 1 239 239 LYS CB C 13 32.288 0.02 . 1 . . . . . 239 LYS CB . 52667 1 578 . 1 . 1 239 239 LYS N N 15 124.249 0.02 . 1 . . . . . 239 LYS N . 52667 1 579 . 1 . 1 240 240 LYS H H 1 8.463 0.001 . 1 . . . . . 240 LYS H . 52667 1 580 . 1 . 1 240 240 LYS C C 13 175.898 0.011 . 1 . . . . . 240 LYS C . 52667 1 581 . 1 . 1 240 240 LYS CA C 13 56.472 0.037 . 1 . . . . . 240 LYS CA . 52667 1 582 . 1 . 1 240 240 LYS CB C 13 32.715 0.016 . 1 . . . . . 240 LYS CB . 52667 1 583 . 1 . 1 240 240 LYS N N 15 121.623 0.009 . 1 . . . . . 240 LYS N . 52667 1 584 . 1 . 1 241 241 SER H H 1 8.188 0.003 . 1 . . . . . 241 SER H . 52667 1 585 . 1 . 1 241 241 SER C C 13 175.284 0.009 . 1 . . . . . 241 SER C . 52667 1 586 . 1 . 1 241 241 SER CA C 13 56.622 0.024 . 1 . . . . . 241 SER CA . 52667 1 587 . 1 . 1 241 241 SER CB C 13 66.599 0.008 . 1 . . . . . 241 SER CB . 52667 1 588 . 1 . 1 241 241 SER N N 15 113.992 0.024 . 1 . . . . . 241 SER N . 52667 1 589 . 1 . 1 242 242 LEU H H 1 7.806 0.003 . 1 . . . . . 242 LEU H . 52667 1 590 . 1 . 1 242 242 LEU C C 13 179.501 0.009 . 1 . . . . . 242 LEU C . 52667 1 591 . 1 . 1 242 242 LEU CA C 13 57.551 0.036 . 1 . . . . . 242 LEU CA . 52667 1 592 . 1 . 1 242 242 LEU CB C 13 42.009 0.044 . 1 . . . . . 242 LEU CB . 52667 1 593 . 1 . 1 242 242 LEU N N 15 126.21 0.017 . 1 . . . . . 242 LEU N . 52667 1 594 . 1 . 1 243 243 ILE H H 1 7.76 0.007 . 1 . . . . . 243 ILE H . 52667 1 595 . 1 . 1 243 243 ILE C C 13 177.828 0.026 . 1 . . . . . 243 ILE C . 52667 1 596 . 1 . 1 243 243 ILE CA C 13 60.636 0.042 . 1 . . . . . 243 ILE CA . 52667 1 597 . 1 . 1 243 243 ILE CB C 13 35.102 0.038 . 1 . . . . . 243 ILE CB . 52667 1 598 . 1 . 1 243 243 ILE N N 15 115.535 0.03 . 1 . . . . . 243 ILE N . 52667 1 599 . 1 . 1 244 244 ASP H H 1 7.46 0.008 . 1 . . . . . 244 ASP H . 52667 1 600 . 1 . 1 244 244 ASP C C 13 179.38 0.021 . 1 . . . . . 244 ASP C . 52667 1 601 . 1 . 1 244 244 ASP CA C 13 57.844 0.04 . 1 . . . . . 244 ASP CA . 52667 1 602 . 1 . 1 244 244 ASP CB C 13 41.055 0.027 . 1 . . . . . 244 ASP CB . 52667 1 603 . 1 . 1 244 244 ASP N N 15 118.857 0.019 . 1 . . . . . 244 ASP N . 52667 1 604 . 1 . 1 245 245 GLN H H 1 7.946 0.002 . 1 . . . . . 245 GLN H . 52667 1 605 . 1 . 1 245 245 GLN C C 13 178.084 0.026 . 1 . . . . . 245 GLN C . 52667 1 606 . 1 . 1 245 245 GLN CA C 13 59.816 0.035 . 1 . . . . . 245 GLN CA . 52667 1 607 . 1 . 1 245 245 GLN CB C 13 29.076 0.063 . 1 . . . . . 245 GLN CB . 52667 1 608 . 1 . 1 245 245 GLN N N 15 116.835 0.014 . 1 . . . . . 245 GLN N . 52667 1 609 . 1 . 1 246 246 PHE H H 1 8.349 0.003 . 1 . . . . . 246 PHE H . 52667 1 610 . 1 . 1 246 246 PHE C C 13 174.584 0 . 1 . . . . . 246 PHE C . 52667 1 611 . 1 . 1 246 246 PHE CA C 13 61.289 0.009 . 1 . . . . . 246 PHE CA . 52667 1 612 . 1 . 1 246 246 PHE CB C 13 39.875 0 . 1 . . . . . 246 PHE CB . 52667 1 613 . 1 . 1 246 246 PHE N N 15 114.132 0.028 . 1 . . . . . 246 PHE N . 52667 1 614 . 1 . 1 247 247 PHE C C 13 176.273 0.003 . 1 . . . . . 247 PHE C . 52667 1 615 . 1 . 1 248 248 GLY H H 1 7.245 0.003 . 1 . . . . . 248 GLY H . 52667 1 616 . 1 . 1 248 248 GLY C C 13 171.971 0 . 1 . . . . . 248 GLY C . 52667 1 617 . 1 . 1 248 248 GLY CA C 13 47.299 0.017 . 1 . . . . . 248 GLY CA . 52667 1 618 . 1 . 1 248 248 GLY N N 15 104.485 0.01 . 1 . . . . . 248 GLY N . 52667 1 619 . 1 . 1 249 249 VAL H H 1 8.832 0.001 . 1 . . . . . 249 VAL H . 52667 1 620 . 1 . 1 249 249 VAL C C 13 175.594 0.088 . 1 . . . . . 249 VAL C . 52667 1 621 . 1 . 1 249 249 VAL CA C 13 59.512 0.006 . 1 . . . . . 249 VAL CA . 52667 1 622 . 1 . 1 249 249 VAL CB C 13 33.14 0.008 . 1 . . . . . 249 VAL CB . 52667 1 623 . 1 . 1 249 249 VAL N N 15 125.965 0.035 . 1 . . . . . 249 VAL N . 52667 1 624 . 1 . 1 250 250 GLU H H 1 7.885 0.004 . 1 . . . . . 250 GLU H . 52667 1 625 . 1 . 1 250 250 GLU C C 13 174.911 0.005 . 1 . . . . . 250 GLU C . 52667 1 626 . 1 . 1 250 250 GLU CA C 13 53.808 0.037 . 1 . . . . . 250 GLU CA . 52667 1 627 . 1 . 1 250 250 GLU CB C 13 32.785 0.042 . 1 . . . . . 250 GLU CB . 52667 1 628 . 1 . 1 250 250 GLU N N 15 125.482 0.013 . 1 . . . . . 250 GLU N . 52667 1 629 . 1 . 1 251 251 PHE H H 1 9.12 0.002 . 1 . . . . . 251 PHE H . 52667 1 630 . 1 . 1 251 251 PHE C C 13 176.389 0.016 . 1 . . . . . 251 PHE C . 52667 1 631 . 1 . 1 251 251 PHE CA C 13 55.136 0.045 . 1 . . . . . 251 PHE CA . 52667 1 632 . 1 . 1 251 251 PHE CB C 13 41.482 0.005 . 1 . . . . . 251 PHE CB . 52667 1 633 . 1 . 1 251 251 PHE N N 15 120.614 0.025 . 1 . . . . . 251 PHE N . 52667 1 634 . 1 . 1 252 252 GLU H H 1 9.172 0.002 . 1 . . . . . 252 GLU H . 52667 1 635 . 1 . 1 252 252 GLU C C 13 176.874 0.018 . 1 . . . . . 252 GLU C . 52667 1 636 . 1 . 1 252 252 GLU CA C 13 55.268 0.039 . 1 . . . . . 252 GLU CA . 52667 1 637 . 1 . 1 252 252 GLU CB C 13 31.288 0.002 . 1 . . . . . 252 GLU CB . 52667 1 638 . 1 . 1 252 252 GLU N N 15 121.735 0.025 . 1 . . . . . 252 GLU N . 52667 1 639 . 1 . 1 253 253 THR H H 1 8.923 0.004 . 1 . . . . . 253 THR H . 52667 1 640 . 1 . 1 253 253 THR C C 13 174.286 0.035 . 1 . . . . . 253 THR C . 52667 1 641 . 1 . 1 253 253 THR CA C 13 59.275 0.023 . 1 . . . . . 253 THR CA . 52667 1 642 . 1 . 1 253 253 THR CB C 13 70.129 0.003 . 1 . . . . . 253 THR CB . 52667 1 643 . 1 . 1 253 253 THR N N 15 121.216 0.027 . 1 . . . . . 253 THR N . 52667 1 644 . 1 . 1 254 254 THR H H 1 9.041 0.004 . 1 . . . . . 254 THR H . 52667 1 645 . 1 . 1 254 254 THR C C 13 173.353 0.002 . 1 . . . . . 254 THR C . 52667 1 646 . 1 . 1 254 254 THR CA C 13 60.928 0.012 . 1 . . . . . 254 THR CA . 52667 1 647 . 1 . 1 254 254 THR CB C 13 70.977 0.01 . 1 . . . . . 254 THR CB . 52667 1 648 . 1 . 1 254 254 THR N N 15 117.701 0.01 . 1 . . . . . 254 THR N . 52667 1 649 . 1 . 1 255 255 MET H H 1 8.755 0.004 . 1 . . . . . 255 MET H . 52667 1 650 . 1 . 1 255 255 MET C C 13 173.954 0.001 . 1 . . . . . 255 MET C . 52667 1 651 . 1 . 1 255 255 MET CA C 13 54.275 0.021 . 1 . . . . . 255 MET CA . 52667 1 652 . 1 . 1 255 255 MET CB C 13 34.336 0 . 1 . . . . . 255 MET CB . 52667 1 653 . 1 . 1 255 255 MET N N 15 125.57 0.012 . 1 . . . . . 255 MET N . 52667 1 654 . 1 . 1 256 256 LYS H H 1 8.485 0.002 . 1 . . . . . 256 LYS H . 52667 1 655 . 1 . 1 256 256 LYS C C 13 174.477 0.002 . 1 . . . . . 256 LYS C . 52667 1 656 . 1 . 1 256 256 LYS CA C 13 53.505 0.013 . 1 . . . . . 256 LYS CA . 52667 1 657 . 1 . 1 256 256 LYS CB C 13 35.859 0.013 . 1 . . . . . 256 LYS CB . 52667 1 658 . 1 . 1 256 256 LYS N N 15 125.922 0.012 . 1 . . . . . 256 LYS N . 52667 1 659 . 1 . 1 257 257 CYS H H 1 9.654 0.003 . 1 . . . . . 257 CYS H . 52667 1 660 . 1 . 1 257 257 CYS C C 13 175.986 0.013 . 1 . . . . . 257 CYS C . 52667 1 661 . 1 . 1 257 257 CYS CA C 13 59.864 0.001 . 1 . . . . . 257 CYS CA . 52667 1 662 . 1 . 1 257 257 CYS CB C 13 27.293 0.014 . 1 . . . . . 257 CYS CB . 52667 1 663 . 1 . 1 257 257 CYS N N 15 128.776 0.037 . 1 . . . . . 257 CYS N . 52667 1 664 . 1 . 1 258 258 THR H H 1 8.769 0.004 . 1 . . . . . 258 THR H . 52667 1 665 . 1 . 1 258 258 THR C C 13 174.923 0.016 . 1 . . . . . 258 THR C . 52667 1 666 . 1 . 1 258 258 THR CA C 13 63.954 0.012 . 1 . . . . . 258 THR CA . 52667 1 667 . 1 . 1 258 258 THR CB C 13 68.481 0.078 . 1 . . . . . 258 THR CB . 52667 1 668 . 1 . 1 258 258 THR N N 15 121.729 0.055 . 1 . . . . . 258 THR N . 52667 1 669 . 1 . 1 259 259 GLU H H 1 7.072 0.003 . 1 . . . . . 259 GLU H . 52667 1 670 . 1 . 1 259 259 GLU C C 13 174.465 0.028 . 1 . . . . . 259 GLU C . 52667 1 671 . 1 . 1 259 259 GLU CA C 13 55.373 0.082 . 1 . . . . . 259 GLU CA . 52667 1 672 . 1 . 1 259 259 GLU CB C 13 31.506 0.03 . 1 . . . . . 259 GLU CB . 52667 1 673 . 1 . 1 259 259 GLU N N 15 118.255 0.007 . 1 . . . . . 259 GLU N . 52667 1 674 . 1 . 1 260 260 SER H H 1 6.624 0.007 . 1 . . . . . 260 SER H . 52667 1 675 . 1 . 1 260 260 SER C C 13 176.689 0 . 1 . . . . . 260 SER C . 52667 1 676 . 1 . 1 260 260 SER CA C 13 56.266 0.033 . 1 . . . . . 260 SER CA . 52667 1 677 . 1 . 1 260 260 SER CB C 13 63.152 0 . 1 . . . . . 260 SER CB . 52667 1 678 . 1 . 1 260 260 SER N N 15 112.4 0.018 . 1 . . . . . 260 SER N . 52667 1 679 . 1 . 1 261 261 GLU C C 13 177.041 0 . 1 . . . . . 261 GLU C . 52667 1 680 . 1 . 1 261 261 GLU CA C 13 57.258 0.015 . 1 . . . . . 261 GLU CA . 52667 1 681 . 1 . 1 261 261 GLU CB C 13 28.87 0 . 1 . . . . . 261 GLU CB . 52667 1 682 . 1 . 1 262 262 GLU H H 1 8.093 0.001 . 1 . . . . . 262 GLU H . 52667 1 683 . 1 . 1 262 262 GLU C C 13 176.427 0.004 . 1 . . . . . 262 GLU C . 52667 1 684 . 1 . 1 262 262 GLU CA C 13 56.387 0.043 . 1 . . . . . 262 GLU CA . 52667 1 685 . 1 . 1 262 262 GLU CB C 13 29.46 0.05 . 1 . . . . . 262 GLU CB . 52667 1 686 . 1 . 1 262 262 GLU N N 15 117.116 0.042 . 1 . . . . . 262 GLU N . 52667 1 687 . 1 . 1 263 263 GLU H H 1 7.085 0.006 . 1 . . . . . 263 GLU H . 52667 1 688 . 1 . 1 263 263 GLU C C 13 175.994 0.014 . 1 . . . . . 263 GLU C . 52667 1 689 . 1 . 1 263 263 GLU CA C 13 56.435 0.023 . 1 . . . . . 263 GLU CA . 52667 1 690 . 1 . 1 263 263 GLU CB C 13 29.422 0.02 . 1 . . . . . 263 GLU CB . 52667 1 691 . 1 . 1 263 263 GLU N N 15 121.185 0.032 . 1 . . . . . 263 GLU N . 52667 1 692 . 1 . 1 264 264 GLU H H 1 8.746 0.002 . 1 . . . . . 264 GLU H . 52667 1 693 . 1 . 1 264 264 GLU C C 13 177.057 0.001 . 1 . . . . . 264 GLU C . 52667 1 694 . 1 . 1 264 264 GLU CA C 13 56.562 0.019 . 1 . . . . . 264 GLU CA . 52667 1 695 . 1 . 1 264 264 GLU CB C 13 29.442 0.037 . 1 . . . . . 264 GLU CB . 52667 1 696 . 1 . 1 264 264 GLU N N 15 128.038 0.017 . 1 . . . . . 264 GLU N . 52667 1 697 . 1 . 1 265 265 VAL H H 1 8.555 0.001 . 1 . . . . . 265 VAL H . 52667 1 698 . 1 . 1 265 265 VAL C C 13 176.728 0.013 . 1 . . . . . 265 VAL C . 52667 1 699 . 1 . 1 265 265 VAL CA C 13 61.843 0.02 . 1 . . . . . 265 VAL CA . 52667 1 700 . 1 . 1 265 265 VAL CB C 13 31.801 0.013 . 1 . . . . . 265 VAL CB . 52667 1 701 . 1 . 1 265 265 VAL N N 15 124.692 0.01 . 1 . . . . . 265 VAL N . 52667 1 702 . 1 . 1 266 266 THR H H 1 8.249 0.003 . 1 . . . . . 266 THR H . 52667 1 703 . 1 . 1 266 266 THR C C 13 174.223 0 . 1 . . . . . 266 THR C . 52667 1 704 . 1 . 1 266 266 THR CA C 13 61.05 0.02 . 1 . . . . . 266 THR CA . 52667 1 705 . 1 . 1 266 266 THR CB C 13 70.116 0.019 . 1 . . . . . 266 THR CB . 52667 1 706 . 1 . 1 266 266 THR N N 15 118.937 0.031 . 1 . . . . . 266 THR N . 52667 1 707 . 1 . 1 267 267 LYS H H 1 8.763 0.001 . 1 . . . . . 267 LYS H . 52667 1 708 . 1 . 1 267 267 LYS C C 13 176.515 0.005 . 1 . . . . . 267 LYS C . 52667 1 709 . 1 . 1 267 267 LYS CA C 13 54.356 0.008 . 1 . . . . . 267 LYS CA . 52667 1 710 . 1 . 1 267 267 LYS CB C 13 33.967 0.001 . 1 . . . . . 267 LYS CB . 52667 1 711 . 1 . 1 267 267 LYS N N 15 126.515 0.019 . 1 . . . . . 267 LYS N . 52667 1 712 . 1 . 1 268 268 GLY H H 1 8.503 0.003 . 1 . . . . . 268 GLY H . 52667 1 713 . 1 . 1 268 268 GLY C C 13 173.012 0.025 . 1 . . . . . 268 GLY C . 52667 1 714 . 1 . 1 268 268 GLY CA C 13 44.283 0.01 . 1 . . . . . 268 GLY CA . 52667 1 715 . 1 . 1 268 268 GLY N N 15 111.517 0.013 . 1 . . . . . 268 GLY N . 52667 1 716 . 1 . 1 269 269 LYS H H 1 8.213 0.001 . 1 . . . . . 269 LYS H . 52667 1 717 . 1 . 1 269 269 LYS C C 13 175.934 0.024 . 1 . . . . . 269 LYS C . 52667 1 718 . 1 . 1 269 269 LYS CA C 13 54.668 0.01 . 1 . . . . . 269 LYS CA . 52667 1 719 . 1 . 1 269 269 LYS CB C 13 34.907 0.022 . 1 . . . . . 269 LYS CB . 52667 1 720 . 1 . 1 269 269 LYS N N 15 121.073 0.033 . 1 . . . . . 269 LYS N . 52667 1 721 . 1 . 1 270 270 GLU H H 1 8.486 0.001 . 1 . . . . . 270 GLU H . 52667 1 722 . 1 . 1 270 270 GLU C C 13 174.237 0.004 . 1 . . . . . 270 GLU C . 52667 1 723 . 1 . 1 270 270 GLU CA C 13 54.558 0.043 . 1 . . . . . 270 GLU CA . 52667 1 724 . 1 . 1 270 270 GLU CB C 13 33.454 0.047 . 1 . . . . . 270 GLU CB . 52667 1 725 . 1 . 1 270 270 GLU N N 15 120.812 0.011 . 1 . . . . . 270 GLU N . 52667 1 726 . 1 . 1 271 271 ASN H H 1 8.653 0.002 . 1 . . . . . 271 ASN H . 52667 1 727 . 1 . 1 271 271 ASN C C 13 174.287 0.004 . 1 . . . . . 271 ASN C . 52667 1 728 . 1 . 1 271 271 ASN CA C 13 52.662 0.01 . 1 . . . . . 271 ASN CA . 52667 1 729 . 1 . 1 271 271 ASN CB C 13 41.212 0.006 . 1 . . . . . 271 ASN CB . 52667 1 730 . 1 . 1 271 271 ASN N N 15 120.125 0.035 . 1 . . . . . 271 ASN N . 52667 1 731 . 1 . 1 272 272 GLN H H 1 8.871 0.001 . 1 . . . . . 272 GLN H . 52667 1 732 . 1 . 1 272 272 GLN C C 13 174.767 0 . 1 . . . . . 272 GLN C . 52667 1 733 . 1 . 1 272 272 GLN CA C 13 54.344 0.001 . 1 . . . . . 272 GLN CA . 52667 1 734 . 1 . 1 272 272 GLN CB C 13 33.121 0 . 1 . . . . . 272 GLN CB . 52667 1 735 . 1 . 1 272 272 GLN N N 15 118.902 0.012 . 1 . . . . . 272 GLN N . 52667 1 736 . 1 . 1 273 273 LEU C C 13 176.181 0.006 . 1 . . . . . 273 LEU C . 52667 1 737 . 1 . 1 273 273 LEU CA C 13 54.134 0.016 . 1 . . . . . 273 LEU CA . 52667 1 738 . 1 . 1 273 273 LEU CB C 13 42.365 0.036 . 1 . . . . . 273 LEU CB . 52667 1 739 . 1 . 1 274 274 GLN H H 1 7.436 0.008 . 1 . . . . . 274 GLN H . 52667 1 740 . 1 . 1 274 274 GLN C C 13 174.513 0.008 . 1 . . . . . 274 GLN C . 52667 1 741 . 1 . 1 274 274 GLN CA C 13 53.823 0.03 . 1 . . . . . 274 GLN CA . 52667 1 742 . 1 . 1 274 274 GLN CB C 13 32.085 0.032 . 1 . . . . . 274 GLN CB . 52667 1 743 . 1 . 1 274 274 GLN N N 15 113.401 0.013 . 1 . . . . . 274 GLN N . 52667 1 744 . 1 . 1 275 275 LEU H H 1 8.733 0.002 . 1 . . . . . 275 LEU H . 52667 1 745 . 1 . 1 275 275 LEU C C 13 175.819 0.009 . 1 . . . . . 275 LEU C . 52667 1 746 . 1 . 1 275 275 LEU CA C 13 52.868 0.022 . 1 . . . . . 275 LEU CA . 52667 1 747 . 1 . 1 275 275 LEU CB C 13 43.354 0.052 . 1 . . . . . 275 LEU CB . 52667 1 748 . 1 . 1 275 275 LEU N N 15 120.395 0.025 . 1 . . . . . 275 LEU N . 52667 1 749 . 1 . 1 276 276 SER H H 1 8.508 0.002 . 1 . . . . . 276 SER H . 52667 1 750 . 1 . 1 276 276 SER C C 13 172.104 0.004 . 1 . . . . . 276 SER C . 52667 1 751 . 1 . 1 276 276 SER CA C 13 56.959 0.025 . 1 . . . . . 276 SER CA . 52667 1 752 . 1 . 1 276 276 SER CB C 13 64.371 0.005 . 1 . . . . . 276 SER CB . 52667 1 753 . 1 . 1 276 276 SER N N 15 116.2 0.027 . 1 . . . . . 276 SER N . 52667 1 754 . 1 . 1 277 277 CYS H H 1 8.7 0.002 . 1 . . . . . 277 CYS H . 52667 1 755 . 1 . 1 277 277 CYS C C 13 173.6 0.004 . 1 . . . . . 277 CYS C . 52667 1 756 . 1 . 1 277 277 CYS CA C 13 56.712 0.076 . 1 . . . . . 277 CYS CA . 52667 1 757 . 1 . 1 277 277 CYS CB C 13 27.805 0.027 . 1 . . . . . 277 CYS CB . 52667 1 758 . 1 . 1 277 277 CYS N N 15 122.456 0.037 . 1 . . . . . 277 CYS N . 52667 1 759 . 1 . 1 278 278 PHE H H 1 7.597 0.002 . 1 . . . . . 278 PHE H . 52667 1 760 . 1 . 1 278 278 PHE C C 13 173.601 0.011 . 1 . . . . . 278 PHE C . 52667 1 761 . 1 . 1 278 278 PHE CA C 13 57.383 0.013 . 1 . . . . . 278 PHE CA . 52667 1 762 . 1 . 1 278 278 PHE CB C 13 39.023 0.063 . 1 . . . . . 278 PHE CB . 52667 1 763 . 1 . 1 278 278 PHE N N 15 129.712 0.013 . 1 . . . . . 278 PHE N . 52667 1 764 . 1 . 1 279 279 ILE H H 1 7.84 0.004 . 1 . . . . . 279 ILE H . 52667 1 765 . 1 . 1 279 279 ILE C C 13 174.3 0.001 . 1 . . . . . 279 ILE C . 52667 1 766 . 1 . 1 279 279 ILE CA C 13 60.906 0.008 . 1 . . . . . 279 ILE CA . 52667 1 767 . 1 . 1 279 279 ILE CB C 13 38.655 0.042 . 1 . . . . . 279 ILE CB . 52667 1 768 . 1 . 1 279 279 ILE N N 15 120.285 0.023 . 1 . . . . . 279 ILE N . 52667 1 769 . 1 . 1 280 280 ASN H H 1 6.578 0.003 . 1 . . . . . 280 ASN H . 52667 1 770 . 1 . 1 280 280 ASN C C 13 175.977 0 . 1 . . . . . 280 ASN C . 52667 1 771 . 1 . 1 280 280 ASN CA C 13 51.108 0.022 . 1 . . . . . 280 ASN CA . 52667 1 772 . 1 . 1 280 280 ASN CB C 13 38.34 0 . 1 . . . . . 280 ASN CB . 52667 1 773 . 1 . 1 280 280 ASN N N 15 123.097 0.012 . 1 . . . . . 280 ASN N . 52667 1 774 . 1 . 1 281 281 GLN C C 13 176.39 0 . 1 . . . . . 281 GLN C . 52667 1 775 . 1 . 1 281 281 GLN CA C 13 58.177 0.009 . 1 . . . . . 281 GLN CA . 52667 1 776 . 1 . 1 281 281 GLN CB C 13 27.441 0 . 1 . . . . . 281 GLN CB . 52667 1 777 . 1 . 1 282 282 GLU H H 1 8.027 0.004 . 1 . . . . . 282 GLU H . 52667 1 778 . 1 . 1 282 282 GLU C C 13 176.725 0.004 . 1 . . . . . 282 GLU C . 52667 1 779 . 1 . 1 282 282 GLU CA C 13 56.023 0.018 . 1 . . . . . 282 GLU CA . 52667 1 780 . 1 . 1 282 282 GLU CB C 13 29.193 0.007 . 1 . . . . . 282 GLU CB . 52667 1 781 . 1 . 1 282 282 GLU N N 15 116.95 0.026 . 1 . . . . . 282 GLU N . 52667 1 782 . 1 . 1 283 283 VAL H H 1 7.418 0.002 . 1 . . . . . 283 VAL H . 52667 1 783 . 1 . 1 283 283 VAL C C 13 174.5 0 . 1 . . . . . 283 VAL C . 52667 1 784 . 1 . 1 283 283 VAL CA C 13 63.63 0.025 . 1 . . . . . 283 VAL CA . 52667 1 785 . 1 . 1 283 283 VAL CB C 13 32.24 0 . 1 . . . . . 283 VAL CB . 52667 1 786 . 1 . 1 283 283 VAL N N 15 121.128 0.017 . 1 . . . . . 283 VAL N . 52667 1 787 . 1 . 1 285 285 TYR C C 13 175.67 0 . 1 . . . . . 285 TYR C . 52667 1 788 . 1 . 1 285 285 TYR CA C 13 55.742 0.016 . 1 . . . . . 285 TYR CA . 52667 1 789 . 1 . 1 285 285 TYR CB C 13 41.022 0 . 1 . . . . . 285 TYR CB . 52667 1 790 . 1 . 1 286 286 LEU H H 1 8.678 0.003 . 1 . . . . . 286 LEU H . 52667 1 791 . 1 . 1 286 286 LEU C C 13 177.87 0.02 . 1 . . . . . 286 LEU C . 52667 1 792 . 1 . 1 286 286 LEU CA C 13 57.85 0.056 . 1 . . . . . 286 LEU CA . 52667 1 793 . 1 . 1 286 286 LEU CB C 13 42.369 0.007 . 1 . . . . . 286 LEU CB . 52667 1 794 . 1 . 1 286 286 LEU N N 15 123.063 0.012 . 1 . . . . . 286 LEU N . 52667 1 795 . 1 . 1 287 287 PHE H H 1 8.93 0.003 . 1 . . . . . 287 PHE H . 52667 1 796 . 1 . 1 287 287 PHE C C 13 176.732 0.044 . 1 . . . . . 287 PHE C . 52667 1 797 . 1 . 1 287 287 PHE CA C 13 62.771 0.016 . 1 . . . . . 287 PHE CA . 52667 1 798 . 1 . 1 287 287 PHE CB C 13 38.704 0.015 . 1 . . . . . 287 PHE CB . 52667 1 799 . 1 . 1 287 287 PHE N N 15 117.21 0.025 . 1 . . . . . 287 PHE N . 52667 1 800 . 1 . 1 288 288 THR H H 1 7.175 0.006 . 1 . . . . . 288 THR H . 52667 1 801 . 1 . 1 288 288 THR C C 13 176.699 0 . 1 . . . . . 288 THR C . 52667 1 802 . 1 . 1 288 288 THR CA C 13 65.743 0.014 . 1 . . . . . 288 THR CA . 52667 1 803 . 1 . 1 288 288 THR CB C 13 68.59 0.035 . 1 . . . . . 288 THR CB . 52667 1 804 . 1 . 1 288 288 THR N N 15 111.52 0.013 . 1 . . . . . 288 THR N . 52667 1 805 . 1 . 1 289 289 GLY H H 1 7.414 0.004 . 1 . . . . . 289 GLY H . 52667 1 806 . 1 . 1 289 289 GLY C C 13 177.628 0.012 . 1 . . . . . 289 GLY C . 52667 1 807 . 1 . 1 289 289 GLY CA C 13 48.697 0.022 . 1 . . . . . 289 GLY CA . 52667 1 808 . 1 . 1 289 289 GLY N N 15 107.462 0.007 . 1 . . . . . 289 GLY N . 52667 1 809 . 1 . 1 290 290 LEU H H 1 7.994 0.006 . 1 . . . . . 290 LEU H . 52667 1 810 . 1 . 1 290 290 LEU C C 13 179.128 0.027 . 1 . . . . . 290 LEU C . 52667 1 811 . 1 . 1 290 290 LEU CA C 13 56.699 0.058 . 1 . . . . . 290 LEU CA . 52667 1 812 . 1 . 1 290 290 LEU CB C 13 40.828 0.032 . 1 . . . . . 290 LEU CB . 52667 1 813 . 1 . 1 290 290 LEU N N 15 121.989 0.019 . 1 . . . . . 290 LEU N . 52667 1 814 . 1 . 1 291 291 LYS H H 1 7.73 0.004 . 1 . . . . . 291 LYS H . 52667 1 815 . 1 . 1 291 291 LYS C C 13 180.063 0.011 . 1 . . . . . 291 LYS C . 52667 1 816 . 1 . 1 291 291 LYS CA C 13 59.453 0.021 . 1 . . . . . 291 LYS CA . 52667 1 817 . 1 . 1 291 291 LYS CB C 13 31.378 0.064 . 1 . . . . . 291 LYS CB . 52667 1 818 . 1 . 1 291 291 LYS N N 15 118.211 0.024 . 1 . . . . . 291 LYS N . 52667 1 819 . 1 . 1 292 292 LEU H H 1 7.794 0.006 . 1 . . . . . 292 LEU H . 52667 1 820 . 1 . 1 292 292 LEU C C 13 178.649 0.027 . 1 . . . . . 292 LEU C . 52667 1 821 . 1 . 1 292 292 LEU CA C 13 57.132 0.019 . 1 . . . . . 292 LEU CA . 52667 1 822 . 1 . 1 292 292 LEU CB C 13 41.36 0.005 . 1 . . . . . 292 LEU CB . 52667 1 823 . 1 . 1 292 292 LEU N N 15 118.387 0.018 . 1 . . . . . 292 LEU N . 52667 1 824 . 1 . 1 293 293 ARG H H 1 7.022 0.004 . 1 . . . . . 293 ARG H . 52667 1 825 . 1 . 1 293 293 ARG C C 13 176.645 0.018 . 1 . . . . . 293 ARG C . 52667 1 826 . 1 . 1 293 293 ARG CA C 13 55.199 0.028 . 1 . . . . . 293 ARG CA . 52667 1 827 . 1 . 1 293 293 ARG CB C 13 28.985 0.031 . 1 . . . . . 293 ARG CB . 52667 1 828 . 1 . 1 293 293 ARG N N 15 116.311 0.017 . 1 . . . . . 293 ARG N . 52667 1 829 . 1 . 1 294 294 LEU H H 1 7.187 0.002 . 1 . . . . . 294 LEU H . 52667 1 830 . 1 . 1 294 294 LEU C C 13 175.328 0.01 . 1 . . . . . 294 LEU C . 52667 1 831 . 1 . 1 294 294 LEU CA C 13 54.874 0.059 . 1 . . . . . 294 LEU CA . 52667 1 832 . 1 . 1 294 294 LEU CB C 13 38.901 0.057 . 1 . . . . . 294 LEU CB . 52667 1 833 . 1 . 1 294 294 LEU N N 15 117.454 0.019 . 1 . . . . . 294 LEU N . 52667 1 834 . 1 . 1 295 295 GLN H H 1 7.179 0.002 . 1 . . . . . 295 GLN H . 52667 1 835 . 1 . 1 295 295 GLN C C 13 173.887 0.003 . 1 . . . . . 295 GLN C . 52667 1 836 . 1 . 1 295 295 GLN CA C 13 54.65 0.019 . 1 . . . . . 295 GLN CA . 52667 1 837 . 1 . 1 295 295 GLN CB C 13 30.544 0.004 . 1 . . . . . 295 GLN CB . 52667 1 838 . 1 . 1 295 295 GLN N N 15 119.045 0.012 . 1 . . . . . 295 GLN N . 52667 1 839 . 1 . 1 296 296 GLU H H 1 8.705 0.006 . 1 . . . . . 296 GLU H . 52667 1 840 . 1 . 1 296 296 GLU C C 13 174.441 0.007 . 1 . . . . . 296 GLU C . 52667 1 841 . 1 . 1 296 296 GLU CA C 13 54.627 0.018 . 1 . . . . . 296 GLU CA . 52667 1 842 . 1 . 1 296 296 GLU CB C 13 33.401 0.014 . 1 . . . . . 296 GLU CB . 52667 1 843 . 1 . 1 296 296 GLU N N 15 122.494 0.027 . 1 . . . . . 296 GLU N . 52667 1 844 . 1 . 1 297 297 GLU H H 1 8.48 0.002 . 1 . . . . . 297 GLU H . 52667 1 845 . 1 . 1 297 297 GLU C C 13 176.259 0.01 . 1 . . . . . 297 GLU C . 52667 1 846 . 1 . 1 297 297 GLU CA C 13 55.199 0.018 . 1 . . . . . 297 GLU CA . 52667 1 847 . 1 . 1 297 297 GLU CB C 13 30.029 0.009 . 1 . . . . . 297 GLU CB . 52667 1 848 . 1 . 1 297 297 GLU N N 15 123.648 0.012 . 1 . . . . . 297 GLU N . 52667 1 849 . 1 . 1 298 298 ILE H H 1 9.083 0.003 . 1 . . . . . 298 ILE H . 52667 1 850 . 1 . 1 298 298 ILE C C 13 174.414 0.001 . 1 . . . . . 298 ILE C . 52667 1 851 . 1 . 1 298 298 ILE CA C 13 59.26 0.016 . 1 . . . . . 298 ILE CA . 52667 1 852 . 1 . 1 298 298 ILE CB C 13 41.763 0.015 . 1 . . . . . 298 ILE CB . 52667 1 853 . 1 . 1 298 298 ILE N N 15 124.668 0.018 . 1 . . . . . 298 ILE N . 52667 1 854 . 1 . 1 299 299 THR H H 1 8.531 0.002 . 1 . . . . . 299 THR H . 52667 1 855 . 1 . 1 299 299 THR C C 13 174.125 0.014 . 1 . . . . . 299 THR C . 52667 1 856 . 1 . 1 299 299 THR CA C 13 61.525 0.026 . 1 . . . . . 299 THR CA . 52667 1 857 . 1 . 1 299 299 THR CB C 13 68.825 0.011 . 1 . . . . . 299 THR CB . 52667 1 858 . 1 . 1 299 299 THR N N 15 122.865 0.011 . 1 . . . . . 299 THR N . 52667 1 859 . 1 . 1 300 300 LYS H H 1 8.792 0.005 . 1 . . . . . 300 LYS H . 52667 1 860 . 1 . 1 300 300 LYS C C 13 174.597 0.006 . 1 . . . . . 300 LYS C . 52667 1 861 . 1 . 1 300 300 LYS CA C 13 54.324 0.009 . 1 . . . . . 300 LYS CA . 52667 1 862 . 1 . 1 300 300 LYS CB C 13 34.058 0.007 . 1 . . . . . 300 LYS CB . 52667 1 863 . 1 . 1 300 300 LYS N N 15 124.739 0.018 . 1 . . . . . 300 LYS N . 52667 1 864 . 1 . 1 301 301 GLN H H 1 8.338 0.001 . 1 . . . . . 301 GLN H . 52667 1 865 . 1 . 1 301 301 GLN C C 13 175.66 0.008 . 1 . . . . . 301 GLN C . 52667 1 866 . 1 . 1 301 301 GLN CA C 13 56.87 0.012 . 1 . . . . . 301 GLN CA . 52667 1 867 . 1 . 1 301 301 GLN CB C 13 27.17 0.01 . 1 . . . . . 301 GLN CB . 52667 1 868 . 1 . 1 301 301 GLN N N 15 121.346 0.01 . 1 . . . . . 301 GLN N . 52667 1 869 . 1 . 1 302 302 SER H H 1 8.294 0.003 . 1 . . . . . 302 SER H . 52667 1 870 . 1 . 1 302 302 SER C C 13 176.53 0 . 1 . . . . . 302 SER C . 52667 1 871 . 1 . 1 302 302 SER CB C 13 63.991 0 . 1 . . . . . 302 SER CB . 52667 1 872 . 1 . 1 302 302 SER N N 15 122.104 0.025 . 1 . . . . . 302 SER N . 52667 1 873 . 1 . 1 304 304 THR C C 13 176.551 0.001 . 1 . . . . . 304 THR C . 52667 1 874 . 1 . 1 304 304 THR CA C 13 63.939 0.006 . 1 . . . . . 304 THR CA . 52667 1 875 . 1 . 1 304 304 THR CB C 13 68.777 0.009 . 1 . . . . . 304 THR CB . 52667 1 876 . 1 . 1 305 305 LEU H H 1 7.788 0.003 . 1 . . . . . 305 LEU H . 52667 1 877 . 1 . 1 305 305 LEU C C 13 176.945 0.024 . 1 . . . . . 305 LEU C . 52667 1 878 . 1 . 1 305 305 LEU CA C 13 54.595 0.023 . 1 . . . . . 305 LEU CA . 52667 1 879 . 1 . 1 305 305 LEU CB C 13 41.977 0.015 . 1 . . . . . 305 LEU CB . 52667 1 880 . 1 . 1 305 305 LEU N N 15 120.655 0.016 . 1 . . . . . 305 LEU N . 52667 1 881 . 1 . 1 306 306 GLN H H 1 8.169 0.002 . 1 . . . . . 306 GLN H . 52667 1 882 . 1 . 1 306 306 GLN C C 13 174.131 0.002 . 1 . . . . . 306 GLN C . 52667 1 883 . 1 . 1 306 306 GLN CA C 13 56.324 0.012 . 1 . . . . . 306 GLN CA . 52667 1 884 . 1 . 1 306 306 GLN CB C 13 24.716 0.042 . 1 . . . . . 306 GLN CB . 52667 1 885 . 1 . 1 306 306 GLN N N 15 113.704 0.034 . 1 . . . . . 306 GLN N . 52667 1 886 . 1 . 1 307 307 ARG H H 1 7.212 0.002 . 1 . . . . . 307 ARG H . 52667 1 887 . 1 . 1 307 307 ARG C C 13 175.607 0 . 1 . . . . . 307 ARG C . 52667 1 888 . 1 . 1 307 307 ARG CA C 13 54.005 0.018 . 1 . . . . . 307 ARG CA . 52667 1 889 . 1 . 1 307 307 ARG CB C 13 30.388 0 . 1 . . . . . 307 ARG CB . 52667 1 890 . 1 . 1 307 307 ARG N N 15 110.11 0.021 . 1 . . . . . 307 ARG N . 52667 1 891 . 1 . 1 308 308 ASN C C 13 175.083 0 . 1 . . . . . 308 ASN C . 52667 1 892 . 1 . 1 308 308 ASN CA C 13 53.545 0.01 . 1 . . . . . 308 ASN CA . 52667 1 893 . 1 . 1 308 308 ASN CB C 13 37.909 0 . 1 . . . . . 308 ASN CB . 52667 1 894 . 1 . 1 309 309 ALA H H 1 9.136 0.001 . 1 . . . . . 309 ALA H . 52667 1 895 . 1 . 1 309 309 ALA C C 13 174.023 0.008 . 1 . . . . . 309 ALA C . 52667 1 896 . 1 . 1 309 309 ALA CA C 13 49.994 0.01 . 1 . . . . . 309 ALA CA . 52667 1 897 . 1 . 1 309 309 ALA CB C 13 23.763 0.003 . 1 . . . . . 309 ALA CB . 52667 1 898 . 1 . 1 309 309 ALA N N 15 125.972 0.02 . 1 . . . . . 309 ALA N . 52667 1 899 . 1 . 1 310 310 LEU H H 1 8.598 0.004 . 1 . . . . . 310 LEU H . 52667 1 900 . 1 . 1 310 310 LEU C C 13 177.001 0.005 . 1 . . . . . 310 LEU C . 52667 1 901 . 1 . 1 310 310 LEU CA C 13 54.827 0.004 . 1 . . . . . 310 LEU CA . 52667 1 902 . 1 . 1 310 310 LEU CB C 13 41.327 0.004 . 1 . . . . . 310 LEU CB . 52667 1 903 . 1 . 1 310 310 LEU N N 15 121.082 0.008 . 1 . . . . . 310 LEU N . 52667 1 904 . 1 . 1 311 311 TYR H H 1 9.976 0.002 . 1 . . . . . 311 TYR H . 52667 1 905 . 1 . 1 311 311 TYR C C 13 174.91 0.007 . 1 . . . . . 311 TYR C . 52667 1 906 . 1 . 1 311 311 TYR CA C 13 56.447 0.024 . 1 . . . . . 311 TYR CA . 52667 1 907 . 1 . 1 311 311 TYR CB C 13 40.631 0.008 . 1 . . . . . 311 TYR CB . 52667 1 908 . 1 . 1 311 311 TYR N N 15 129.915 0.019 . 1 . . . . . 311 TYR N . 52667 1 909 . 1 . 1 312 312 ILE H H 1 8.709 0.002 . 1 . . . . . 312 ILE H . 52667 1 910 . 1 . 1 312 312 ILE C C 13 175.758 0.024 . 1 . . . . . 312 ILE C . 52667 1 911 . 1 . 1 312 312 ILE CA C 13 58.627 0.014 . 1 . . . . . 312 ILE CA . 52667 1 912 . 1 . 1 312 312 ILE CB C 13 38.884 0.017 . 1 . . . . . 312 ILE CB . 52667 1 913 . 1 . 1 312 312 ILE N N 15 118.303 0.016 . 1 . . . . . 312 ILE N . 52667 1 914 . 1 . 1 313 313 LYS H H 1 9.318 0.002 . 1 . . . . . 313 LYS H . 52667 1 915 . 1 . 1 313 313 LYS C C 13 175.267 0.004 . 1 . . . . . 313 LYS C . 52667 1 916 . 1 . 1 313 313 LYS CA C 13 53.938 0.032 . 1 . . . . . 313 LYS CA . 52667 1 917 . 1 . 1 313 313 LYS CB C 13 34.154 0.01 . 1 . . . . . 313 LYS CB . 52667 1 918 . 1 . 1 313 313 LYS N N 15 132.188 0.017 . 1 . . . . . 313 LYS N . 52667 1 919 . 1 . 1 314 314 SER H H 1 9.194 0.003 . 1 . . . . . 314 SER H . 52667 1 920 . 1 . 1 314 314 SER C C 13 173.953 0.022 . 1 . . . . . 314 SER C . 52667 1 921 . 1 . 1 314 314 SER CA C 13 56.409 0.007 . 1 . . . . . 314 SER CA . 52667 1 922 . 1 . 1 314 314 SER CB C 13 64.214 0.015 . 1 . . . . . 314 SER CB . 52667 1 923 . 1 . 1 314 314 SER N N 15 123.81 0.015 . 1 . . . . . 314 SER N . 52667 1 924 . 1 . 1 315 315 SER H H 1 8.631 0.003 . 1 . . . . . 315 SER H . 52667 1 925 . 1 . 1 315 315 SER C C 13 172.642 0.019 . 1 . . . . . 315 SER C . 52667 1 926 . 1 . 1 315 315 SER CA C 13 57.773 0.022 . 1 . . . . . 315 SER CA . 52667 1 927 . 1 . 1 315 315 SER CB C 13 64.835 0.005 . 1 . . . . . 315 SER CB . 52667 1 928 . 1 . 1 315 315 SER N N 15 120.943 0.018 . 1 . . . . . 315 SER N . 52667 1 929 . 1 . 1 316 316 LYS H H 1 8.46 0.002 . 1 . . . . . 316 LYS H . 52667 1 930 . 1 . 1 316 316 LYS C C 13 175.509 0.018 . 1 . . . . . 316 LYS C . 52667 1 931 . 1 . 1 316 316 LYS CA C 13 53.883 0.014 . 1 . . . . . 316 LYS CA . 52667 1 932 . 1 . 1 316 316 LYS CB C 13 37.169 0.026 . 1 . . . . . 316 LYS CB . 52667 1 933 . 1 . 1 316 316 LYS N N 15 121.433 0.043 . 1 . . . . . 316 LYS N . 52667 1 934 . 1 . 1 317 317 ILE H H 1 9.111 0.002 . 1 . . . . . 317 ILE H . 52667 1 935 . 1 . 1 317 317 ILE C C 13 174.569 0.02 . 1 . . . . . 317 ILE C . 52667 1 936 . 1 . 1 317 317 ILE CA C 13 62.942 0.069 . 1 . . . . . 317 ILE CA . 52667 1 937 . 1 . 1 317 317 ILE CB C 13 37.31 0.049 . 1 . . . . . 317 ILE CB . 52667 1 938 . 1 . 1 317 317 ILE N N 15 123.253 0.021 . 1 . . . . . 317 ILE N . 52667 1 939 . 1 . 1 318 318 SER H H 1 9.218 0.004 . 1 . . . . . 318 SER H . 52667 1 940 . 1 . 1 318 318 SER C C 13 175.351 0.031 . 1 . . . . . 318 SER C . 52667 1 941 . 1 . 1 318 318 SER CA C 13 57.68 0.044 . 1 . . . . . 318 SER CA . 52667 1 942 . 1 . 1 318 318 SER CB C 13 64.438 0 . 1 . . . . . 318 SER CB . 52667 1 943 . 1 . 1 318 318 SER N N 15 123.064 0.022 . 1 . . . . . 318 SER N . 52667 1 944 . 1 . 1 319 319 ARG H H 1 7.412 0.005 . 1 . . . . . 319 ARG H . 52667 1 945 . 1 . 1 319 319 ARG C C 13 173.974 0.002 . 1 . . . . . 319 ARG C . 52667 1 946 . 1 . 1 319 319 ARG CA C 13 58.881 0.043 . 1 . . . . . 319 ARG CA . 52667 1 947 . 1 . 1 319 319 ARG CB C 13 32.667 0.005 . 1 . . . . . 319 ARG CB . 52667 1 948 . 1 . 1 319 319 ARG N N 15 125.878 0.026 . 1 . . . . . 319 ARG N . 52667 1 949 . 1 . 1 320 320 LEU H H 1 8.819 0.002 . 1 . . . . . 320 LEU H . 52667 1 950 . 1 . 1 320 320 LEU C C 13 175.155 0 . 1 . . . . . 320 LEU C . 52667 1 951 . 1 . 1 320 320 LEU CA C 13 49.944 0.007 . 1 . . . . . 320 LEU CA . 52667 1 952 . 1 . 1 320 320 LEU CB C 13 42.06 0 . 1 . . . . . 320 LEU CB . 52667 1 953 . 1 . 1 320 320 LEU N N 15 126.945 0.012 . 1 . . . . . 320 LEU N . 52667 1 954 . 1 . 1 324 324 LEU C C 13 174.655 0 . 1 . . . . . 324 LEU C . 52667 1 955 . 1 . 1 324 324 LEU CA C 13 52.519 0.008 . 1 . . . . . 324 LEU CA . 52667 1 956 . 1 . 1 324 324 LEU CB C 13 44.559 0.007 . 1 . . . . . 324 LEU CB . 52667 1 957 . 1 . 1 325 325 THR H H 1 8.692 0.002 . 1 . . . . . 325 THR H . 52667 1 958 . 1 . 1 325 325 THR C C 13 173.84 0 . 1 . . . . . 325 THR C . 52667 1 959 . 1 . 1 325 325 THR CA C 13 61.556 0.008 . 1 . . . . . 325 THR CA . 52667 1 960 . 1 . 1 325 325 THR CB C 13 68.391 0 . 1 . . . . . 325 THR CB . 52667 1 961 . 1 . 1 325 325 THR N N 15 125.951 0.037 . 1 . . . . . 325 THR N . 52667 1 962 . 1 . 1 326 326 ILE C C 13 174.141 0 . 1 . . . . . 326 ILE C . 52667 1 963 . 1 . 1 326 326 ILE CA C 13 58.503 0.005 . 1 . . . . . 326 ILE CA . 52667 1 964 . 1 . 1 326 326 ILE CB C 13 41.048 0 . 1 . . . . . 326 ILE CB . 52667 1 965 . 1 . 1 327 327 GLN H H 1 8.666 0.002 . 1 . . . . . 327 GLN H . 52667 1 966 . 1 . 1 327 327 GLN C C 13 175.388 0.008 . 1 . . . . . 327 GLN C . 52667 1 967 . 1 . 1 327 327 GLN CA C 13 53.301 0.059 . 1 . . . . . 327 GLN CA . 52667 1 968 . 1 . 1 327 327 GLN CB C 13 27.617 0.061 . 1 . . . . . 327 GLN CB . 52667 1 969 . 1 . 1 327 327 GLN N N 15 127.348 0.014 . 1 . . . . . 327 GLN N . 52667 1 970 . 1 . 1 328 328 MET H H 1 9.331 0.004 . 1 . . . . . 328 MET H . 52667 1 971 . 1 . 1 328 328 MET C C 13 176.157 0.006 . 1 . . . . . 328 MET C . 52667 1 972 . 1 . 1 328 328 MET CA C 13 53.961 0.012 . 1 . . . . . 328 MET CA . 52667 1 973 . 1 . 1 328 328 MET CB C 13 31.214 0.037 . 1 . . . . . 328 MET CB . 52667 1 974 . 1 . 1 328 328 MET N N 15 127.65 0.02 . 1 . . . . . 328 MET N . 52667 1 975 . 1 . 1 329 329 VAL H H 1 8.236 0.002 . 1 . . . . . 329 VAL H . 52667 1 976 . 1 . 1 329 329 VAL C C 13 175.211 0.007 . 1 . . . . . 329 VAL C . 52667 1 977 . 1 . 1 329 329 VAL CA C 13 63.282 0.036 . 1 . . . . . 329 VAL CA . 52667 1 978 . 1 . 1 329 329 VAL CB C 13 28.421 0.041 . 1 . . . . . 329 VAL CB . 52667 1 979 . 1 . 1 329 329 VAL N N 15 126.218 0.03 . 1 . . . . . 329 VAL N . 52667 1 980 . 1 . 1 330 330 ARG H H 1 7.655 0.003 . 1 . . . . . 330 ARG H . 52667 1 981 . 1 . 1 330 330 ARG C C 13 174.583 0.013 . 1 . . . . . 330 ARG C . 52667 1 982 . 1 . 1 330 330 ARG CA C 13 54.873 0.031 . 1 . . . . . 330 ARG CA . 52667 1 983 . 1 . 1 330 330 ARG CB C 13 31.436 0.025 . 1 . . . . . 330 ARG CB . 52667 1 984 . 1 . 1 330 330 ARG N N 15 125.392 0.059 . 1 . . . . . 330 ARG N . 52667 1 985 . 1 . 1 331 331 PHE H H 1 8.135 0.004 . 1 . . . . . 331 PHE H . 52667 1 986 . 1 . 1 331 331 PHE C C 13 175.061 0.011 . 1 . . . . . 331 PHE C . 52667 1 987 . 1 . 1 331 331 PHE CA C 13 55.635 0.031 . 1 . . . . . 331 PHE CA . 52667 1 988 . 1 . 1 331 331 PHE CB C 13 39.378 0.036 . 1 . . . . . 331 PHE CB . 52667 1 989 . 1 . 1 331 331 PHE N N 15 117.772 0.019 . 1 . . . . . 331 PHE N . 52667 1 990 . 1 . 1 332 332 PHE H H 1 8.431 0.003 . 1 . . . . . 332 PHE H . 52667 1 991 . 1 . 1 332 332 PHE C C 13 173.066 0.001 . 1 . . . . . 332 PHE C . 52667 1 992 . 1 . 1 332 332 PHE CA C 13 55.937 0.032 . 1 . . . . . 332 PHE CA . 52667 1 993 . 1 . 1 332 332 PHE CB C 13 40.235 0.018 . 1 . . . . . 332 PHE CB . 52667 1 994 . 1 . 1 332 332 PHE N N 15 120.402 0.017 . 1 . . . . . 332 PHE N . 52667 1 995 . 1 . 1 333 333 TYR H H 1 8.512 0.003 . 1 . . . . . 333 TYR H . 52667 1 996 . 1 . 1 333 333 TYR C C 13 175.424 0 . 1 . . . . . 333 TYR C . 52667 1 997 . 1 . 1 333 333 TYR CA C 13 57.365 0.003 . 1 . . . . . 333 TYR CA . 52667 1 998 . 1 . 1 333 333 TYR CB C 13 38.699 0 . 1 . . . . . 333 TYR CB . 52667 1 999 . 1 . 1 333 333 TYR N N 15 122.157 0.029 . 1 . . . . . 333 TYR N . 52667 1 1000 . 1 . 1 338 338 SER C C 13 174.048 0.007 . 1 . . . . . 338 SER C . 52667 1 1001 . 1 . 1 338 338 SER CA C 13 58.051 0.004 . 1 . . . . . 338 SER CA . 52667 1 1002 . 1 . 1 339 339 VAL H H 1 7.317 0.003 . 1 . . . . . 339 VAL H . 52667 1 1003 . 1 . 1 339 339 VAL C C 13 174.488 0.006 . 1 . . . . . 339 VAL C . 52667 1 1004 . 1 . 1 339 339 VAL CA C 13 60.299 0.043 . 1 . . . . . 339 VAL CA . 52667 1 1005 . 1 . 1 339 339 VAL CB C 13 33.394 0 . 1 . . . . . 339 VAL CB . 52667 1 1006 . 1 . 1 339 339 VAL N N 15 117.384 0 . 1 . . . . . 339 VAL N . 52667 1 1007 . 1 . 1 340 340 ASN H H 1 8.279 0.002 . 1 . . . . . 340 ASN H . 52667 1 1008 . 1 . 1 340 340 ASN C C 13 173.828 0.003 . 1 . . . . . 340 ASN C . 52667 1 1009 . 1 . 1 340 340 ASN CA C 13 52.47 0.044 . 1 . . . . . 340 ASN CA . 52667 1 1010 . 1 . 1 340 340 ASN CB C 13 38.442 0.089 . 1 . . . . . 340 ASN CB . 52667 1 1011 . 1 . 1 340 340 ASN N N 15 122.858 0.031 . 1 . . . . . 340 ASN N . 52667 1 1012 . 1 . 1 341 341 ALA H H 1 8.309 0.001 . 1 . . . . . 341 ALA H . 52667 1 1013 . 1 . 1 341 341 ALA C C 13 175.861 0.025 . 1 . . . . . 341 ALA C . 52667 1 1014 . 1 . 1 341 341 ALA CA C 13 51.135 0.05 . 1 . . . . . 341 ALA CA . 52667 1 1015 . 1 . 1 341 341 ALA CB C 13 20.545 0.009 . 1 . . . . . 341 ALA CB . 52667 1 1016 . 1 . 1 341 341 ALA N N 15 124.869 0.048 . 1 . . . . . 341 ALA N . 52667 1 1017 . 1 . 1 342 342 LYS H H 1 7.643 0.002 . 1 . . . . . 342 LYS H . 52667 1 1018 . 1 . 1 342 342 LYS C C 13 175.905 0 . 1 . . . . . 342 LYS C . 52667 1 1019 . 1 . 1 342 342 LYS CA C 13 54.295 0.071 . 1 . . . . . 342 LYS CA . 52667 1 1020 . 1 . 1 342 342 LYS CB C 13 35.805 0 . 1 . . . . . 342 LYS CB . 52667 1 1021 . 1 . 1 342 342 LYS N N 15 120.571 0.009 . 1 . . . . . 342 LYS N . 52667 1 1022 . 1 . 1 343 343 VAL H H 1 9.076 0.004 . 1 . . . . . 343 VAL H . 52667 1 1023 . 1 . 1 343 343 VAL C C 13 175.09 0 . 1 . . . . . 343 VAL C . 52667 1 1024 . 1 . 1 343 343 VAL CA C 13 61.886 0.102 . 1 . . . . . 343 VAL CA . 52667 1 1025 . 1 . 1 343 343 VAL CB C 13 31.983 0 . 1 . . . . . 343 VAL CB . 52667 1 1026 . 1 . 1 343 343 VAL N N 15 127.759 0.022 . 1 . . . . . 343 VAL N . 52667 1 1027 . 1 . 1 344 344 LEU C C 13 176.289 0.011 . 1 . . . . . 344 LEU C . 52667 1 1028 . 1 . 1 344 344 LEU CA C 13 54.535 0.029 . 1 . . . . . 344 LEU CA . 52667 1 1029 . 1 . 1 344 344 LEU CB C 13 42.859 0.007 . 1 . . . . . 344 LEU CB . 52667 1 1030 . 1 . 1 345 345 LYS H H 1 6.516 0.002 . 1 . . . . . 345 LYS H . 52667 1 1031 . 1 . 1 345 345 LYS C C 13 175.301 0.008 . 1 . . . . . 345 LYS C . 52667 1 1032 . 1 . 1 345 345 LYS CA C 13 56.665 0.024 . 1 . . . . . 345 LYS CA . 52667 1 1033 . 1 . 1 345 345 LYS CB C 13 33.155 0.026 . 1 . . . . . 345 LYS CB . 52667 1 1034 . 1 . 1 345 345 LYS N N 15 117.909 0.032 . 1 . . . . . 345 LYS N . 52667 1 1035 . 1 . 1 346 346 ASP H H 1 8.634 0.004 . 1 . . . . . 346 ASP H . 52667 1 1036 . 1 . 1 346 346 ASP C C 13 175.947 0.03 . 1 . . . . . 346 ASP C . 52667 1 1037 . 1 . 1 346 346 ASP CA C 13 54.188 0.038 . 1 . . . . . 346 ASP CA . 52667 1 1038 . 1 . 1 346 346 ASP CB C 13 40.34 0 . 1 . . . . . 346 ASP CB . 52667 1 1039 . 1 . 1 346 346 ASP N N 15 125.671 0.013 . 1 . . . . . 346 ASP N . 52667 1 1040 . 1 . 1 347 347 VAL H H 1 7.926 0.002 . 1 . . . . . 347 VAL H . 52667 1 1041 . 1 . 1 347 347 VAL C C 13 174.862 0.019 . 1 . . . . . 347 VAL C . 52667 1 1042 . 1 . 1 347 347 VAL CA C 13 61.174 0.004 . 1 . . . . . 347 VAL CA . 52667 1 1043 . 1 . 1 347 347 VAL CB C 13 32.788 0.007 . 1 . . . . . 347 VAL CB . 52667 1 1044 . 1 . 1 347 347 VAL N N 15 128.679 0.011 . 1 . . . . . 347 VAL N . 52667 1 1045 . 1 . 1 348 348 LYS H H 1 7.695 0.002 . 1 . . . . . 348 LYS H . 52667 1 1046 . 1 . 1 348 348 LYS C C 13 175.899 0.007 . 1 . . . . . 348 LYS C . 52667 1 1047 . 1 . 1 348 348 LYS CA C 13 56.34 0.019 . 1 . . . . . 348 LYS CA . 52667 1 1048 . 1 . 1 348 348 LYS CB C 13 31.639 0.025 . 1 . . . . . 348 LYS CB . 52667 1 1049 . 1 . 1 348 348 LYS N N 15 124.365 0.011 . 1 . . . . . 348 LYS N . 52667 1 1050 . 1 . 1 349 349 PHE H H 1 7.442 0.003 . 1 . . . . . 349 PHE H . 52667 1 1051 . 1 . 1 349 349 PHE C C 13 172.426 0 . 1 . . . . . 349 PHE C . 52667 1 1052 . 1 . 1 349 349 PHE CA C 13 51.674 0.004 . 1 . . . . . 349 PHE CA . 52667 1 1053 . 1 . 1 349 349 PHE CB C 13 40.143 0 . 1 . . . . . 349 PHE CB . 52667 1 1054 . 1 . 1 349 349 PHE N N 15 118.833 0.021 . 1 . . . . . 349 PHE N . 52667 1 1055 . 1 . 1 350 350 PRO C C 13 177.676 0 . 1 . . . . . 350 PRO C . 52667 1 1056 . 1 . 1 350 350 PRO CA C 13 60.716 0.012 . 1 . . . . . 350 PRO CA . 52667 1 1057 . 1 . 1 350 350 PRO CB C 13 31.366 0 . 1 . . . . . 350 PRO CB . 52667 1 1058 . 1 . 1 351 351 LEU H H 1 8.684 0.002 . 1 . . . . . 351 LEU H . 52667 1 1059 . 1 . 1 351 351 LEU C C 13 176.863 0.015 . 1 . . . . . 351 LEU C . 52667 1 1060 . 1 . 1 351 351 LEU CA C 13 56.875 0.022 . 1 . . . . . 351 LEU CA . 52667 1 1061 . 1 . 1 351 351 LEU CB C 13 40.017 0.005 . 1 . . . . . 351 LEU CB . 52667 1 1062 . 1 . 1 351 351 LEU N N 15 119.896 0.025 . 1 . . . . . 351 LEU N . 52667 1 1063 . 1 . 1 352 352 MET H H 1 7.847 0.002 . 1 . . . . . 352 MET H . 52667 1 1064 . 1 . 1 352 352 MET C C 13 174.916 0.014 . 1 . . . . . 352 MET C . 52667 1 1065 . 1 . 1 352 352 MET CA C 13 54.752 0.035 . 1 . . . . . 352 MET CA . 52667 1 1066 . 1 . 1 352 352 MET CB C 13 31.616 0.059 . 1 . . . . . 352 MET CB . 52667 1 1067 . 1 . 1 352 352 MET N N 15 121.58 0.022 . 1 . . . . . 352 MET N . 52667 1 1068 . 1 . 1 353 353 LEU H H 1 8.822 0.003 . 1 . . . . . 353 LEU H . 52667 1 1069 . 1 . 1 353 353 LEU C C 13 172.929 0.009 . 1 . . . . . 353 LEU C . 52667 1 1070 . 1 . 1 353 353 LEU CA C 13 53.175 0.018 . 1 . . . . . 353 LEU CA . 52667 1 1071 . 1 . 1 353 353 LEU CB C 13 46.557 0.02 . 1 . . . . . 353 LEU CB . 52667 1 1072 . 1 . 1 353 353 LEU N N 15 128.389 0.007 . 1 . . . . . 353 LEU N . 52667 1 1073 . 1 . 1 354 354 ASP H H 1 8.208 0.002 . 1 . . . . . 354 ASP H . 52667 1 1074 . 1 . 1 354 354 ASP C C 13 178.229 0 . 1 . . . . . 354 ASP C . 52667 1 1075 . 1 . 1 354 354 ASP CA C 13 51.488 0 . 1 . . . . . 354 ASP CA . 52667 1 1076 . 1 . 1 354 354 ASP CB C 13 41.896 0 . 1 . . . . . 354 ASP CB . 52667 1 1077 . 1 . 1 354 354 ASP N N 15 125.154 0.011 . 1 . . . . . 354 ASP N . 52667 1 1078 . 1 . 1 355 355 MET C C 13 177.69 0.027 . 1 . . . . . 355 MET C . 52667 1 1079 . 1 . 1 355 355 MET CA C 13 52.985 0.003 . 1 . . . . . 355 MET CA . 52667 1 1080 . 1 . 1 355 355 MET CB C 13 31.239 0 . 1 . . . . . 355 MET CB . 52667 1 1081 . 1 . 1 356 356 TYR H H 1 8.23 0.002 . 1 . . . . . 356 TYR H . 52667 1 1082 . 1 . 1 356 356 TYR C C 13 178.229 0.002 . 1 . . . . . 356 TYR C . 52667 1 1083 . 1 . 1 356 356 TYR CA C 13 63.495 0.015 . 1 . . . . . 356 TYR CA . 52667 1 1084 . 1 . 1 356 356 TYR CB C 13 39.189 0.022 . 1 . . . . . 356 TYR CB . 52667 1 1085 . 1 . 1 356 356 TYR N N 15 123.085 0.018 . 1 . . . . . 356 TYR N . 52667 1 1086 . 1 . 1 357 357 GLU H H 1 9.525 0.002 . 1 . . . . . 357 GLU H . 52667 1 1087 . 1 . 1 357 357 GLU C C 13 177.012 0.018 . 1 . . . . . 357 GLU C . 52667 1 1088 . 1 . 1 357 357 GLU CA C 13 58.221 0.016 . 1 . . . . . 357 GLU CA . 52667 1 1089 . 1 . 1 357 357 GLU CB C 13 29.212 0.013 . 1 . . . . . 357 GLU CB . 52667 1 1090 . 1 . 1 357 357 GLU N N 15 115.411 0.019 . 1 . . . . . 357 GLU N . 52667 1 1091 . 1 . 1 358 358 LEU H H 1 7.813 0.005 . 1 . . . . . 358 LEU H . 52667 1 1092 . 1 . 1 358 358 LEU C C 13 176.109 0.048 . 1 . . . . . 358 LEU C . 52667 1 1093 . 1 . 1 358 358 LEU CA C 13 53.946 0.055 . 1 . . . . . 358 LEU CA . 52667 1 1094 . 1 . 1 358 358 LEU CB C 13 40.3 0 . 1 . . . . . 358 LEU CB . 52667 1 1095 . 1 . 1 358 358 LEU N N 15 116.898 0.016 . 1 . . . . . 358 LEU N . 52667 1 1096 . 1 . 1 359 359 CYS H H 1 7.064 0.004 . 1 . . . . . 359 CYS H . 52667 1 1097 . 1 . 1 359 359 CYS C C 13 174.213 0.003 . 1 . . . . . 359 CYS C . 52667 1 1098 . 1 . 1 359 359 CYS CA C 13 58.415 0.013 . 1 . . . . . 359 CYS CA . 52667 1 1099 . 1 . 1 359 359 CYS CB C 13 29.217 0.021 . 1 . . . . . 359 CYS CB . 52667 1 1100 . 1 . 1 359 359 CYS N N 15 116.906 0.018 . 1 . . . . . 359 CYS N . 52667 1 1101 . 1 . 1 360 360 THR H H 1 8.394 0.002 . 1 . . . . . 360 THR H . 52667 1 1102 . 1 . 1 360 360 THR C C 13 172.824 0 . 1 . . . . . 360 THR C . 52667 1 1103 . 1 . 1 360 360 THR CA C 13 59.594 0.015 . 1 . . . . . 360 THR CA . 52667 1 1104 . 1 . 1 360 360 THR CB C 13 67.393 0 . 1 . . . . . 360 THR CB . 52667 1 1105 . 1 . 1 360 360 THR N N 15 112.204 0.005 . 1 . . . . . 360 THR N . 52667 1 1106 . 1 . 1 361 361 PRO C C 13 179.221 0 . 1 . . . . . 361 PRO C . 52667 1 1107 . 1 . 1 361 361 PRO CA C 13 64.525 0.005 . 1 . . . . . 361 PRO CA . 52667 1 1108 . 1 . 1 361 361 PRO CB C 13 30.499 0 . 1 . . . . . 361 PRO CB . 52667 1 1109 . 1 . 1 362 362 GLU H H 1 8.355 0.002 . 1 . . . . . 362 GLU H . 52667 1 1110 . 1 . 1 362 362 GLU C C 13 179.059 0.001 . 1 . . . . . 362 GLU C . 52667 1 1111 . 1 . 1 362 362 GLU CA C 13 59.741 0.02 . 1 . . . . . 362 GLU CA . 52667 1 1112 . 1 . 1 362 362 GLU CB C 13 27.918 0.013 . 1 . . . . . 362 GLU CB . 52667 1 1113 . 1 . 1 362 362 GLU N N 15 116.213 0.02 . 1 . . . . . 362 GLU N . 52667 1 1114 . 1 . 1 363 363 LEU H H 1 7.605 0.002 . 1 . . . . . 363 LEU H . 52667 1 1115 . 1 . 1 363 363 LEU CA C 13 57.034 0.002 . 1 . . . . . 363 LEU CA . 52667 1 1116 . 1 . 1 363 363 LEU CB C 13 40.311 0 . 1 . . . . . 363 LEU CB . 52667 1 1117 . 1 . 1 363 363 LEU N N 15 123.108 0.013 . 1 . . . . . 363 LEU N . 52667 1 1118 . 1 . 1 364 364 GLN C C 13 179.037 0 . 1 . . . . . 364 GLN C . 52667 1 1119 . 1 . 1 364 364 GLN CA C 13 59.337 0.06 . 1 . . . . . 364 GLN CA . 52667 1 1120 . 1 . 1 364 364 GLN CB C 13 26.214 0 . 1 . . . . . 364 GLN CB . 52667 1 1121 . 1 . 1 365 365 GLU H H 1 7.876 0.006 . 1 . . . . . 365 GLU H . 52667 1 1122 . 1 . 1 365 365 GLU C C 13 179.325 0.011 . 1 . . . . . 365 GLU C . 52667 1 1123 . 1 . 1 365 365 GLU CA C 13 58.829 0.039 . 1 . . . . . 365 GLU CA . 52667 1 1124 . 1 . 1 365 365 GLU CB C 13 28.655 0.006 . 1 . . . . . 365 GLU CB . 52667 1 1125 . 1 . 1 365 365 GLU N N 15 116.768 0.025 . 1 . . . . . 365 GLU N . 52667 1 1126 . 1 . 1 366 366 LYS H H 1 7.492 0.002 . 1 . . . . . 366 LYS H . 52667 1 1127 . 1 . 1 366 366 LYS C C 13 178.921 0.014 . 1 . . . . . 366 LYS C . 52667 1 1128 . 1 . 1 366 366 LYS CA C 13 58.663 0.018 . 1 . . . . . 366 LYS CA . 52667 1 1129 . 1 . 1 366 366 LYS CB C 13 32.772 0.013 . 1 . . . . . 366 LYS CB . 52667 1 1130 . 1 . 1 366 366 LYS N N 15 119.848 0.013 . 1 . . . . . 366 LYS N . 52667 1 1131 . 1 . 1 367 367 MET H H 1 7.927 0.002 . 1 . . . . . 367 MET H . 52667 1 1132 . 1 . 1 367 367 MET C C 13 178.75 0.029 . 1 . . . . . 367 MET C . 52667 1 1133 . 1 . 1 367 367 MET CA C 13 57.547 0.046 . 1 . . . . . 367 MET CA . 52667 1 1134 . 1 . 1 367 367 MET CB C 13 34.757 0.023 . 1 . . . . . 367 MET CB . 52667 1 1135 . 1 . 1 367 367 MET N N 15 114.717 0.035 . 1 . . . . . 367 MET N . 52667 1 1136 . 1 . 1 368 368 VAL H H 1 7.619 0.003 . 1 . . . . . 368 VAL H . 52667 1 1137 . 1 . 1 368 368 VAL CA C 13 67.934 0.012 . 1 . . . . . 368 VAL CA . 52667 1 1138 . 1 . 1 368 368 VAL CB C 13 31.078 0 . 1 . . . . . 368 VAL CB . 52667 1 1139 . 1 . 1 368 368 VAL N N 15 119.708 0.028 . 1 . . . . . 368 VAL N . 52667 1 1140 . 1 . 1 369 369 SER C C 13 176.655 0 . 1 . . . . . 369 SER C . 52667 1 1141 . 1 . 1 369 369 SER CA C 13 61.33 0.047 . 1 . . . . . 369 SER CA . 52667 1 1142 . 1 . 1 370 370 PHE H H 1 7.22 0.005 . 1 . . . . . 370 PHE H . 52667 1 1143 . 1 . 1 370 370 PHE C C 13 178.951 0.012 . 1 . . . . . 370 PHE C . 52667 1 1144 . 1 . 1 370 370 PHE CA C 13 60.903 0.059 . 1 . . . . . 370 PHE CA . 52667 1 1145 . 1 . 1 370 370 PHE CB C 13 38.436 0.008 . 1 . . . . . 370 PHE CB . 52667 1 1146 . 1 . 1 370 370 PHE N N 15 121.531 0.018 . 1 . . . . . 370 PHE N . 52667 1 1147 . 1 . 1 371 371 ARG H H 1 8.457 0.003 . 1 . . . . . 371 ARG H . 52667 1 1148 . 1 . 1 371 371 ARG C C 13 179.781 0.003 . 1 . . . . . 371 ARG C . 52667 1 1149 . 1 . 1 371 371 ARG CA C 13 59.913 0.016 . 1 . . . . . 371 ARG CA . 52667 1 1150 . 1 . 1 371 371 ARG CB C 13 29.891 0.013 . 1 . . . . . 371 ARG CB . 52667 1 1151 . 1 . 1 371 371 ARG N N 15 119.602 0.021 . 1 . . . . . 371 ARG N . 52667 1 1152 . 1 . 1 372 372 SER H H 1 8.061 0.002 . 1 . . . . . 372 SER H . 52667 1 1153 . 1 . 1 372 372 SER C C 13 175.502 0 . 1 . . . . . 372 SER C . 52667 1 1154 . 1 . 1 372 372 SER CA C 13 60.947 0.104 . 1 . . . . . 372 SER CA . 52667 1 1155 . 1 . 1 372 372 SER CB C 13 62.195 0.008 . 1 . . . . . 372 SER CB . 52667 1 1156 . 1 . 1 372 372 SER N N 15 116.051 0.029 . 1 . . . . . 372 SER N . 52667 1 1157 . 1 . 1 373 373 LYS H H 1 7.298 0.004 . 1 . . . . . 373 LYS H . 52667 1 1158 . 1 . 1 373 373 LYS C C 13 177.712 0.022 . 1 . . . . . 373 LYS C . 52667 1 1159 . 1 . 1 373 373 LYS CA C 13 57.65 0.006 . 1 . . . . . 373 LYS CA . 52667 1 1160 . 1 . 1 373 373 LYS CB C 13 31.244 0.027 . 1 . . . . . 373 LYS CB . 52667 1 1161 . 1 . 1 373 373 LYS N N 15 119.583 0.02 . 1 . . . . . 373 LYS N . 52667 1 1162 . 1 . 1 374 374 PHE H H 1 7.526 0.002 . 1 . . . . . 374 PHE H . 52667 1 1163 . 1 . 1 374 374 PHE C C 13 176.894 0.024 . 1 . . . . . 374 PHE C . 52667 1 1164 . 1 . 1 374 374 PHE CA C 13 59.68 0.017 . 1 . . . . . 374 PHE CA . 52667 1 1165 . 1 . 1 374 374 PHE CB C 13 38.114 0.004 . 1 . . . . . 374 PHE CB . 52667 1 1166 . 1 . 1 374 374 PHE N N 15 116.741 0.015 . 1 . . . . . 374 PHE N . 52667 1 1167 . 1 . 1 375 375 LYS H H 1 7.662 0.002 . 1 . . . . . 375 LYS H . 52667 1 1168 . 1 . 1 375 375 LYS C C 13 177.341 0.022 . 1 . . . . . 375 LYS C . 52667 1 1169 . 1 . 1 375 375 LYS CA C 13 57.31 0.002 . 1 . . . . . 375 LYS CA . 52667 1 1170 . 1 . 1 375 375 LYS CB C 13 31.552 0.001 . 1 . . . . . 375 LYS CB . 52667 1 1171 . 1 . 1 375 375 LYS N N 15 121.78 0.008 . 1 . . . . . 375 LYS N . 52667 1 1172 . 1 . 1 376 376 ASP H H 1 8.133 0.004 . 1 . . . . . 376 ASP H . 52667 1 1173 . 1 . 1 376 376 ASP C C 13 177.403 0.009 . 1 . . . . . 376 ASP C . 52667 1 1174 . 1 . 1 376 376 ASP CA C 13 55.545 0.013 . 1 . . . . . 376 ASP CA . 52667 1 1175 . 1 . 1 376 376 ASP CB C 13 40.081 0.01 . 1 . . . . . 376 ASP CB . 52667 1 1176 . 1 . 1 376 376 ASP N N 15 120.123 0.008 . 1 . . . . . 376 ASP N . 52667 1 1177 . 1 . 1 377 377 LEU H H 1 7.737 0.004 . 1 . . . . . 377 LEU H . 52667 1 1178 . 1 . 1 377 377 LEU C C 13 178.505 0.006 . 1 . . . . . 377 LEU C . 52667 1 1179 . 1 . 1 377 377 LEU CA C 13 56.089 0.006 . 1 . . . . . 377 LEU CA . 52667 1 1180 . 1 . 1 377 377 LEU CB C 13 41.075 0.004 . 1 . . . . . 377 LEU CB . 52667 1 1181 . 1 . 1 377 377 LEU N N 15 120.696 0.005 . 1 . . . . . 377 LEU N . 52667 1 1182 . 1 . 1 378 378 GLU H H 1 8.039 0.001 . 1 . . . . . 378 GLU H . 52667 1 1183 . 1 . 1 378 378 GLU C C 13 177.65 0.013 . 1 . . . . . 378 GLU C . 52667 1 1184 . 1 . 1 378 378 GLU CA C 13 57.491 0.003 . 1 . . . . . 378 GLU CA . 52667 1 1185 . 1 . 1 378 378 GLU CB C 13 29.025 0.001 . 1 . . . . . 378 GLU CB . 52667 1 1186 . 1 . 1 378 378 GLU N N 15 120.491 0.008 . 1 . . . . . 378 GLU N . 52667 1 1187 . 1 . 1 379 379 ASP H H 1 8.154 0.004 . 1 . . . . . 379 ASP H . 52667 1 1188 . 1 . 1 379 379 ASP C C 13 177.118 0.007 . 1 . . . . . 379 ASP C . 52667 1 1189 . 1 . 1 379 379 ASP CA C 13 55.068 0.014 . 1 . . . . . 379 ASP CA . 52667 1 1190 . 1 . 1 379 379 ASP CB C 13 40.227 0 . 1 . . . . . 379 ASP CB . 52667 1 1191 . 1 . 1 379 379 ASP N N 15 120.481 0.021 . 1 . . . . . 379 ASP N . 52667 1 1192 . 1 . 1 380 380 LYS H H 1 7.87 0.002 . 1 . . . . . 380 LYS H . 52667 1 1193 . 1 . 1 380 380 LYS C C 13 177.278 0.013 . 1 . . . . . 380 LYS C . 52667 1 1194 . 1 . 1 380 380 LYS CA C 13 56.694 0.017 . 1 . . . . . 380 LYS CA . 52667 1 1195 . 1 . 1 380 380 LYS CB C 13 31.746 0.004 . 1 . . . . . 380 LYS CB . 52667 1 1196 . 1 . 1 380 380 LYS N N 15 120.684 0.008 . 1 . . . . . 380 LYS N . 52667 1 1197 . 1 . 1 381 381 LYS H H 1 8.006 0.006 . 1 . . . . . 381 LYS H . 52667 1 1198 . 1 . 1 381 381 LYS C C 13 177.35 0.007 . 1 . . . . . 381 LYS C . 52667 1 1199 . 1 . 1 381 381 LYS CA C 13 56.68 0.012 . 1 . . . . . 381 LYS CA . 52667 1 1200 . 1 . 1 381 381 LYS CB C 13 31.613 0.019 . 1 . . . . . 381 LYS CB . 52667 1 1201 . 1 . 1 381 381 LYS N N 15 121.096 0.012 . 1 . . . . . 381 LYS N . 52667 1 1202 . 1 . 1 382 382 VAL H H 1 7.836 0.001 . 1 . . . . . 382 VAL H . 52667 1 1203 . 1 . 1 382 382 VAL C C 13 176.256 0 . 1 . . . . . 382 VAL C . 52667 1 1204 . 1 . 1 382 382 VAL CA C 13 62.5 0.005 . 1 . . . . . 382 VAL CA . 52667 1 1205 . 1 . 1 382 382 VAL N N 15 119.607 0.019 . 1 . . . . . 382 VAL N . 52667 1 1206 . 1 . 1 384 384 GLN C C 13 175.724 0 . 1 . . . . . 384 GLN C . 52667 1 1207 . 1 . 1 384 384 GLN CA C 13 55.374 0.01 . 1 . . . . . 384 GLN CA . 52667 1 1208 . 1 . 1 384 384 GLN CB C 13 28.685 0.039 . 1 . . . . . 384 GLN CB . 52667 1 1209 . 1 . 1 385 385 GLN H H 1 8.34 0.004 . 1 . . . . . 385 GLN H . 52667 1 1210 . 1 . 1 385 385 GLN C C 13 174.21 0 . 1 . . . . . 385 GLN C . 52667 1 1211 . 1 . 1 385 385 GLN CA C 13 53.405 0.002 . 1 . . . . . 385 GLN CA . 52667 1 1212 . 1 . 1 385 385 GLN CB C 13 27.996 0 . 1 . . . . . 385 GLN CB . 52667 1 1213 . 1 . 1 385 385 GLN N N 15 123.027 0.028 . 1 . . . . . 385 GLN N . 52667 1 1214 . 1 . 1 390 390 ASP C C 13 176.28 0 . 1 . . . . . 390 ASP C . 52667 1 1215 . 1 . 1 390 390 ASP CA C 13 54.031 0.006 . 1 . . . . . 390 ASP CA . 52667 1 1216 . 1 . 1 390 390 ASP CB C 13 40.317 0.009 . 1 . . . . . 390 ASP CB . 52667 1 1217 . 1 . 1 391 391 LYS H H 1 8.073 0.002 . 1 . . . . . 391 LYS H . 52667 1 1218 . 1 . 1 391 391 LYS C C 13 176.781 0.043 . 1 . . . . . 391 LYS C . 52667 1 1219 . 1 . 1 391 391 LYS CA C 13 55.938 0.018 . 1 . . . . . 391 LYS CA . 52667 1 1220 . 1 . 1 391 391 LYS CB C 13 31.746 0 . 1 . . . . . 391 LYS CB . 52667 1 1221 . 1 . 1 391 391 LYS N N 15 121.75 0.017 . 1 . . . . . 391 LYS N . 52667 1 1222 . 1 . 1 392 392 LYS H H 1 8.216 0.002 . 1 . . . . . 392 LYS H . 52667 1 1223 . 1 . 1 392 392 LYS CA C 13 55.938 0.011 . 1 . . . . . 392 LYS CA . 52667 1 1224 . 1 . 1 392 392 LYS CB C 13 31.933 0 . 1 . . . . . 392 LYS CB . 52667 1 1225 . 1 . 1 392 392 LYS N N 15 122.423 0 . 1 . . . . . 392 LYS N . 52667 1 1226 . 1 . 1 395 395 PRO C C 13 176.954 0.017 . 1 . . . . . 395 PRO C . 52667 1 1227 . 1 . 1 395 395 PRO CA C 13 63.02 0.014 . 1 . . . . . 395 PRO CA . 52667 1 1228 . 1 . 1 396 396 GLN H H 1 8.344 0.004 . 1 . . . . . 396 GLN H . 52667 1 1229 . 1 . 1 396 396 GLN C C 13 175.818 0.028 . 1 . . . . . 396 GLN C . 52667 1 1230 . 1 . 1 396 396 GLN CA C 13 55.43 0.016 . 1 . . . . . 396 GLN CA . 52667 1 1231 . 1 . 1 396 396 GLN CB C 13 28.574 0.274 . 1 . . . . . 396 GLN CB . 52667 1 1232 . 1 . 1 396 396 GLN N N 15 120.811 0.012 . 1 . . . . . 396 GLN N . 52667 1 1233 . 1 . 1 397 397 LYS H H 1 8.049 0.001 . 1 . . . . . 397 LYS H . 52667 1 1234 . 1 . 1 397 397 LYS C C 13 176.047 0.001 . 1 . . . . . 397 LYS C . 52667 1 1235 . 1 . 1 397 397 LYS CA C 13 55.652 0.023 . 1 . . . . . 397 LYS CA . 52667 1 1236 . 1 . 1 397 397 LYS CB C 13 32.543 0.007 . 1 . . . . . 397 LYS CB . 52667 1 1237 . 1 . 1 397 397 LYS N N 15 123.063 0.037 . 1 . . . . . 397 LYS N . 52667 1 1238 . 1 . 1 398 398 GLU H H 1 8.304 0.001 . 1 . . . . . 398 GLU H . 52667 1 1239 . 1 . 1 398 398 GLU C C 13 175.822 0.006 . 1 . . . . . 398 GLU C . 52667 1 1240 . 1 . 1 398 398 GLU CA C 13 55.722 0.019 . 1 . . . . . 398 GLU CA . 52667 1 1241 . 1 . 1 398 398 GLU CB C 13 29.419 0 . 1 . . . . . 398 GLU CB . 52667 1 1242 . 1 . 1 398 398 GLU N N 15 123.284 0.018 . 1 . . . . . 398 GLU N . 52667 1 1243 . 1 . 1 399 399 VAL H H 1 8.097 0.001 . 1 . . . . . 399 VAL H . 52667 1 1244 . 1 . 1 399 399 VAL C C 13 174.779 0.003 . 1 . . . . . 399 VAL C . 52667 1 1245 . 1 . 1 399 399 VAL CA C 13 61.917 0.02 . 1 . . . . . 399 VAL CA . 52667 1 1246 . 1 . 1 399 399 VAL CB C 13 31.801 0.011 . 1 . . . . . 399 VAL CB . 52667 1 1247 . 1 . 1 399 399 VAL N N 15 124.964 0.013 . 1 . . . . . 399 VAL N . 52667 1 1248 . 1 . 1 400 400 LYS H H 1 8.281 0.002 . 1 . . . . . 400 LYS H . 52667 1 1249 . 1 . 1 400 400 LYS C C 13 174.781 0 . 1 . . . . . 400 LYS C . 52667 1 1250 . 1 . 1 400 400 LYS CA C 13 54.322 0.003 . 1 . . . . . 400 LYS CA . 52667 1 1251 . 1 . 1 400 400 LYS CB C 13 33.789 0.004 . 1 . . . . . 400 LYS CB . 52667 1 1252 . 1 . 1 400 400 LYS N N 15 126.474 0.011 . 1 . . . . . 400 LYS N . 52667 1 1253 . 1 . 1 401 401 TYR H H 1 8.341 0.003 . 1 . . . . . 401 TYR H . 52667 1 1254 . 1 . 1 401 401 TYR C C 13 176.992 0.002 . 1 . . . . . 401 TYR C . 52667 1 1255 . 1 . 1 401 401 TYR CA C 13 56.155 0.006 . 1 . . . . . 401 TYR CA . 52667 1 1256 . 1 . 1 401 401 TYR CB C 13 40.908 0.002 . 1 . . . . . 401 TYR CB . 52667 1 1257 . 1 . 1 401 401 TYR N N 15 119.298 0.01 . 1 . . . . . 401 TYR N . 52667 1 1258 . 1 . 1 402 402 GLU H H 1 8.662 0.002 . 1 . . . . . 402 GLU H . 52667 1 1259 . 1 . 1 402 402 GLU C C 13 175.919 0 . 1 . . . . . 402 GLU C . 52667 1 1260 . 1 . 1 402 402 GLU CA C 13 54.772 0.005 . 1 . . . . . 402 GLU CA . 52667 1 1261 . 1 . 1 402 402 GLU CB C 13 28.317 0 . 1 . . . . . 402 GLU CB . 52667 1 1262 . 1 . 1 402 402 GLU N N 15 121.657 0.009 . 1 . . . . . 402 GLU N . 52667 1 1263 . 1 . 1 403 403 PRO C C 13 176.577 0 . 1 . . . . . 403 PRO C . 52667 1 1264 . 1 . 1 403 403 PRO CA C 13 63.417 0.008 . 1 . . . . . 403 PRO CA . 52667 1 1265 . 1 . 1 403 403 PRO CB C 13 31.362 0 . 1 . . . . . 403 PRO CB . 52667 1 1266 . 1 . 1 404 404 PHE H H 1 7.369 0.003 . 1 . . . . . 404 PHE H . 52667 1 1267 . 1 . 1 404 404 PHE C C 13 174.336 0.009 . 1 . . . . . 404 PHE C . 52667 1 1268 . 1 . 1 404 404 PHE CA C 13 55.87 0.01 . 1 . . . . . 404 PHE CA . 52667 1 1269 . 1 . 1 404 404 PHE CB C 13 39.272 0.019 . 1 . . . . . 404 PHE CB . 52667 1 1270 . 1 . 1 404 404 PHE N N 15 117.096 0.037 . 1 . . . . . 404 PHE N . 52667 1 1271 . 1 . 1 405 405 SER H H 1 6.76 0.003 . 1 . . . . . 405 SER H . 52667 1 1272 . 1 . 1 405 405 SER C C 13 176.135 0.016 . 1 . . . . . 405 SER C . 52667 1 1273 . 1 . 1 405 405 SER CA C 13 55.942 0.038 . 1 . . . . . 405 SER CA . 52667 1 1274 . 1 . 1 405 405 SER CB C 13 64.657 0.025 . 1 . . . . . 405 SER CB . 52667 1 1275 . 1 . 1 405 405 SER N N 15 116.584 0.015 . 1 . . . . . 405 SER N . 52667 1 1276 . 1 . 1 406 406 PHE H H 1 7.532 0.003 . 1 . . . . . 406 PHE H . 52667 1 1277 . 1 . 1 406 406 PHE C C 13 178.133 0 . 1 . . . . . 406 PHE C . 52667 1 1278 . 1 . 1 406 406 PHE CA C 13 58.177 0.02 . 1 . . . . . 406 PHE CA . 52667 1 1279 . 1 . 1 406 406 PHE CB C 13 38.954 0 . 1 . . . . . 406 PHE CB . 52667 1 1280 . 1 . 1 406 406 PHE N N 15 122.778 0.037 . 1 . . . . . 406 PHE N . 52667 1 1281 . 1 . 1 407 407 ALA C C 13 177.733 0 . 1 . . . . . 407 ALA C . 52667 1 1282 . 1 . 1 407 407 ALA CA C 13 54.253 0.056 . 1 . . . . . 407 ALA CA . 52667 1 1283 . 1 . 1 407 407 ALA CB C 13 17.447 0 . 1 . . . . . 407 ALA CB . 52667 1 1284 . 1 . 1 408 408 ASP H H 1 7.958 0.004 . 1 . . . . . 408 ASP H . 52667 1 1285 . 1 . 1 408 408 ASP C C 13 175.423 0.017 . 1 . . . . . 408 ASP C . 52667 1 1286 . 1 . 1 408 408 ASP CA C 13 51.959 0.03 . 1 . . . . . 408 ASP CA . 52667 1 1287 . 1 . 1 408 408 ASP CB C 13 39.544 0.014 . 1 . . . . . 408 ASP CB . 52667 1 1288 . 1 . 1 408 408 ASP N N 15 111.712 0.031 . 1 . . . . . 408 ASP N . 52667 1 1289 . 1 . 1 409 409 ASP H H 1 7.102 0.003 . 1 . . . . . 409 ASP H . 52667 1 1290 . 1 . 1 409 409 ASP C C 13 175.3 0.005 . 1 . . . . . 409 ASP C . 52667 1 1291 . 1 . 1 409 409 ASP CA C 13 52.502 0.048 . 1 . . . . . 409 ASP CA . 52667 1 1292 . 1 . 1 409 409 ASP CB C 13 39.575 0.03 . 1 . . . . . 409 ASP CB . 52667 1 1293 . 1 . 1 409 409 ASP N N 15 118.206 0.022 . 1 . . . . . 409 ASP N . 52667 1 1294 . 1 . 1 410 410 ILE H H 1 8.774 0.002 . 1 . . . . . 410 ILE H . 52667 1 1295 . 1 . 1 410 410 ILE C C 13 176.575 0.025 . 1 . . . . . 410 ILE C . 52667 1 1296 . 1 . 1 410 410 ILE CA C 13 63.468 0.022 . 1 . . . . . 410 ILE CA . 52667 1 1297 . 1 . 1 410 410 ILE CB C 13 37.099 0.001 . 1 . . . . . 410 ILE CB . 52667 1 1298 . 1 . 1 410 410 ILE N N 15 130.222 0.009 . 1 . . . . . 410 ILE N . 52667 1 1299 . 1 . 1 411 411 GLY H H 1 7.741 0.002 . 1 . . . . . 411 GLY H . 52667 1 1300 . 1 . 1 411 411 GLY C C 13 171.764 0.024 . 1 . . . . . 411 GLY C . 52667 1 1301 . 1 . 1 411 411 GLY CA C 13 43.15 0.042 . 1 . . . . . 411 GLY CA . 52667 1 1302 . 1 . 1 411 411 GLY N N 15 113.107 0.028 . 1 . . . . . 411 GLY N . 52667 1 1303 . 1 . 1 412 412 SER H H 1 7.294 0.005 . 1 . . . . . 412 SER H . 52667 1 1304 . 1 . 1 412 412 SER C C 13 173.657 0 . 1 . . . . . 412 SER C . 52667 1 1305 . 1 . 1 412 412 SER CA C 13 57.479 0.01 . 1 . . . . . 412 SER CA . 52667 1 1306 . 1 . 1 412 412 SER CB C 13 65.984 0.013 . 1 . . . . . 412 SER CB . 52667 1 1307 . 1 . 1 412 412 SER N N 15 109.853 0.011 . 1 . . . . . 412 SER N . 52667 1 1308 . 1 . 1 413 413 ASN H H 1 7.082 0.004 . 1 . . . . . 413 ASN H . 52667 1 1309 . 1 . 1 413 413 ASN C C 13 174.966 0.016 . 1 . . . . . 413 ASN C . 52667 1 1310 . 1 . 1 413 413 ASN CA C 13 51.3 0.038 . 1 . . . . . 413 ASN CA . 52667 1 1311 . 1 . 1 413 413 ASN CB C 13 39.63 0.043 . 1 . . . . . 413 ASN CB . 52667 1 1312 . 1 . 1 413 413 ASN N N 15 116.541 0.021 . 1 . . . . . 413 ASN N . 52667 1 1313 . 1 . 1 414 414 ASN H H 1 8.037 0.002 . 1 . . . . . 414 ASN H . 52667 1 1314 . 1 . 1 414 414 ASN C C 13 173.793 0.017 . 1 . . . . . 414 ASN C . 52667 1 1315 . 1 . 1 414 414 ASN CA C 13 52.253 0.034 . 1 . . . . . 414 ASN CA . 52667 1 1316 . 1 . 1 414 414 ASN CB C 13 36.9 0 . 1 . . . . . 414 ASN CB . 52667 1 1317 . 1 . 1 414 414 ASN N N 15 119.62 0.028 . 1 . . . . . 414 ASN N . 52667 1 1318 . 1 . 1 415 415 CYS H H 1 7.81 0.004 . 1 . . . . . 415 CYS H . 52667 1 1319 . 1 . 1 415 415 CYS C C 13 173.975 0.002 . 1 . . . . . 415 CYS C . 52667 1 1320 . 1 . 1 415 415 CYS CA C 13 56.039 0.027 . 1 . . . . . 415 CYS CA . 52667 1 1321 . 1 . 1 415 415 CYS CB C 13 29.955 0.01 . 1 . . . . . 415 CYS CB . 52667 1 1322 . 1 . 1 415 415 CYS N N 15 106.664 0.024 . 1 . . . . . 415 CYS N . 52667 1 1323 . 1 . 1 416 416 GLY H H 1 7.468 0.005 . 1 . . . . . 416 GLY H . 52667 1 1324 . 1 . 1 416 416 GLY C C 13 170.036 0.015 . 1 . . . . . 416 GLY C . 52667 1 1325 . 1 . 1 416 416 GLY CA C 13 45.595 0.03 . 1 . . . . . 416 GLY CA . 52667 1 1326 . 1 . 1 416 416 GLY N N 15 110.92 0.036 . 1 . . . . . 416 GLY N . 52667 1 1327 . 1 . 1 417 417 TYR H H 1 7.288 0.005 . 1 . . . . . 417 TYR H . 52667 1 1328 . 1 . 1 417 417 TYR C C 13 175.881 0.009 . 1 . . . . . 417 TYR C . 52667 1 1329 . 1 . 1 417 417 TYR CA C 13 55.195 0.042 . 1 . . . . . 417 TYR CA . 52667 1 1330 . 1 . 1 417 417 TYR CB C 13 40.231 0.061 . 1 . . . . . 417 TYR CB . 52667 1 1331 . 1 . 1 417 417 TYR N N 15 116.117 0.02 . 1 . . . . . 417 TYR N . 52667 1 1332 . 1 . 1 418 418 TYR H H 1 9.109 0.002 . 1 . . . . . 418 TYR H . 52667 1 1333 . 1 . 1 418 418 TYR CA C 13 56.686 0.008 . 1 . . . . . 418 TYR CA . 52667 1 1334 . 1 . 1 418 418 TYR CB C 13 42.973 0 . 1 . . . . . 418 TYR CB . 52667 1 1335 . 1 . 1 418 418 TYR N N 15 120.515 0.011 . 1 . . . . . 418 TYR N . 52667 1 1336 . 1 . 1 422 422 ALA C C 13 174.814 0.001 . 1 . . . . . 422 ALA C . 52667 1 1337 . 1 . 1 422 422 ALA CA C 13 51.744 0.033 . 1 . . . . . 422 ALA CA . 52667 1 1338 . 1 . 1 422 422 ALA CB C 13 21.458 0 . 1 . . . . . 422 ALA CB . 52667 1 1339 . 1 . 1 423 423 VAL H H 1 9.906 0.007 . 1 . . . . . 423 VAL H . 52667 1 1340 . 1 . 1 423 423 VAL CA C 13 60.427 0.008 . 1 . . . . . 423 VAL CA . 52667 1 1341 . 1 . 1 423 423 VAL CB C 13 34.736 0 . 1 . . . . . 423 VAL CB . 52667 1 1342 . 1 . 1 423 423 VAL N N 15 119.818 0.004 . 1 . . . . . 423 VAL N . 52667 1 1343 . 1 . 1 424 424 LEU C C 13 178.254 0 . 1 . . . . . 424 LEU C . 52667 1 1344 . 1 . 1 424 424 LEU CA C 13 54.547 0.095 . 1 . . . . . 424 LEU CA . 52667 1 1345 . 1 . 1 424 424 LEU CB C 13 44.611 0.006 . 1 . . . . . 424 LEU CB . 52667 1 1346 . 1 . 1 425 425 THR H H 1 10.033 0.002 . 1 . . . . . 425 THR H . 52667 1 1347 . 1 . 1 425 425 THR C C 13 172.854 0.006 . 1 . . . . . 425 THR C . 52667 1 1348 . 1 . 1 425 425 THR CA C 13 59.621 0.024 . 1 . . . . . 425 THR CA . 52667 1 1349 . 1 . 1 425 425 THR CB C 13 71.345 0.016 . 1 . . . . . 425 THR CB . 52667 1 1350 . 1 . 1 425 425 THR N N 15 118.981 0.014 . 1 . . . . . 425 THR N . 52667 1 1351 . 1 . 1 426 426 HIS H H 1 8.573 0.002 . 1 . . . . . 426 HIS H . 52667 1 1352 . 1 . 1 426 426 HIS C C 13 174.336 0.005 . 1 . . . . . 426 HIS C . 52667 1 1353 . 1 . 1 426 426 HIS CA C 13 56.423 0.017 . 1 . . . . . 426 HIS CA . 52667 1 1354 . 1 . 1 426 426 HIS CB C 13 35.124 0 . 1 . . . . . 426 HIS CB . 52667 1 1355 . 1 . 1 426 426 HIS N N 15 117.847 0.04 . 1 . . . . . 426 HIS N . 52667 1 1356 . 1 . 1 427 427 GLN H H 1 7.938 0.004 . 1 . . . . . 427 GLN H . 52667 1 1357 . 1 . 1 427 427 GLN CA C 13 53.849 0.003 . 1 . . . . . 427 GLN CA . 52667 1 1358 . 1 . 1 427 427 GLN CB C 13 29.511 0 . 1 . . . . . 427 GLN CB . 52667 1 1359 . 1 . 1 427 427 GLN N N 15 131.609 0.03 . 1 . . . . . 427 GLN N . 52667 1 1360 . 1 . 1 432 432 SER C C 13 175.415 0.004 . 1 . . . . . 432 SER C . 52667 1 1361 . 1 . 1 432 432 SER CA C 13 57.293 0.001 . 1 . . . . . 432 SER CA . 52667 1 1362 . 1 . 1 433 433 SER H H 1 8.366 0.001 . 1 . . . . . 433 SER H . 52667 1 1363 . 1 . 1 433 433 SER C C 13 173.025 0 . 1 . . . . . 433 SER C . 52667 1 1364 . 1 . 1 433 433 SER CA C 13 55.302 0 . 1 . . . . . 433 SER CA . 52667 1 1365 . 1 . 1 433 433 SER N N 15 126.609 0 . 1 . . . . . 433 SER N . 52667 1 1366 . 1 . 1 434 434 GLY H H 1 8.522 0.001 . 1 . . . . . 434 GLY H . 52667 1 1367 . 1 . 1 434 434 GLY C C 13 174.318 0 . 1 . . . . . 434 GLY C . 52667 1 1368 . 1 . 1 434 434 GLY CA C 13 45.677 0.045 . 1 . . . . . 434 GLY CA . 52667 1 1369 . 1 . 1 434 434 GLY N N 15 107.49 0.015 . 1 . . . . . 434 GLY N . 52667 1 1370 . 1 . 1 435 435 HIS H H 1 8.051 0.001 . 1 . . . . . 435 HIS H . 52667 1 1371 . 1 . 1 435 435 HIS C C 13 172.92 0.013 . 1 . . . . . 435 HIS C . 52667 1 1372 . 1 . 1 435 435 HIS CA C 13 52.855 0.03 . 1 . . . . . 435 HIS CA . 52667 1 1373 . 1 . 1 435 435 HIS CB C 13 31.821 0.051 . 1 . . . . . 435 HIS CB . 52667 1 1374 . 1 . 1 435 435 HIS N N 15 118.321 0.018 . 1 . . . . . 435 HIS N . 52667 1 1375 . 1 . 1 436 436 TYR H H 1 10.054 0.003 . 1 . . . . . 436 TYR H . 52667 1 1376 . 1 . 1 436 436 TYR C C 13 174.089 0.018 . 1 . . . . . 436 TYR C . 52667 1 1377 . 1 . 1 436 436 TYR CA C 13 56.827 0.037 . 1 . . . . . 436 TYR CA . 52667 1 1378 . 1 . 1 436 436 TYR CB C 13 39.532 0.022 . 1 . . . . . 436 TYR CB . 52667 1 1379 . 1 . 1 436 436 TYR N N 15 131.871 0.017 . 1 . . . . . 436 TYR N . 52667 1 1380 . 1 . 1 437 437 VAL H H 1 7.914 0.003 . 1 . . . . . 437 VAL H . 52667 1 1381 . 1 . 1 437 437 VAL C C 13 173.294 0.034 . 1 . . . . . 437 VAL C . 52667 1 1382 . 1 . 1 437 437 VAL CA C 13 60.814 0.026 . 1 . . . . . 437 VAL CA . 52667 1 1383 . 1 . 1 437 437 VAL CB C 13 35.254 0.029 . 1 . . . . . 437 VAL CB . 52667 1 1384 . 1 . 1 437 437 VAL N N 15 121.065 0.042 . 1 . . . . . 437 VAL N . 52667 1 1385 . 1 . 1 438 438 SER H H 1 7.079 0.004 . 1 . . . . . 438 SER H . 52667 1 1386 . 1 . 1 438 438 SER C C 13 171.853 0.011 . 1 . . . . . 438 SER C . 52667 1 1387 . 1 . 1 438 438 SER CA C 13 56.306 0.008 . 1 . . . . . 438 SER CA . 52667 1 1388 . 1 . 1 438 438 SER CB C 13 65.636 0.001 . 1 . . . . . 438 SER CB . 52667 1 1389 . 1 . 1 438 438 SER N N 15 117.981 0.019 . 1 . . . . . 438 SER N . 52667 1 1390 . 1 . 1 439 439 TRP H H 1 9.235 0.002 . 1 . . . . . 439 TRP H . 52667 1 1391 . 1 . 1 439 439 TRP C C 13 176.926 0 . 1 . . . . . 439 TRP C . 52667 1 1392 . 1 . 1 439 439 TRP CA C 13 54.537 0.011 . 1 . . . . . 439 TRP CA . 52667 1 1393 . 1 . 1 439 439 TRP CB C 13 28.138 0.014 . 1 . . . . . 439 TRP CB . 52667 1 1394 . 1 . 1 439 439 TRP N N 15 127.636 0.021 . 1 . . . . . 439 TRP N . 52667 1 1395 . 1 . 1 440 440 VAL H H 1 9.885 0.005 . 1 . . . . . 440 VAL H . 52667 1 1396 . 1 . 1 440 440 VAL C C 13 174.575 0.015 . 1 . . . . . 440 VAL C . 52667 1 1397 . 1 . 1 440 440 VAL CA C 13 61.099 0.012 . 1 . . . . . 440 VAL CA . 52667 1 1398 . 1 . 1 440 440 VAL CB C 13 36.732 0.026 . 1 . . . . . 440 VAL CB . 52667 1 1399 . 1 . 1 440 440 VAL N N 15 125.024 0.024 . 1 . . . . . 440 VAL N . 52667 1 1400 . 1 . 1 441 441 LYS H H 1 7.953 0.002 . 1 . . . . . 441 LYS H . 52667 1 1401 . 1 . 1 441 441 LYS C C 13 175.817 0.027 . 1 . . . . . 441 LYS C . 52667 1 1402 . 1 . 1 441 441 LYS CA C 13 57.583 0.021 . 1 . . . . . 441 LYS CA . 52667 1 1403 . 1 . 1 441 441 LYS CB C 13 31.402 0.002 . 1 . . . . . 441 LYS CB . 52667 1 1404 . 1 . 1 441 441 LYS N N 15 132.717 0.033 . 1 . . . . . 441 LYS N . 52667 1 1405 . 1 . 1 442 442 ARG H H 1 8.668 0.005 . 1 . . . . . 442 ARG H . 52667 1 1406 . 1 . 1 442 442 ARG C C 13 175.211 0.018 . 1 . . . . . 442 ARG C . 52667 1 1407 . 1 . 1 442 442 ARG CA C 13 56.978 0.028 . 1 . . . . . 442 ARG CA . 52667 1 1408 . 1 . 1 442 442 ARG CB C 13 31.803 0.079 . 1 . . . . . 442 ARG CB . 52667 1 1409 . 1 . 1 442 442 ARG N N 15 128.338 0.012 . 1 . . . . . 442 ARG N . 52667 1 1410 . 1 . 1 443 443 LYS H H 1 8.313 0.001 . 1 . . . . . 443 LYS H . 52667 1 1411 . 1 . 1 443 443 LYS C C 13 175.463 0 . 1 . . . . . 443 LYS C . 52667 1 1412 . 1 . 1 443 443 LYS CA C 13 54.799 0.01 . 1 . . . . . 443 LYS CA . 52667 1 1413 . 1 . 1 443 443 LYS CB C 13 33.838 0 . 1 . . . . . 443 LYS CB . 52667 1 1414 . 1 . 1 443 443 LYS N N 15 117.585 0.006 . 1 . . . . . 443 LYS N . 52667 1 1415 . 1 . 1 444 444 GLN C C 13 175.874 0 . 1 . . . . . 444 GLN C . 52667 1 1416 . 1 . 1 444 444 GLN CA C 13 58.688 0.004 . 1 . . . . . 444 GLN CA . 52667 1 1417 . 1 . 1 444 444 GLN CB C 13 27.388 0 . 1 . . . . . 444 GLN CB . 52667 1 1418 . 1 . 1 445 445 ASP H H 1 8.271 0.002 . 1 . . . . . 445 ASP H . 52667 1 1419 . 1 . 1 445 445 ASP C C 13 175.243 0.018 . 1 . . . . . 445 ASP C . 52667 1 1420 . 1 . 1 445 445 ASP CA C 13 53.295 0.034 . 1 . . . . . 445 ASP CA . 52667 1 1421 . 1 . 1 445 445 ASP CB C 13 40.319 0.002 . 1 . . . . . 445 ASP CB . 52667 1 1422 . 1 . 1 445 445 ASP N N 15 114.926 0.012 . 1 . . . . . 445 ASP N . 52667 1 1423 . 1 . 1 446 446 GLU H H 1 7.831 0.002 . 1 . . . . . 446 GLU H . 52667 1 1424 . 1 . 1 446 446 GLU C C 13 173.386 0.003 . 1 . . . . . 446 GLU C . 52667 1 1425 . 1 . 1 446 446 GLU CA C 13 56.671 0.039 . 1 . . . . . 446 GLU CA . 52667 1 1426 . 1 . 1 446 446 GLU CB C 13 33.419 0.005 . 1 . . . . . 446 GLU CB . 52667 1 1427 . 1 . 1 446 446 GLU N N 15 119.514 0.043 . 1 . . . . . 446 GLU N . 52667 1 1428 . 1 . 1 447 447 TRP H H 1 8.571 0.002 . 1 . . . . . 447 TRP H . 52667 1 1429 . 1 . 1 447 447 TRP C C 13 173.279 0.008 . 1 . . . . . 447 TRP C . 52667 1 1430 . 1 . 1 447 447 TRP CA C 13 55.788 0.026 . 1 . . . . . 447 TRP CA . 52667 1 1431 . 1 . 1 447 447 TRP CB C 13 31.184 0.052 . 1 . . . . . 447 TRP CB . 52667 1 1432 . 1 . 1 447 447 TRP N N 15 127.341 0.024 . 1 . . . . . 447 TRP N . 52667 1 1433 . 1 . 1 448 448 ILE H H 1 9.74 0.058 . 1 . . . . . 448 ILE H . 52667 1 1434 . 1 . 1 448 448 ILE C C 13 174.773 0.003 . 1 . . . . . 448 ILE C . 52667 1 1435 . 1 . 1 448 448 ILE CA C 13 57.856 0.055 . 1 . . . . . 448 ILE CA . 52667 1 1436 . 1 . 1 448 448 ILE CB C 13 37.568 0.007 . 1 . . . . . 448 ILE CB . 52667 1 1437 . 1 . 1 448 448 ILE N N 15 122.729 0.027 . 1 . . . . . 448 ILE N . 52667 1 1438 . 1 . 1 449 449 LYS H H 1 8.947 0.004 . 1 . . . . . 449 LYS H . 52667 1 1439 . 1 . 1 449 449 LYS C C 13 174.142 0.009 . 1 . . . . . 449 LYS C . 52667 1 1440 . 1 . 1 449 449 LYS CA C 13 54.236 0.012 . 1 . . . . . 449 LYS CA . 52667 1 1441 . 1 . 1 449 449 LYS CB C 13 33.325 0.01 . 1 . . . . . 449 LYS CB . 52667 1 1442 . 1 . 1 449 449 LYS N N 15 128.371 0.02 . 1 . . . . . 449 LYS N . 52667 1 1443 . 1 . 1 450 450 PHE H H 1 9.112 0.004 . 1 . . . . . 450 PHE H . 52667 1 1444 . 1 . 1 450 450 PHE C C 13 175.01 0.014 . 1 . . . . . 450 PHE C . 52667 1 1445 . 1 . 1 450 450 PHE CA C 13 56.396 0.015 . 1 . . . . . 450 PHE CA . 52667 1 1446 . 1 . 1 450 450 PHE CB C 13 37.684 0.01 . 1 . . . . . 450 PHE CB . 52667 1 1447 . 1 . 1 450 450 PHE N N 15 126.169 0.012 . 1 . . . . . 450 PHE N . 52667 1 1448 . 1 . 1 451 451 ASP H H 1 8.329 0.003 . 1 . . . . . 451 ASP H . 52667 1 1449 . 1 . 1 451 451 ASP C C 13 176.024 0.024 . 1 . . . . . 451 ASP C . 52667 1 1450 . 1 . 1 451 451 ASP CA C 13 50.959 0.04 . 1 . . . . . 451 ASP CA . 52667 1 1451 . 1 . 1 451 451 ASP CB C 13 38.645 0.107 . 1 . . . . . 451 ASP CB . 52667 1 1452 . 1 . 1 451 451 ASP N N 15 127.783 0.022 . 1 . . . . . 451 ASP N . 52667 1 1453 . 1 . 1 452 452 ASP H H 1 7.562 0.001 . 1 . . . . . 452 ASP H . 52667 1 1454 . 1 . 1 452 452 ASP C C 13 175.769 0 . 1 . . . . . 452 ASP C . 52667 1 1455 . 1 . 1 452 452 ASP CA C 13 59.1 0.029 . 1 . . . . . 452 ASP CA . 52667 1 1456 . 1 . 1 452 452 ASP CB C 13 40.067 0.003 . 1 . . . . . 452 ASP CB . 52667 1 1457 . 1 . 1 452 452 ASP N N 15 116.16 0.015 . 1 . . . . . 452 ASP N . 52667 1 1458 . 1 . 1 453 453 ASP H H 1 9.024 0.002 . 1 . . . . . 453 ASP H . 52667 1 1459 . 1 . 1 453 453 ASP C C 13 174.875 0.029 . 1 . . . . . 453 ASP C . 52667 1 1460 . 1 . 1 453 453 ASP CA C 13 53.521 0.018 . 1 . . . . . 453 ASP CA . 52667 1 1461 . 1 . 1 453 453 ASP CB C 13 39.315 0.011 . 1 . . . . . 453 ASP CB . 52667 1 1462 . 1 . 1 453 453 ASP N N 15 122.527 0.014 . 1 . . . . . 453 ASP N . 52667 1 1463 . 1 . 1 454 454 LYS H H 1 8.377 0.002 . 1 . . . . . 454 LYS H . 52667 1 1464 . 1 . 1 454 454 LYS C C 13 174.901 0 . 1 . . . . . 454 LYS C . 52667 1 1465 . 1 . 1 454 454 LYS CA C 13 55.389 0.053 . 1 . . . . . 454 LYS CA . 52667 1 1466 . 1 . 1 454 454 LYS CB C 13 30.562 0.007 . 1 . . . . . 454 LYS CB . 52667 1 1467 . 1 . 1 454 454 LYS N N 15 124.283 0.042 . 1 . . . . . 454 LYS N . 52667 1 1468 . 1 . 1 455 455 VAL H H 1 8.244 0.002 . 1 . . . . . 455 VAL H . 52667 1 1469 . 1 . 1 455 455 VAL C C 13 175.196 0.007 . 1 . . . . . 455 VAL C . 52667 1 1470 . 1 . 1 455 455 VAL CA C 13 60.956 0.016 . 1 . . . . . 455 VAL CA . 52667 1 1471 . 1 . 1 455 455 VAL CB C 13 32.669 0.004 . 1 . . . . . 455 VAL CB . 52667 1 1472 . 1 . 1 455 455 VAL N N 15 129.681 0.014 . 1 . . . . . 455 VAL N . 52667 1 1473 . 1 . 1 456 456 SER H H 1 8.277 0.001 . 1 . . . . . 456 SER H . 52667 1 1474 . 1 . 1 456 456 SER C C 13 171.483 0.004 . 1 . . . . . 456 SER C . 52667 1 1475 . 1 . 1 456 456 SER CA C 13 56.435 0.017 . 1 . . . . . 456 SER CA . 52667 1 1476 . 1 . 1 456 456 SER CB C 13 65.013 0 . 1 . . . . . 456 SER CB . 52667 1 1477 . 1 . 1 456 456 SER N N 15 119.668 0.014 . 1 . . . . . 456 SER N . 52667 1 1478 . 1 . 1 457 457 ILE H H 1 8.327 0.004 . 1 . . . . . 457 ILE H . 52667 1 1479 . 1 . 1 457 457 ILE C C 13 176.938 0.008 . 1 . . . . . 457 ILE C . 52667 1 1480 . 1 . 1 457 457 ILE CA C 13 59.829 0.008 . 1 . . . . . 457 ILE CA . 52667 1 1481 . 1 . 1 457 457 ILE CB C 13 37.492 0.06 . 1 . . . . . 457 ILE CB . 52667 1 1482 . 1 . 1 457 457 ILE N N 15 120.834 0.019 . 1 . . . . . 457 ILE N . 52667 1 1483 . 1 . 1 458 458 VAL H H 1 9.433 0.003 . 1 . . . . . 458 VAL H . 52667 1 1484 . 1 . 1 458 458 VAL C C 13 174.788 0.008 . 1 . . . . . 458 VAL C . 52667 1 1485 . 1 . 1 458 458 VAL CA C 13 59.065 0.026 . 1 . . . . . 458 VAL CA . 52667 1 1486 . 1 . 1 458 458 VAL CB C 13 33.438 0.002 . 1 . . . . . 458 VAL CB . 52667 1 1487 . 1 . 1 458 458 VAL N N 15 122.217 0.007 . 1 . . . . . 458 VAL N . 52667 1 1488 . 1 . 1 459 459 THR H H 1 8.927 0.003 . 1 . . . . . 459 THR H . 52667 1 1489 . 1 . 1 459 459 THR C C 13 174.437 0 . 1 . . . . . 459 THR C . 52667 1 1490 . 1 . 1 459 459 THR CA C 13 59.544 0.019 . 1 . . . . . 459 THR CA . 52667 1 1491 . 1 . 1 459 459 THR CB C 13 69.518 0 . 1 . . . . . 459 THR CB . 52667 1 1492 . 1 . 1 459 459 THR N N 15 111.61 0.02 . 1 . . . . . 459 THR N . 52667 1 1493 . 1 . 1 460 460 PRO C C 13 177.798 0 . 1 . . . . . 460 PRO C . 52667 1 1494 . 1 . 1 460 460 PRO CA C 13 64.913 0.012 . 1 . . . . . 460 PRO CA . 52667 1 1495 . 1 . 1 460 460 PRO CB C 13 30.67 0 . 1 . . . . . 460 PRO CB . 52667 1 1496 . 1 . 1 461 461 GLU H H 1 7.814 0.003 . 1 . . . . . 461 GLU H . 52667 1 1497 . 1 . 1 461 461 GLU C C 13 179.275 0.008 . 1 . . . . . 461 GLU C . 52667 1 1498 . 1 . 1 461 461 GLU CA C 13 59.604 0.022 . 1 . . . . . 461 GLU CA . 52667 1 1499 . 1 . 1 461 461 GLU CB C 13 28.01 0.038 . 1 . . . . . 461 GLU CB . 52667 1 1500 . 1 . 1 461 461 GLU N N 15 115.216 0.019 . 1 . . . . . 461 GLU N . 52667 1 1501 . 1 . 1 462 462 ASP H H 1 7.442 0.005 . 1 . . . . . 462 ASP H . 52667 1 1502 . 1 . 1 462 462 ASP C C 13 177.83 0.011 . 1 . . . . . 462 ASP C . 52667 1 1503 . 1 . 1 462 462 ASP CA C 13 57.112 0.025 . 1 . . . . . 462 ASP CA . 52667 1 1504 . 1 . 1 462 462 ASP CB C 13 40.136 0.002 . 1 . . . . . 462 ASP CB . 52667 1 1505 . 1 . 1 462 462 ASP N N 15 118.669 0.023 . 1 . . . . . 462 ASP N . 52667 1 1506 . 1 . 1 463 463 ILE H H 1 6.822 0.004 . 1 . . . . . 463 ILE H . 52667 1 1507 . 1 . 1 463 463 ILE C C 13 178.556 0.017 . 1 . . . . . 463 ILE C . 52667 1 1508 . 1 . 1 463 463 ILE CA C 13 59.385 0.031 . 1 . . . . . 463 ILE CA . 52667 1 1509 . 1 . 1 463 463 ILE CB C 13 32.783 0.07 . 1 . . . . . 463 ILE CB . 52667 1 1510 . 1 . 1 463 463 ILE N N 15 119.379 0.014 . 1 . . . . . 463 ILE N . 52667 1 1511 . 1 . 1 464 464 LEU H H 1 7.377 0.003 . 1 . . . . . 464 LEU H . 52667 1 1512 . 1 . 1 464 464 LEU C C 13 179.037 0.003 . 1 . . . . . 464 LEU C . 52667 1 1513 . 1 . 1 464 464 LEU CA C 13 56.873 0.038 . 1 . . . . . 464 LEU CA . 52667 1 1514 . 1 . 1 464 464 LEU CB C 13 40.141 0.077 . 1 . . . . . 464 LEU CB . 52667 1 1515 . 1 . 1 464 464 LEU N N 15 118.214 0.026 . 1 . . . . . 464 LEU N . 52667 1 1516 . 1 . 1 465 465 ARG H H 1 6.75 0.004 . 1 . . . . . 465 ARG H . 52667 1 1517 . 1 . 1 465 465 ARG C C 13 177.046 0.017 . 1 . . . . . 465 ARG C . 52667 1 1518 . 1 . 1 465 465 ARG CA C 13 56.604 0.038 . 1 . . . . . 465 ARG CA . 52667 1 1519 . 1 . 1 465 465 ARG CB C 13 29.116 0.005 . 1 . . . . . 465 ARG CB . 52667 1 1520 . 1 . 1 465 465 ARG N N 15 114.654 0.016 . 1 . . . . . 465 ARG N . 52667 1 1521 . 1 . 1 466 466 LEU H H 1 7.632 0.003 . 1 . . . . . 466 LEU H . 52667 1 1522 . 1 . 1 466 466 LEU C C 13 176.579 0.018 . 1 . . . . . 466 LEU C . 52667 1 1523 . 1 . 1 466 466 LEU CA C 13 54.64 0.031 . 1 . . . . . 466 LEU CA . 52667 1 1524 . 1 . 1 466 466 LEU CB C 13 38.87 0.01 . 1 . . . . . 466 LEU CB . 52667 1 1525 . 1 . 1 466 466 LEU N N 15 120.152 0.021 . 1 . . . . . 466 LEU N . 52667 1 1526 . 1 . 1 467 467 SER H H 1 7.404 0.002 . 1 . . . . . 467 SER H . 52667 1 1527 . 1 . 1 467 467 SER C C 13 174.748 0 . 1 . . . . . 467 SER C . 52667 1 1528 . 1 . 1 467 467 SER CA C 13 60.644 0.075 . 1 . . . . . 467 SER CA . 52667 1 1529 . 1 . 1 467 467 SER CB C 13 62.378 0.01 . 1 . . . . . 467 SER CB . 52667 1 1530 . 1 . 1 467 467 SER N N 15 114.088 0.016 . 1 . . . . . 467 SER N . 52667 1 1531 . 1 . 1 468 468 GLY H H 1 7.88 0.002 . 1 . . . . . 468 GLY H . 52667 1 1532 . 1 . 1 468 468 GLY C C 13 172.433 0.025 . 1 . . . . . 468 GLY C . 52667 1 1533 . 1 . 1 468 468 GLY CA C 13 43.905 0.013 . 1 . . . . . 468 GLY CA . 52667 1 1534 . 1 . 1 468 468 GLY N N 15 109.725 0.01 . 1 . . . . . 468 GLY N . 52667 1 1535 . 1 . 1 469 469 GLY H H 1 8.333 0.001 . 1 . . . . . 469 GLY H . 52667 1 1536 . 1 . 1 469 469 GLY C C 13 173.894 0.014 . 1 . . . . . 469 GLY C . 52667 1 1537 . 1 . 1 469 469 GLY CA C 13 44.425 0.006 . 1 . . . . . 469 GLY CA . 52667 1 1538 . 1 . 1 469 469 GLY N N 15 104.716 0.007 . 1 . . . . . 469 GLY N . 52667 1 1539 . 1 . 1 470 470 GLY H H 1 7.252 0.004 . 1 . . . . . 470 GLY H . 52667 1 1540 . 1 . 1 470 470 GLY CA C 13 44.428 0 . 1 . . . . . 470 GLY CA . 52667 1 1541 . 1 . 1 470 470 GLY N N 15 109.715 0.01 . 1 . . . . . 470 GLY N . 52667 1 1542 . 1 . 1 471 471 ASP C C 13 175.424 0.023 . 1 . . . . . 471 ASP C . 52667 1 1543 . 1 . 1 471 471 ASP CA C 13 52.956 0.018 . 1 . . . . . 471 ASP CA . 52667 1 1544 . 1 . 1 471 471 ASP CB C 13 39.372 0 . 1 . . . . . 471 ASP CB . 52667 1 1545 . 1 . 1 472 472 TRP H H 1 7.679 0.003 . 1 . . . . . 472 TRP H . 52667 1 1546 . 1 . 1 472 472 TRP C C 13 175.238 0.001 . 1 . . . . . 472 TRP C . 52667 1 1547 . 1 . 1 472 472 TRP CA C 13 54.439 0.014 . 1 . . . . . 472 TRP CA . 52667 1 1548 . 1 . 1 472 472 TRP CB C 13 29.36 0.072 . 1 . . . . . 472 TRP CB . 52667 1 1549 . 1 . 1 472 472 TRP N N 15 123.382 0.019 . 1 . . . . . 472 TRP N . 52667 1 1550 . 1 . 1 473 473 HIS H H 1 6.718 0.006 . 1 . . . . . 473 HIS H . 52667 1 1551 . 1 . 1 473 473 HIS C C 13 175.945 0.074 . 1 . . . . . 473 HIS C . 52667 1 1552 . 1 . 1 473 473 HIS CA C 13 58.214 0.037 . 1 . . . . . 473 HIS CA . 52667 1 1553 . 1 . 1 473 473 HIS CB C 13 30.878 0.014 . 1 . . . . . 473 HIS CB . 52667 1 1554 . 1 . 1 473 473 HIS N N 15 121.079 0.017 . 1 . . . . . 473 HIS N . 52667 1 1555 . 1 . 1 474 474 ILE H H 1 8.049 0.004 . 1 . . . . . 474 ILE H . 52667 1 1556 . 1 . 1 474 474 ILE C C 13 176.47 0.003 . 1 . . . . . 474 ILE C . 52667 1 1557 . 1 . 1 474 474 ILE CA C 13 59.951 0.041 . 1 . . . . . 474 ILE CA . 52667 1 1558 . 1 . 1 474 474 ILE CB C 13 40.441 0.095 . 1 . . . . . 474 ILE CB . 52667 1 1559 . 1 . 1 474 474 ILE N N 15 122.463 0.012 . 1 . . . . . 474 ILE N . 52667 1 1560 . 1 . 1 475 475 ALA H H 1 9.245 0.003 . 1 . . . . . 475 ALA H . 52667 1 1561 . 1 . 1 475 475 ALA C C 13 173.97 0.014 . 1 . . . . . 475 ALA C . 52667 1 1562 . 1 . 1 475 475 ALA CA C 13 55.003 0.009 . 1 . . . . . 475 ALA CA . 52667 1 1563 . 1 . 1 475 475 ALA CB C 13 18.41 0.008 . 1 . . . . . 475 ALA CB . 52667 1 1564 . 1 . 1 475 475 ALA N N 15 130.492 0.017 . 1 . . . . . 475 ALA N . 52667 1 1565 . 1 . 1 476 476 TYR H H 1 9.151 0.002 . 1 . . . . . 476 TYR H . 52667 1 1566 . 1 . 1 476 476 TYR C C 13 173.111 0 . 1 . . . . . 476 TYR C . 52667 1 1567 . 1 . 1 476 476 TYR CA C 13 55.083 0 . 1 . . . . . 476 TYR CA . 52667 1 1568 . 1 . 1 476 476 TYR CB C 13 39.294 0 . 1 . . . . . 476 TYR CB . 52667 1 1569 . 1 . 1 476 476 TYR N N 15 123.569 0.011 . 1 . . . . . 476 TYR N . 52667 1 1570 . 1 . 1 482 482 PRO C C 13 176.31 0.011 . 1 . . . . . 482 PRO C . 52667 1 1571 . 1 . 1 482 482 PRO CA C 13 62.88 0.008 . 1 . . . . . 482 PRO CA . 52667 1 1572 . 1 . 1 482 482 PRO CB C 13 30.989 0 . 1 . . . . . 482 PRO CB . 52667 1 1573 . 1 . 1 483 483 ARG H H 1 7.647 0.003 . 1 . . . . . 483 ARG H . 52667 1 1574 . 1 . 1 483 483 ARG C C 13 174.953 0.009 . 1 . . . . . 483 ARG C . 52667 1 1575 . 1 . 1 483 483 ARG CA C 13 55.158 0.018 . 1 . . . . . 483 ARG CA . 52667 1 1576 . 1 . 1 483 483 ARG CB C 13 29.75 0.012 . 1 . . . . . 483 ARG CB . 52667 1 1577 . 1 . 1 483 483 ARG N N 15 125.135 0.02 . 1 . . . . . 483 ARG N . 52667 1 1578 . 1 . 1 484 484 ARG H H 1 8.203 0.001 . 1 . . . . . 484 ARG H . 52667 1 1579 . 1 . 1 484 484 ARG C C 13 176.17 0.002 . 1 . . . . . 484 ARG C . 52667 1 1580 . 1 . 1 484 484 ARG CA C 13 53.924 0.026 . 1 . . . . . 484 ARG CA . 52667 1 1581 . 1 . 1 484 484 ARG CB C 13 30.009 0.046 . 1 . . . . . 484 ARG CB . 52667 1 1582 . 1 . 1 484 484 ARG N N 15 124.731 0.005 . 1 . . . . . 484 ARG N . 52667 1 1583 . 1 . 1 485 485 VAL H H 1 8.924 0.004 . 1 . . . . . 485 VAL H . 52667 1 1584 . 1 . 1 485 485 VAL C C 13 174.357 0.001 . 1 . . . . . 485 VAL C . 52667 1 1585 . 1 . 1 485 485 VAL CA C 13 60.25 0.004 . 1 . . . . . 485 VAL CA . 52667 1 1586 . 1 . 1 485 485 VAL CB C 13 33.066 0.023 . 1 . . . . . 485 VAL CB . 52667 1 1587 . 1 . 1 485 485 VAL N N 15 122.921 0.022 . 1 . . . . . 485 VAL N . 52667 1 1588 . 1 . 1 486 486 GLU H H 1 8.56 0.002 . 1 . . . . . 486 GLU H . 52667 1 1589 . 1 . 1 486 486 GLU C C 13 176.334 0.001 . 1 . . . . . 486 GLU C . 52667 1 1590 . 1 . 1 486 486 GLU CA C 13 56.431 0.011 . 1 . . . . . 486 GLU CA . 52667 1 1591 . 1 . 1 486 486 GLU CB C 13 29.841 0.002 . 1 . . . . . 486 GLU CB . 52667 1 1592 . 1 . 1 486 486 GLU N N 15 128.492 0.025 . 1 . . . . . 486 GLU N . 52667 1 1593 . 1 . 1 487 487 ILE H H 1 8.2 0.003 . 1 . . . . . 487 ILE H . 52667 1 1594 . 1 . 1 487 487 ILE C C 13 176.091 0.003 . 1 . . . . . 487 ILE C . 52667 1 1595 . 1 . 1 487 487 ILE CA C 13 61.197 0.004 . 1 . . . . . 487 ILE CA . 52667 1 1596 . 1 . 1 487 487 ILE CB C 13 37.651 0.005 . 1 . . . . . 487 ILE CB . 52667 1 1597 . 1 . 1 487 487 ILE N N 15 122.864 0.017 . 1 . . . . . 487 ILE N . 52667 1 1598 . 1 . 1 488 488 MET H H 1 8.481 0.001 . 1 . . . . . 488 MET H . 52667 1 1599 . 1 . 1 488 488 MET C C 13 175.784 0.001 . 1 . . . . . 488 MET C . 52667 1 1600 . 1 . 1 488 488 MET CA C 13 54.531 0.019 . 1 . . . . . 488 MET CA . 52667 1 1601 . 1 . 1 488 488 MET CB C 13 32.362 0.005 . 1 . . . . . 488 MET CB . 52667 1 1602 . 1 . 1 488 488 MET N N 15 127.525 0.007 . 1 . . . . . 488 MET N . 52667 1 1603 . 1 . 1 489 489 GLU H H 1 8.349 0.001 . 1 . . . . . 489 GLU H . 52667 1 1604 . 1 . 1 489 489 GLU C C 13 176.144 0.006 . 1 . . . . . 489 GLU C . 52667 1 1605 . 1 . 1 489 489 GLU CA C 13 55.841 0.025 . 1 . . . . . 489 GLU CA . 52667 1 1606 . 1 . 1 489 489 GLU CB C 13 29.852 0.033 . 1 . . . . . 489 GLU CB . 52667 1 1607 . 1 . 1 489 489 GLU N N 15 123.892 0.007 . 1 . . . . . 489 GLU N . 52667 1 1608 . 1 . 1 490 490 GLU H H 1 8.44 0.003 . 1 . . . . . 490 GLU H . 52667 1 1609 . 1 . 1 490 490 GLU C C 13 176.478 0.006 . 1 . . . . . 490 GLU C . 52667 1 1610 . 1 . 1 490 490 GLU CA C 13 56.063 0.007 . 1 . . . . . 490 GLU CA . 52667 1 1611 . 1 . 1 490 490 GLU CB C 13 29.621 0.014 . 1 . . . . . 490 GLU CB . 52667 1 1612 . 1 . 1 490 490 GLU N N 15 123.073 0.023 . 1 . . . . . 490 GLU N . 52667 1 1613 . 1 . 1 491 491 GLU H H 1 8.452 0.006 . 1 . . . . . 491 GLU H . 52667 1 1614 . 1 . 1 491 491 GLU C C 13 176.502 0 . 1 . . . . . 491 GLU C . 52667 1 1615 . 1 . 1 491 491 GLU CA C 13 56.011 0.099 . 1 . . . . . 491 GLU CA . 52667 1 1616 . 1 . 1 491 491 GLU CB C 13 29.558 0.023 . 1 . . . . . 491 GLU CB . 52667 1 1617 . 1 . 1 491 491 GLU N N 15 123.068 0.005 . 1 . . . . . 491 GLU N . 52667 1 1618 . 1 . 1 492 492 SER H H 1 8.281 0.001 . 1 . . . . . 492 SER H . 52667 1 1619 . 1 . 1 492 492 SER C C 13 174.437 0.004 . 1 . . . . . 492 SER C . 52667 1 1620 . 1 . 1 492 492 SER CA C 13 57.896 0.017 . 1 . . . . . 492 SER CA . 52667 1 1621 . 1 . 1 492 492 SER CB C 13 63.409 0.006 . 1 . . . . . 492 SER CB . 52667 1 1622 . 1 . 1 492 492 SER N N 15 117.513 0.007 . 1 . . . . . 492 SER N . 52667 1 1623 . 1 . 1 493 493 GLU H H 1 8.377 0.004 . 1 . . . . . 493 GLU H . 52667 1 1624 . 1 . 1 493 493 GLU C C 13 175.664 0.002 . 1 . . . . . 493 GLU C . 52667 1 1625 . 1 . 1 493 493 GLU CA C 13 56.273 0.004 . 1 . . . . . 493 GLU CA . 52667 1 1626 . 1 . 1 493 493 GLU CB C 13 29.488 0.011 . 1 . . . . . 493 GLU CB . 52667 1 1627 . 1 . 1 493 493 GLU N N 15 123.727 0.011 . 1 . . . . . 493 GLU N . 52667 1 1628 . 1 . 1 494 494 GLN H H 1 7.888 0.001 . 1 . . . . . 494 GLN H . 52667 1 1629 . 1 . 1 494 494 GLN C C 13 180.623 0 . 1 . . . . . 494 GLN C . 52667 1 1630 . 1 . 1 494 494 GLN CA C 13 56.916 0.008 . 1 . . . . . 494 GLN CA . 52667 1 1631 . 1 . 1 494 494 GLN CB C 13 29.576 0 . 1 . . . . . 494 GLN CB . 52667 1 1632 . 1 . 1 494 494 GLN N N 15 126.447 0.005 . 1 . . . . . 494 GLN N . 52667 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronucl_NOEs_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronucl_NOEs_1 _Heteronucl_NOE_list.Entry_ID 52667 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name NOE _Heteronucl_NOE_list.Sample_condition_list_ID 2 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_NOE_list.Spectrometer_frequency_1H 900 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak integral' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 12 '15N-(1H) NOE' . . . 52667 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 6 $software_6 . . 52667 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 105 105 CYS N N 15 . 1 1 105 105 CYS H H 1 0.656451 0.038668 . . . . . . . . . . 52667 1 2 . 1 1 106 106 GLY N N 15 . 1 1 106 106 GLY H H 1 0.634217 0.0392903 . . . . . . . . . . 52667 1 3 . 1 1 107 107 LEU N N 15 . 1 1 107 107 LEU H H 1 0.613827 0.0719819 . . . . . . . . . . 52667 1 4 . 1 1 108 108 THR N N 15 . 1 1 108 108 THR H H 1 0.717712 0.0794389 . . . . . . . . . . 52667 1 5 . 1 1 109 109 ASN N N 15 . 1 1 109 109 ASN H H 1 0.921266 0.0526455 . . . . . . . . . . 52667 1 6 . 1 1 111 111 GLY N N 15 . 1 1 111 111 GLY H H 1 0.770143 0.126208 . . . . . . . . . . 52667 1 7 . 1 1 112 112 ASN N N 15 . 1 1 112 112 ASN H H 1 0.80883 0.0568899 . . . . . . . . . . 52667 1 8 . 1 1 113 113 THR N N 15 . 1 1 113 113 THR H H 1 0.708115 0.179648 . . . . . . . . . . 52667 1 9 . 1 1 117 117 ASN N N 15 . 1 1 117 117 ASN H H 1 0.873136 0.094474 . . . . . . . . . . 52667 1 10 . 1 1 118 118 ALA N N 15 . 1 1 118 118 ALA H H 1 0.791305 0.0155906 . . . . . . . . . . 52667 1 11 . 1 1 119 119 THR N N 15 . 1 1 119 119 THR H H 1 0.919972 0.181577 . . . . . . . . . . 52667 1 12 . 1 1 120 120 VAL N N 15 . 1 1 120 120 VAL H H 1 0.0814588 0.0076316 . . . . . . . . . . 52667 1 13 . 1 1 121 121 GLN N N 15 . 1 1 121 121 GLN H H 1 1.02987 0.0779385 . . . . . . . . . . 52667 1 14 . 1 1 122 122 CYS N N 15 . 1 1 122 122 CYS H H 1 1.03687 0.21715 . . . . . . . . . . 52667 1 15 . 1 1 125 125 SER N N 15 . 1 1 125 125 SER H H 1 0.864927 0.162328 . . . . . . . . . . 52667 1 16 . 1 1 126 126 VAL N N 15 . 1 1 126 126 VAL H H 1 0.817948 0.017197 . . . . . . . . . . 52667 1 17 . 1 1 128 128 GLU N N 15 . 1 1 128 128 GLU H H 1 0.986547 0.16608 . . . . . . . . . . 52667 1 18 . 1 1 129 129 LEU N N 15 . 1 1 129 129 LEU H H 1 0.663868 0.0519916 . . . . . . . . . . 52667 1 19 . 1 1 130 130 LYS N N 15 . 1 1 130 130 LYS H H 1 0.790846 0.100467 . . . . . . . . . . 52667 1 20 . 1 1 131 131 ASP N N 15 . 1 1 131 131 ASP H H 1 0.414106 0.0417738 . . . . . . . . . . 52667 1 21 . 1 1 132 132 ALA N N 15 . 1 1 132 132 ALA H H 1 0.843086 0.0562133 . . . . . . . . . . 52667 1 22 . 1 1 133 133 LEU N N 15 . 1 1 133 133 LEU H H 1 0.81962 0.028573 . . . . . . . . . . 52667 1 23 . 1 1 134 134 LYS N N 15 . 1 1 134 134 LYS H H 1 0.728814 0.0799555 . . . . . . . . . . 52667 1 24 . 1 1 135 135 ARG N N 15 . 1 1 135 135 ARG H H 1 0.844967 0.0084964 . . . . . . . . . . 52667 1 25 . 1 1 136 136 TYR N N 15 . 1 1 136 136 TYR H H 1 0.734035 0.0399245 . . . . . . . . . . 52667 1 26 . 1 1 137 137 ALA N N 15 . 1 1 137 137 ALA H H 1 0.589453 0.110582 . . . . . . . . . . 52667 1 27 . 1 1 139 139 ALA N N 15 . 1 1 139 139 ALA H H 1 0.527517 0.0621716 . . . . . . . . . . 52667 1 28 . 1 1 140 140 LEU N N 15 . 1 1 140 140 LEU H H 1 0.497043 0.0166972 . . . . . . . . . . 52667 1 29 . 1 1 142 142 ALA N N 15 . 1 1 142 142 ALA H H 1 0.634896 0.275863 . . . . . . . . . . 52667 1 30 . 1 1 149 149 ALA N N 15 . 1 1 149 149 ALA H H 1 -1.00423 0.0258963 . . . . . . . . . . 52667 1 31 . 1 1 152 152 ILE N N 15 . 1 1 152 152 ILE H H 1 0.86237 0.132502 . . . . . . . . . . 52667 1 32 . 1 1 153 153 THR N N 15 . 1 1 153 153 THR H H 1 0.58893 0.20567 . . . . . . . . . . 52667 1 33 . 1 1 155 155 ALA N N 15 . 1 1 155 155 ALA H H 1 0.352853 0.0466537 . . . . . . . . . . 52667 1 34 . 1 1 156 156 LEU N N 15 . 1 1 156 156 LEU H H 1 0.559738 0.0109126 . . . . . . . . . . 52667 1 35 . 1 1 157 157 ARG N N 15 . 1 1 157 157 ARG H H 1 0.661092 0.0332163 . . . . . . . . . . 52667 1 36 . 1 1 158 158 ASP N N 15 . 1 1 158 158 ASP H H 1 0.677792 0.127774 . . . . . . . . . . 52667 1 37 . 1 1 160 160 PHE N N 15 . 1 1 160 160 PHE H H 1 0.614889 0.0114532 . . . . . . . . . . 52667 1 38 . 1 1 161 161 ASP N N 15 . 1 1 161 161 ASP H H 1 0.90502 0.0904936 . . . . . . . . . . 52667 1 39 . 1 1 162 162 SER N N 15 . 1 1 162 162 SER H H 1 0.499682 0.0581084 . . . . . . . . . . 52667 1 40 . 1 1 163 163 MET N N 15 . 1 1 163 163 MET H H 1 0.868086 0.133478 . . . . . . . . . . 52667 1 41 . 1 1 164 164 ASP N N 15 . 1 1 164 164 ASP H H 1 0.699091 0.0227602 . . . . . . . . . . 52667 1 42 . 1 1 165 165 LYS N N 15 . 1 1 165 165 LYS H H 1 0.627706 0.0636658 . . . . . . . . . . 52667 1 43 . 1 1 166 166 THR N N 15 . 1 1 166 166 THR H H 1 0.633997 0.0442802 . . . . . . . . . . 52667 1 44 . 1 1 168 168 SER N N 15 . 1 1 168 168 SER H H 1 0.512742 0.0258859 . . . . . . . . . . 52667 1 45 . 1 1 169 169 SER N N 15 . 1 1 169 169 SER H H 1 0.332916 0.0143475 . . . . . . . . . . 52667 1 46 . 1 1 170 170 ILE N N 15 . 1 1 170 170 ILE H H 1 0.733151 0.0327412 . . . . . . . . . . 52667 1 47 . 1 1 185 185 GLN N N 15 . 1 1 185 185 GLN H H 1 0.840414 0.0377622 . . . . . . . . . . 52667 1 48 . 1 1 186 186 PHE N N 15 . 1 1 186 186 PHE H H 1 0.530279 0.0448347 . . . . . . . . . . 52667 1 49 . 1 1 187 187 ALA N N 15 . 1 1 187 187 ALA H H 1 0.698198 0.0922285 . . . . . . . . . . 52667 1 50 . 1 1 188 188 GLU N N 15 . 1 1 188 188 GLU H H 1 0.331413 0.0340912 . . . . . . . . . . 52667 1 51 . 1 1 189 189 LYS N N 15 . 1 1 189 189 LYS H H 1 0.405884 0.0122249 . . . . . . . . . . 52667 1 52 . 1 1 190 190 GLY N N 15 . 1 1 190 190 GLY H H 1 0.429001 0.0223656 . . . . . . . . . . 52667 1 53 . 1 1 193 193 GLY N N 15 . 1 1 193 193 GLY H H 1 0.506661 0.0479891 . . . . . . . . . . 52667 1 54 . 1 1 194 194 GLN N N 15 . 1 1 194 194 GLN H H 1 0.258389 0.198553 . . . . . . . . . . 52667 1 55 . 1 1 195 195 TYR N N 15 . 1 1 195 195 TYR H H 1 0.440313 0.0256382 . . . . . . . . . . 52667 1 56 . 1 1 196 196 LEU N N 15 . 1 1 196 196 LEU H H 1 0.57385 0.0358699 . . . . . . . . . . 52667 1 57 . 1 1 197 197 GLN N N 15 . 1 1 197 197 GLN H H 1 0.704115 0.0474588 . . . . . . . . . . 52667 1 58 . 1 1 199 199 ASP N N 15 . 1 1 199 199 ASP H H 1 0.6535 0.0509589 . . . . . . . . . . 52667 1 59 . 1 1 200 200 ALA N N 15 . 1 1 200 200 ALA H H 1 0.93718 0.180778 . . . . . . . . . . 52667 1 60 . 1 1 201 201 ASN N N 15 . 1 1 201 201 ASN H H 1 0.968104 0.16814 . . . . . . . . . . 52667 1 61 . 1 1 202 202 GLU N N 15 . 1 1 202 202 GLU H H 1 0.83898 0.103517 . . . . . . . . . . 52667 1 62 . 1 1 203 203 CYS N N 15 . 1 1 203 203 CYS H H 1 0.31897 0.0657579 . . . . . . . . . . 52667 1 63 . 1 1 204 204 TRP N N 15 . 1 1 204 204 TRP H H 1 0.867726 0.131281 . . . . . . . . . . 52667 1 64 . 1 1 205 205 ILE N N 15 . 1 1 205 205 ILE H H 1 0.869407 0.096458 . . . . . . . . . . 52667 1 65 . 1 1 206 206 GLN N N 15 . 1 1 206 206 GLN H H 1 0.918681 0.0950848 . . . . . . . . . . 52667 1 66 . 1 1 207 207 MET N N 15 . 1 1 207 207 MET H H 1 0.952462 0.0999732 . . . . . . . . . . 52667 1 67 . 1 1 208 208 MET N N 15 . 1 1 208 208 MET H H 1 0.460651 0.0671308 . . . . . . . . . . 52667 1 68 . 1 1 209 209 ARG N N 15 . 1 1 209 209 ARG H H 1 0.779293 0.0704159 . . . . . . . . . . 52667 1 69 . 1 1 210 210 VAL N N 15 . 1 1 210 210 VAL H H 1 0.840152 0.0920687 . . . . . . . . . . 52667 1 70 . 1 1 211 211 LEU N N 15 . 1 1 211 211 LEU H H 1 0.916313 0.0778515 . . . . . . . . . . 52667 1 71 . 1 1 212 212 GLN N N 15 . 1 1 212 212 GLN H H 1 0.704499 0.0780698 . . . . . . . . . . 52667 1 72 . 1 1 213 213 GLN N N 15 . 1 1 213 213 GLN H H 1 0.780828 0.0488732 . . . . . . . . . . 52667 1 73 . 1 1 214 214 LYS N N 15 . 1 1 214 214 LYS H H 1 0.454486 0.0509938 . . . . . . . . . . 52667 1 74 . 1 1 215 215 LEU N N 15 . 1 1 215 215 LEU H H 1 0.637507 0.10925 . . . . . . . . . . 52667 1 75 . 1 1 216 216 GLU N N 15 . 1 1 216 216 GLU H H 1 0.698491 0.0303741 . . . . . . . . . . 52667 1 76 . 1 1 217 217 ALA N N 15 . 1 1 217 217 ALA H H 1 0.563325 0.0214723 . . . . . . . . . . 52667 1 77 . 1 1 218 218 ILE N N 15 . 1 1 218 218 ILE H H 1 0.654902 0.0280992 . . . . . . . . . . 52667 1 78 . 1 1 219 219 GLU N N 15 . 1 1 219 219 GLU H H 1 0.548409 0.013624 . . . . . . . . . . 52667 1 79 . 1 1 220 220 ASP N N 15 . 1 1 220 220 ASP H H 1 0.422705 0.0524941 . . . . . . . . . . 52667 1 80 . 1 1 221 221 ASP N N 15 . 1 1 221 221 ASP H H 1 0.429721 0.0049006 . . . . . . . . . . 52667 1 81 . 1 1 222 222 SER N N 15 . 1 1 222 222 SER H H 1 0.466841 0.0013504 . . . . . . . . . . 52667 1 82 . 1 1 223 223 VAL N N 15 . 1 1 223 223 VAL H H 1 0.474433 0.0028086 . . . . . . . . . . 52667 1 83 . 1 1 224 224 LYS N N 15 . 1 1 224 224 LYS H H 1 0.390994 0.002661 . . . . . . . . . . 52667 1 84 . 1 1 225 225 GLU N N 15 . 1 1 225 225 GLU H H 1 0.405962 0.004527 . . . . . . . . . . 52667 1 85 . 1 1 226 226 THR N N 15 . 1 1 226 226 THR H H 1 0.338646 0.0005851 . . . . . . . . . . 52667 1 86 . 1 1 227 227 ASP N N 15 . 1 1 227 227 ASP H H 1 0.366261 0.0071181 . . . . . . . . . . 52667 1 87 . 1 1 233 233 ALA N N 15 . 1 1 233 233 ALA H H 1 0.231832 0.0156084 . . . . . . . . . . 52667 1 88 . 1 1 234 234 ALA N N 15 . 1 1 234 234 ALA H H 1 0.230468 0.0035685 . . . . . . . . . . 52667 1 89 . 1 1 235 235 THR N N 15 . 1 1 235 235 THR H H 1 0.228492 0.0041126 . . . . . . . . . . 52667 1 90 . 1 1 238 238 LYS N N 15 . 1 1 238 238 LYS H H 1 0.413814 0.0093745 . . . . . . . . . . 52667 1 91 . 1 1 239 239 LYS N N 15 . 1 1 239 239 LYS H H 1 0.466976 0.008611 . . . . . . . . . . 52667 1 92 . 1 1 240 240 LYS N N 15 . 1 1 240 240 LYS H H 1 0.516348 0.0115591 . . . . . . . . . . 52667 1 93 . 1 1 241 241 SER N N 15 . 1 1 241 241 SER H H 1 0.561947 0.0451914 . . . . . . . . . . 52667 1 94 . 1 1 242 242 LEU N N 15 . 1 1 242 242 LEU H H 1 0.791202 0.089575 . . . . . . . . . . 52667 1 95 . 1 1 243 243 ILE N N 15 . 1 1 243 243 ILE H H 1 0.780605 0.133639 . . . . . . . . . . 52667 1 96 . 1 1 244 244 ASP N N 15 . 1 1 244 244 ASP H H 1 0.699653 0.632816 . . . . . . . . . . 52667 1 97 . 1 1 245 245 GLN N N 15 . 1 1 245 245 GLN H H 1 0.866036 0.0965722 . . . . . . . . . . 52667 1 98 . 1 1 246 246 PHE N N 15 . 1 1 246 246 PHE H H 1 0.451717 0.171255 . . . . . . . . . . 52667 1 99 . 1 1 249 249 VAL N N 15 . 1 1 249 249 VAL H H 1 0.677061 0.14535 . . . . . . . . . . 52667 1 100 . 1 1 251 251 PHE N N 15 . 1 1 251 251 PHE H H 1 0.833283 0.0611553 . . . . . . . . . . 52667 1 101 . 1 1 252 252 GLU N N 15 . 1 1 252 252 GLU H H 1 0.817525 0.0415549 . . . . . . . . . . 52667 1 102 . 1 1 253 253 THR N N 15 . 1 1 253 253 THR H H 1 0.773987 0.0525971 . . . . . . . . . . 52667 1 103 . 1 1 254 254 THR N N 15 . 1 1 254 254 THR H H 1 0.721287 0.0673214 . . . . . . . . . . 52667 1 104 . 1 1 255 255 MET N N 15 . 1 1 255 255 MET H H 1 0.725332 0.0309694 . . . . . . . . . . 52667 1 105 . 1 1 256 256 LYS N N 15 . 1 1 256 256 LYS H H 1 0.712447 0.0273543 . . . . . . . . . . 52667 1 106 . 1 1 257 257 CYS N N 15 . 1 1 257 257 CYS H H 1 0.758704 0.0573511 . . . . . . . . . . 52667 1 107 . 1 1 258 258 THR N N 15 . 1 1 258 258 THR H H 1 0.562951 0.0859181 . . . . . . . . . . 52667 1 108 . 1 1 259 259 GLU N N 15 . 1 1 259 259 GLU H H 1 0.548225 0.0904639 . . . . . . . . . . 52667 1 109 . 1 1 262 262 GLU N N 15 . 1 1 262 262 GLU H H 1 0.214008 0.0440546 . . . . . . . . . . 52667 1 110 . 1 1 264 264 GLU N N 15 . 1 1 264 264 GLU H H 1 0.41795 0.013326 . . . . . . . . . . 52667 1 111 . 1 1 265 265 VAL N N 15 . 1 1 265 265 VAL H H 1 0.36686 0.0115923 . . . . . . . . . . 52667 1 112 . 1 1 266 266 THR N N 15 . 1 1 266 266 THR H H 1 0.672687 0.0652516 . . . . . . . . . . 52667 1 113 . 1 1 267 267 LYS N N 15 . 1 1 267 267 LYS H H 1 0.59586 0.0156762 . . . . . . . . . . 52667 1 114 . 1 1 268 268 GLY N N 15 . 1 1 268 268 GLY H H 1 0.561611 0.0319289 . . . . . . . . . . 52667 1 115 . 1 1 269 269 LYS N N 15 . 1 1 269 269 LYS H H 1 0.537934 0.0198088 . . . . . . . . . . 52667 1 116 . 1 1 270 270 GLU N N 15 . 1 1 270 270 GLU H H 1 0.600166 0.0359443 . . . . . . . . . . 52667 1 117 . 1 1 271 271 ASN N N 15 . 1 1 271 271 ASN H H 1 0.575314 0.0252752 . . . . . . . . . . 52667 1 118 . 1 1 272 272 GLN N N 15 . 1 1 272 272 GLN H H 1 0.701005 0.0228193 . . . . . . . . . . 52667 1 119 . 1 1 274 274 GLN N N 15 . 1 1 274 274 GLN H H 1 -0.345111 0.0322143 . . . . . . . . . . 52667 1 120 . 1 1 275 275 LEU N N 15 . 1 1 275 275 LEU H H 1 0.695197 0.0283211 . . . . . . . . . . 52667 1 121 . 1 1 276 276 SER N N 15 . 1 1 276 276 SER H H 1 0.594123 0.0318641 . . . . . . . . . . 52667 1 122 . 1 1 277 277 CYS N N 15 . 1 1 277 277 CYS H H 1 0.607901 0.0186454 . . . . . . . . . . 52667 1 123 . 1 1 278 278 PHE N N 15 . 1 1 278 278 PHE H H 1 0.808208 0.0523069 . . . . . . . . . . 52667 1 124 . 1 1 279 279 ILE N N 15 . 1 1 279 279 ILE H H 1 0.447432 0.0084554 . . . . . . . . . . 52667 1 125 . 1 1 280 280 ASN N N 15 . 1 1 280 280 ASN H H 1 0.595274 0.0460043 . . . . . . . . . . 52667 1 126 . 1 1 282 282 GLU N N 15 . 1 1 282 282 GLU H H 1 0.483919 0.0499876 . . . . . . . . . . 52667 1 127 . 1 1 283 283 VAL N N 15 . 1 1 283 283 VAL H H 1 0.539846 0.034926 . . . . . . . . . . 52667 1 128 . 1 1 286 286 LEU N N 15 . 1 1 286 286 LEU H H 1 0.758221 0.0262238 . . . . . . . . . . 52667 1 129 . 1 1 287 287 PHE N N 15 . 1 1 287 287 PHE H H 1 0.889725 0.0779864 . . . . . . . . . . 52667 1 130 . 1 1 288 288 THR N N 15 . 1 1 288 288 THR H H 1 0.275425 0.0485899 . . . . . . . . . . 52667 1 131 . 1 1 289 289 GLY N N 15 . 1 1 289 289 GLY H H 1 0.769012 0.0909915 . . . . . . . . . . 52667 1 132 . 1 1 290 290 LEU N N 15 . 1 1 290 290 LEU H H 1 1.0344 0.0944905 . . . . . . . . . . 52667 1 133 . 1 1 291 291 LYS N N 15 . 1 1 291 291 LYS H H 1 0.800031 0.032111 . . . . . . . . . . 52667 1 134 . 1 1 292 292 LEU N N 15 . 1 1 292 292 LEU H H 1 0.82316 0.0621941 . . . . . . . . . . 52667 1 135 . 1 1 293 293 ARG N N 15 . 1 1 293 293 ARG H H 1 0.772134 0.0546848 . . . . . . . . . . 52667 1 136 . 1 1 294 294 LEU N N 15 . 1 1 294 294 LEU H H 1 0.702186 0.0105609 . . . . . . . . . . 52667 1 137 . 1 1 295 295 GLN N N 15 . 1 1 295 295 GLN H H 1 0.636677 0.0339876 . . . . . . . . . . 52667 1 138 . 1 1 296 296 GLU N N 15 . 1 1 296 296 GLU H H 1 0.621101 0.0627788 . . . . . . . . . . 52667 1 139 . 1 1 297 297 GLU N N 15 . 1 1 297 297 GLU H H 1 0.476123 0.0124344 . . . . . . . . . . 52667 1 140 . 1 1 298 298 ILE N N 15 . 1 1 298 298 ILE H H 1 0.60864 0.0051842 . . . . . . . . . . 52667 1 141 . 1 1 299 299 THR N N 15 . 1 1 299 299 THR H H 1 0.517741 0.0201219 . . . . . . . . . . 52667 1 142 . 1 1 300 300 LYS N N 15 . 1 1 300 300 LYS H H 1 0.535222 0.0292539 . . . . . . . . . . 52667 1 143 . 1 1 301 301 GLN N N 15 . 1 1 301 301 GLN H H 1 0.497356 0.0158577 . . . . . . . . . . 52667 1 144 . 1 1 302 302 SER N N 15 . 1 1 302 302 SER H H 1 0.431728 0.0080456 . . . . . . . . . . 52667 1 145 . 1 1 306 306 GLN N N 15 . 1 1 306 306 GLN H H 1 0.482859 0.0301845 . . . . . . . . . . 52667 1 146 . 1 1 307 307 ARG N N 15 . 1 1 307 307 ARG H H 1 0.427932 0.0275682 . . . . . . . . . . 52667 1 147 . 1 1 309 309 ALA N N 15 . 1 1 309 309 ALA H H 1 0.581454 0.0262094 . . . . . . . . . . 52667 1 148 . 1 1 310 310 LEU N N 15 . 1 1 310 310 LEU H H 1 0.517999 0.0132444 . . . . . . . . . . 52667 1 149 . 1 1 311 311 TYR N N 15 . 1 1 311 311 TYR H H 1 0.688666 0.0309699 . . . . . . . . . . 52667 1 150 . 1 1 312 312 ILE N N 15 . 1 1 312 312 ILE H H 1 0.642482 0.025437 . . . . . . . . . . 52667 1 151 . 1 1 313 313 LYS N N 15 . 1 1 313 313 LYS H H 1 0.663472 0.0093771 . . . . . . . . . . 52667 1 152 . 1 1 314 314 SER N N 15 . 1 1 314 314 SER H H 1 0.710073 0.0429964 . . . . . . . . . . 52667 1 153 . 1 1 315 315 SER N N 15 . 1 1 315 315 SER H H 1 0.747551 0.0433701 . . . . . . . . . . 52667 1 154 . 1 1 316 316 LYS N N 15 . 1 1 316 316 LYS H H 1 0.740837 0.0384589 . . . . . . . . . . 52667 1 155 . 1 1 317 317 ILE N N 15 . 1 1 317 317 ILE H H 1 0.923286 0.0142145 . . . . . . . . . . 52667 1 156 . 1 1 318 318 SER N N 15 . 1 1 318 318 SER H H 1 0.678246 0.164576 . . . . . . . . . . 52667 1 157 . 1 1 320 320 LEU N N 15 . 1 1 320 320 LEU H H 1 0.789409 0.0609805 . . . . . . . . . . 52667 1 158 . 1 1 325 325 THR N N 15 . 1 1 325 325 THR H H 1 0.553859 0.0671769 . . . . . . . . . . 52667 1 159 . 1 1 327 327 GLN N N 15 . 1 1 327 327 GLN H H 1 0.854455 0.120895 . . . . . . . . . . 52667 1 160 . 1 1 328 328 MET N N 15 . 1 1 328 328 MET H H 1 0.70148 0.427469 . . . . . . . . . . 52667 1 161 . 1 1 329 329 VAL N N 15 . 1 1 329 329 VAL H H 1 0.758212 0.0467745 . . . . . . . . . . 52667 1 162 . 1 1 330 330 ARG N N 15 . 1 1 330 330 ARG H H 1 0.921097 0.130419 . . . . . . . . . . 52667 1 163 . 1 1 332 332 PHE N N 15 . 1 1 332 332 PHE H H 1 0.531411 0.0953757 . . . . . . . . . . 52667 1 164 . 1 1 333 333 TYR N N 15 . 1 1 333 333 TYR H H 1 0.513113 0.0559145 . . . . . . . . . . 52667 1 165 . 1 1 335 335 GLU N N 15 . 1 1 335 335 GLU H H 1 0.372846 0.0756848 . . . . . . . . . . 52667 1 166 . 1 1 339 339 VAL N N 15 . 1 1 339 339 VAL H H 1 0.64483 0.130633 . . . . . . . . . . 52667 1 167 . 1 1 340 340 ASN N N 15 . 1 1 340 340 ASN H H 1 0.570145 0.0245405 . . . . . . . . . . 52667 1 168 . 1 1 341 341 ALA N N 15 . 1 1 341 341 ALA H H 1 0.385539 0.0079977 . . . . . . . . . . 52667 1 169 . 1 1 342 342 LYS N N 15 . 1 1 342 342 LYS H H 1 0.607897 0.0278531 . . . . . . . . . . 52667 1 170 . 1 1 343 343 VAL N N 15 . 1 1 343 343 VAL H H 1 0.759128 0.0885042 . . . . . . . . . . 52667 1 171 . 1 1 345 345 LYS N N 15 . 1 1 345 345 LYS H H 1 0.75288 0.196095 . . . . . . . . . . 52667 1 172 . 1 1 346 346 ASP N N 15 . 1 1 346 346 ASP H H 1 0.687936 0.0597934 . . . . . . . . . . 52667 1 173 . 1 1 347 347 VAL N N 15 . 1 1 347 347 VAL H H 1 0.647154 0.112547 . . . . . . . . . . 52667 1 174 . 1 1 348 348 LYS N N 15 . 1 1 348 348 LYS H H 1 0.826093 0.0423585 . . . . . . . . . . 52667 1 175 . 1 1 349 349 PHE N N 15 . 1 1 349 349 PHE H H 1 0.878956 0.0501065 . . . . . . . . . . 52667 1 176 . 1 1 351 351 LEU N N 15 . 1 1 351 351 LEU H H 1 0.86518 0.0499168 . . . . . . . . . . 52667 1 177 . 1 1 352 352 MET N N 15 . 1 1 352 352 MET H H 1 0.44247 0.0259806 . . . . . . . . . . 52667 1 178 . 1 1 353 353 LEU N N 15 . 1 1 353 353 LEU H H 1 0.828368 0.106034 . . . . . . . . . . 52667 1 179 . 1 1 354 354 ASP N N 15 . 1 1 354 354 ASP H H 1 0.712736 0.0383119 . . . . . . . . . . 52667 1 180 . 1 1 356 356 TYR N N 15 . 1 1 356 356 TYR H H 1 0.303009 0.002784 . . . . . . . . . . 52667 1 181 . 1 1 357 357 GLU N N 15 . 1 1 357 357 GLU H H 1 0.900373 0.0693581 . . . . . . . . . . 52667 1 182 . 1 1 358 358 LEU N N 15 . 1 1 358 358 LEU H H 1 0.729486 0.0488038 . . . . . . . . . . 52667 1 183 . 1 1 362 362 GLU N N 15 . 1 1 362 362 GLU H H 1 0.769281 0.0107574 . . . . . . . . . . 52667 1 184 . 1 1 363 363 LEU N N 15 . 1 1 363 363 LEU H H 1 0.770989 0.036453 . . . . . . . . . . 52667 1 185 . 1 1 365 365 GLU N N 15 . 1 1 365 365 GLU H H 1 0.918859 0.0462298 . . . . . . . . . . 52667 1 186 . 1 1 366 366 LYS N N 15 . 1 1 366 366 LYS H H 1 0.723376 0.0577432 . . . . . . . . . . 52667 1 187 . 1 1 367 367 MET N N 15 . 1 1 367 367 MET H H 1 0.536292 0.111568 . . . . . . . . . . 52667 1 188 . 1 1 368 368 VAL N N 15 . 1 1 368 368 VAL H H 1 0.664172 0.0502921 . . . . . . . . . . 52667 1 189 . 1 1 370 370 PHE N N 15 . 1 1 370 370 PHE H H 1 0.611031 0.0497577 . . . . . . . . . . 52667 1 190 . 1 1 371 371 ARG N N 15 . 1 1 371 371 ARG H H 1 0.856611 0.116226 . . . . . . . . . . 52667 1 191 . 1 1 372 372 SER N N 15 . 1 1 372 372 SER H H 1 0.614744 0.107793 . . . . . . . . . . 52667 1 192 . 1 1 373 373 LYS N N 15 . 1 1 373 373 LYS H H 1 0.673336 0.0758585 . . . . . . . . . . 52667 1 193 . 1 1 374 374 PHE N N 15 . 1 1 374 374 PHE H H 1 0.711257 0.0793009 . . . . . . . . . . 52667 1 194 . 1 1 375 375 LYS N N 15 . 1 1 375 375 LYS H H 1 0.564263 0.0108087 . . . . . . . . . . 52667 1 195 . 1 1 376 376 ASP N N 15 . 1 1 376 376 ASP H H 1 0.547007 0.0159278 . . . . . . . . . . 52667 1 196 . 1 1 377 377 LEU N N 15 . 1 1 377 377 LEU H H 1 0.564845 0.0042272 . . . . . . . . . . 52667 1 197 . 1 1 378 378 GLU N N 15 . 1 1 378 378 GLU H H 1 0.479337 0.0063778 . . . . . . . . . . 52667 1 198 . 1 1 379 379 ASP N N 15 . 1 1 379 379 ASP H H 1 0.463203 0.0027039 . . . . . . . . . . 52667 1 199 . 1 1 380 380 LYS N N 15 . 1 1 380 380 LYS H H 1 0.445215 0.0084639 . . . . . . . . . . 52667 1 200 . 1 1 381 381 LYS N N 15 . 1 1 381 381 LYS H H 1 0.472367 0.0094778 . . . . . . . . . . 52667 1 201 . 1 1 382 382 VAL N N 15 . 1 1 382 382 VAL H H 1 0.429991 0.0052822 . . . . . . . . . . 52667 1 202 . 1 1 385 385 GLN N N 15 . 1 1 385 385 GLN H H 1 0.34052 0.0058342 . . . . . . . . . . 52667 1 203 . 1 1 391 391 LYS N N 15 . 1 1 391 391 LYS H H 1 0.348375 0.0062604 . . . . . . . . . . 52667 1 204 . 1 1 392 392 LYS N N 15 . 1 1 392 392 LYS H H 1 0.338159 0.0071637 . . . . . . . . . . 52667 1 205 . 1 1 396 396 GLN N N 15 . 1 1 396 396 GLN H H 1 0.304917 0.0106534 . . . . . . . . . . 52667 1 206 . 1 1 397 397 LYS N N 15 . 1 1 397 397 LYS H H 1 0.313805 0.0064723 . . . . . . . . . . 52667 1 207 . 1 1 398 398 GLU N N 15 . 1 1 398 398 GLU H H 1 0.3707 0.001799 . . . . . . . . . . 52667 1 208 . 1 1 399 399 VAL N N 15 . 1 1 399 399 VAL H H 1 0.252716 0.0066946 . . . . . . . . . . 52667 1 209 . 1 1 400 400 LYS N N 15 . 1 1 400 400 LYS H H 1 0.301216 0.0108438 . . . . . . . . . . 52667 1 210 . 1 1 401 401 TYR N N 15 . 1 1 401 401 TYR H H 1 0.522835 0.0178571 . . . . . . . . . . 52667 1 211 . 1 1 402 402 GLU N N 15 . 1 1 402 402 GLU H H 1 0.686699 0.0194035 . . . . . . . . . . 52667 1 212 . 1 1 404 404 PHE N N 15 . 1 1 404 404 PHE H H 1 0.759463 0.075932 . . . . . . . . . . 52667 1 213 . 1 1 405 405 SER N N 15 . 1 1 405 405 SER H H 1 0.69843 0.121629 . . . . . . . . . . 52667 1 214 . 1 1 406 406 PHE N N 15 . 1 1 406 406 PHE H H 1 0.867887 0.169151 . . . . . . . . . . 52667 1 215 . 1 1 408 408 ASP N N 15 . 1 1 408 408 ASP H H 1 0.621226 0.040792 . . . . . . . . . . 52667 1 216 . 1 1 409 409 ASP N N 15 . 1 1 409 409 ASP H H 1 0.798911 0.0334592 . . . . . . . . . . 52667 1 217 . 1 1 410 410 ILE N N 15 . 1 1 410 410 ILE H H 1 0.771789 0.0325403 . . . . . . . . . . 52667 1 218 . 1 1 411 411 GLY N N 15 . 1 1 411 411 GLY H H 1 0.725224 0.0816183 . . . . . . . . . . 52667 1 219 . 1 1 413 413 ASN N N 15 . 1 1 413 413 ASN H H 1 0.967201 0.036596 . . . . . . . . . . 52667 1 220 . 1 1 414 414 ASN N N 15 . 1 1 414 414 ASN H H 1 0.827422 0.0752425 . . . . . . . . . . 52667 1 221 . 1 1 415 415 CYS N N 15 . 1 1 415 415 CYS H H 1 0.918079 0.0862078 . . . . . . . . . . 52667 1 222 . 1 1 416 416 GLY N N 15 . 1 1 416 416 GLY H H 1 0.3793 0.0599228 . . . . . . . . . . 52667 1 223 . 1 1 418 418 TYR N N 15 . 1 1 418 418 TYR H H 1 0.526841 0.0656185 . . . . . . . . . . 52667 1 224 . 1 1 425 425 THR N N 15 . 1 1 425 425 THR H H 1 0.82633 0.220043 . . . . . . . . . . 52667 1 225 . 1 1 426 426 HIS N N 15 . 1 1 426 426 HIS H H 1 0.707337 0.129177 . . . . . . . . . . 52667 1 226 . 1 1 427 427 GLN N N 15 . 1 1 427 427 GLN H H 1 0.642417 0.161229 . . . . . . . . . . 52667 1 227 . 1 1 433 433 SER N N 15 . 1 1 433 433 SER H H 1 0.475574 0.0704816 . . . . . . . . . . 52667 1 228 . 1 1 434 434 GLY N N 15 . 1 1 434 434 GLY H H 1 0.633251 0.0770546 . . . . . . . . . . 52667 1 229 . 1 1 435 435 HIS N N 15 . 1 1 435 435 HIS H H 1 0.782028 0.0646712 . . . . . . . . . . 52667 1 230 . 1 1 436 436 TYR N N 15 . 1 1 436 436 TYR H H 1 0.90094 0.074408 . . . . . . . . . . 52667 1 231 . 1 1 437 437 VAL N N 15 . 1 1 437 437 VAL H H 1 0.76045 0.114374 . . . . . . . . . . 52667 1 232 . 1 1 438 438 SER N N 15 . 1 1 438 438 SER H H 1 0.817957 0.121434 . . . . . . . . . . 52667 1 233 . 1 1 439 439 TRP N N 15 . 1 1 439 439 TRP H H 1 0.960341 0.123244 . . . . . . . . . . 52667 1 234 . 1 1 440 440 VAL N N 15 . 1 1 440 440 VAL H H 1 0.882661 0.0879331 . . . . . . . . . . 52667 1 235 . 1 1 441 441 LYS N N 15 . 1 1 441 441 LYS H H 1 0.86689 0.0326902 . . . . . . . . . . 52667 1 236 . 1 1 442 442 ARG N N 15 . 1 1 442 442 ARG H H 1 0.690481 0.0706466 . . . . . . . . . . 52667 1 237 . 1 1 443 443 LYS N N 15 . 1 1 443 443 LYS H H 1 0.333625 0.0191179 . . . . . . . . . . 52667 1 238 . 1 1 445 445 ASP N N 15 . 1 1 445 445 ASP H H 1 0.513664 0.0541013 . . . . . . . . . . 52667 1 239 . 1 1 446 446 GLU N N 15 . 1 1 446 446 GLU H H 1 0.551729 0.0297043 . . . . . . . . . . 52667 1 240 . 1 1 447 447 TRP N N 15 . 1 1 447 447 TRP H H 1 0.833989 0.0866693 . . . . . . . . . . 52667 1 241 . 1 1 448 448 ILE N N 15 . 1 1 448 448 ILE H H 1 0.844722 0.0770387 . . . . . . . . . . 52667 1 242 . 1 1 449 449 LYS N N 15 . 1 1 449 449 LYS H H 1 0.858177 0.0580889 . . . . . . . . . . 52667 1 243 . 1 1 450 450 PHE N N 15 . 1 1 450 450 PHE H H 1 0.835583 0.0047716 . . . . . . . . . . 52667 1 244 . 1 1 451 451 ASP N N 15 . 1 1 451 451 ASP H H 1 0.860731 0.0496117 . . . . . . . . . . 52667 1 245 . 1 1 452 452 ASP N N 15 . 1 1 452 452 ASP H H 1 0.613229 0.177907 . . . . . . . . . . 52667 1 246 . 1 1 453 453 ASP N N 15 . 1 1 453 453 ASP H H 1 0.788456 0.116766 . . . . . . . . . . 52667 1 247 . 1 1 454 454 LYS N N 15 . 1 1 454 454 LYS H H 1 0.316633 0.0771924 . . . . . . . . . . 52667 1 248 . 1 1 455 455 VAL N N 15 . 1 1 455 455 VAL H H 1 0.855287 0.0285976 . . . . . . . . . . 52667 1 249 . 1 1 456 456 SER N N 15 . 1 1 456 456 SER H H 1 0.727449 0.0673297 . . . . . . . . . . 52667 1 250 . 1 1 457 457 ILE N N 15 . 1 1 457 457 ILE H H 1 0.692779 0.0339067 . . . . . . . . . . 52667 1 251 . 1 1 458 458 VAL N N 15 . 1 1 458 458 VAL H H 1 0.734427 0.0457702 . . . . . . . . . . 52667 1 252 . 1 1 459 459 THR N N 15 . 1 1 459 459 THR H H 1 0.682046 0.060783 . . . . . . . . . . 52667 1 253 . 1 1 461 461 GLU N N 15 . 1 1 461 461 GLU H H 1 0.724413 0.0236404 . . . . . . . . . . 52667 1 254 . 1 1 462 462 ASP N N 15 . 1 1 462 462 ASP H H 1 0.474736 0.155793 . . . . . . . . . . 52667 1 255 . 1 1 463 463 ILE N N 15 . 1 1 463 463 ILE H H 1 0.901415 0.135077 . . . . . . . . . . 52667 1 256 . 1 1 464 464 LEU N N 15 . 1 1 464 464 LEU H H 1 0.864398 0.0305482 . . . . . . . . . . 52667 1 257 . 1 1 465 465 ARG N N 15 . 1 1 465 465 ARG H H 1 0.865239 0.075479 . . . . . . . . . . 52667 1 258 . 1 1 466 466 LEU N N 15 . 1 1 466 466 LEU H H 1 0.727031 0.0729251 . . . . . . . . . . 52667 1 259 . 1 1 467 467 SER N N 15 . 1 1 467 467 SER H H 1 0.815128 0.0602572 . . . . . . . . . . 52667 1 260 . 1 1 468 468 GLY N N 15 . 1 1 468 468 GLY H H 1 0.715722 0.105883 . . . . . . . . . . 52667 1 261 . 1 1 469 469 GLY N N 15 . 1 1 469 469 GLY H H 1 0.722394 0.0722533 . . . . . . . . . . 52667 1 262 . 1 1 470 470 GLY N N 15 . 1 1 470 470 GLY H H 1 0.567087 0.0888477 . . . . . . . . . . 52667 1 263 . 1 1 472 472 TRP N N 15 . 1 1 472 472 TRP H H 1 0.435348 0.0239077 . . . . . . . . . . 52667 1 264 . 1 1 473 473 HIS N N 15 . 1 1 473 473 HIS H H 1 0.504702 0.207594 . . . . . . . . . . 52667 1 265 . 1 1 474 474 ILE N N 15 . 1 1 474 474 ILE H H 1 0.722916 0.102769 . . . . . . . . . . 52667 1 266 . 1 1 475 475 ALA N N 15 . 1 1 475 475 ALA H H 1 0.794917 0.0807898 . . . . . . . . . . 52667 1 267 . 1 1 476 476 TYR N N 15 . 1 1 476 476 TYR H H 1 0.875104 0.0412111 . . . . . . . . . . 52667 1 268 . 1 1 480 480 TYR N N 15 . 1 1 480 480 TYR H H 1 0.884504 0.0408249 . . . . . . . . . . 52667 1 269 . 1 1 483 483 ARG N N 15 . 1 1 483 483 ARG H H 1 0.622115 0.0064634 . . . . . . . . . . 52667 1 270 . 1 1 484 484 ARG N N 15 . 1 1 484 484 ARG H H 1 0.581759 0.0121721 . . . . . . . . . . 52667 1 271 . 1 1 485 485 VAL N N 15 . 1 1 485 485 VAL H H 1 0.65433 0.0370046 . . . . . . . . . . 52667 1 272 . 1 1 486 486 GLU N N 15 . 1 1 486 486 GLU H H 1 0.627294 0.0134016 . . . . . . . . . . 52667 1 273 . 1 1 487 487 ILE N N 15 . 1 1 487 487 ILE H H 1 0.610712 0.0152742 . . . . . . . . . . 52667 1 274 . 1 1 488 488 MET N N 15 . 1 1 488 488 MET H H 1 0.503069 0.0066078 . . . . . . . . . . 52667 1 275 . 1 1 489 489 GLU N N 15 . 1 1 489 489 GLU H H 1 0.392809 0.0045653 . . . . . . . . . . 52667 1 276 . 1 1 490 490 GLU N N 15 . 1 1 490 490 GLU H H 1 0.349292 0.0011157 . . . . . . . . . . 52667 1 277 . 1 1 491 491 GLU N N 15 . 1 1 491 491 GLU H H 1 0.321014 0.0012177 . . . . . . . . . . 52667 1 278 . 1 1 492 492 SER N N 15 . 1 1 492 492 SER H H 1 0.168587 0.0030563 . . . . . . . . . . 52667 1 279 . 1 1 493 493 GLU N N 15 . 1 1 493 493 GLU H H 1 0.0124638 0.0023348 . . . . . . . . . . 52667 1 280 . 1 1 494 494 GLN N N 15 . 1 1 494 494 GLN H H 1 -0.390761 0.0012796 . . . . . . . . . . 52667 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Entry_ID 52667 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Name R1_800 _Heteronucl_T1_list.Sample_condition_list_ID 2 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Iz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 13 'T1/R1 relaxation' . . . 52667 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 6 $software_6 . . 52667 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 105 105 CYS N N 15 0.752 0.163 . . . . . 52667 1 2 . 1 1 106 106 GLY N N 15 0.687 0.161 . . . . . 52667 1 3 . 1 1 107 107 LEU N N 15 0.807 0.203 . . . . . 52667 1 4 . 1 1 108 108 THR N N 15 0.805 0.205 . . . . . 52667 1 5 . 1 1 109 109 ASN N N 15 0.735 0.179 . . . . . 52667 1 6 . 1 1 111 111 GLY N N 15 0.665 0.192 . . . . . 52667 1 7 . 1 1 112 112 ASN N N 15 0.787 0.186 . . . . . 52667 1 8 . 1 1 113 113 THR N N 15 0.772 0.173 . . . . . 52667 1 9 . 1 1 115 115 TYR N N 15 2.07 0.693 . . . . . 52667 1 10 . 1 1 117 117 ASN N N 15 1.01 0.258 . . . . . 52667 1 11 . 1 1 118 118 ALA N N 15 0.863 0.305 . . . . . 52667 1 12 . 1 1 119 119 THR N N 15 0.675 0.19 . . . . . 52667 1 13 . 1 1 120 120 VAL N N 15 1.37 0.358 . . . . . 52667 1 14 . 1 1 121 121 GLN N N 15 1.69 0.211 . . . . . 52667 1 15 . 1 1 122 122 CYS N N 15 0.78 0.282 . . . . . 52667 1 16 . 1 1 124 124 ARG N N 15 0.701 0.267 . . . . . 52667 1 17 . 1 1 125 125 SER N N 15 1.16 0.244 . . . . . 52667 1 18 . 1 1 126 126 VAL N N 15 0.596 0.162 . . . . . 52667 1 19 . 1 1 128 128 GLU N N 15 0.697 0.138 . . . . . 52667 1 20 . 1 1 129 129 LEU N N 15 0.721 0.279 . . . . . 52667 1 21 . 1 1 130 130 LYS N N 15 0.703 0.274 . . . . . 52667 1 22 . 1 1 131 131 ASP N N 15 0.693 0.0987 . . . . . 52667 1 23 . 1 1 132 132 ALA N N 15 0.66 0.17 . . . . . 52667 1 24 . 1 1 133 133 LEU N N 15 0.931 0.256 . . . . . 52667 1 25 . 1 1 134 134 LYS N N 15 0.709 0.211 . . . . . 52667 1 26 . 1 1 135 135 ARG N N 15 0.65 0.163 . . . . . 52667 1 27 . 1 1 136 136 TYR N N 15 0.64 0.161 . . . . . 52667 1 28 . 1 1 139 139 ALA N N 15 0.728 0.138 . . . . . 52667 1 29 . 1 1 140 140 LEU N N 15 1.33 0.209 . . . . . 52667 1 30 . 1 1 142 142 ALA N N 15 0.985 0.238 . . . . . 52667 1 31 . 1 1 152 152 ILE N N 15 1.32 0.3 . . . . . 52667 1 32 . 1 1 153 153 THR N N 15 0.643 0.132 . . . . . 52667 1 33 . 1 1 154 154 ALA N N 15 0.994 0.256 . . . . . 52667 1 34 . 1 1 155 155 ALA N N 15 1.12 0.285 . . . . . 52667 1 35 . 1 1 156 156 LEU N N 15 2.5 0.461 . . . . . 52667 1 36 . 1 1 157 157 ARG N N 15 1.34 0.318 . . . . . 52667 1 37 . 1 1 158 158 ASP N N 15 0.764 0.209 . . . . . 52667 1 38 . 1 1 160 160 PHE N N 15 1.5 0.435 . . . . . 52667 1 39 . 1 1 161 161 ASP N N 15 0.707 0.18 . . . . . 52667 1 40 . 1 1 162 162 SER N N 15 0.698 0.194 . . . . . 52667 1 41 . 1 1 163 163 MET N N 15 1.27 0.254 . . . . . 52667 1 42 . 1 1 164 164 ASP N N 15 0.678 0.149 . . . . . 52667 1 43 . 1 1 165 165 LYS N N 15 0.711 0.207 . . . . . 52667 1 44 . 1 1 166 166 THR N N 15 0.853 0.222 . . . . . 52667 1 45 . 1 1 168 168 SER N N 15 0.819 0.16 . . . . . 52667 1 46 . 1 1 169 169 SER N N 15 1.13 0.191 . . . . . 52667 1 47 . 1 1 170 170 ILE N N 15 1.49 0.209 . . . . . 52667 1 48 . 1 1 185 185 GLN N N 15 0.835 0.194 . . . . . 52667 1 49 . 1 1 186 186 PHE N N 15 0.694 0.144 . . . . . 52667 1 50 . 1 1 187 187 ALA N N 15 0.814 0.181 . . . . . 52667 1 51 . 1 1 188 188 GLU N N 15 0.664 0.175 . . . . . 52667 1 52 . 1 1 189 189 LYS N N 15 0.654 0.164 . . . . . 52667 1 53 . 1 1 190 190 GLY N N 15 0.637 0.125 . . . . . 52667 1 54 . 1 1 193 193 GLY N N 15 0.686 0.144 . . . . . 52667 1 55 . 1 1 194 194 GLN N N 15 0.962 0.196 . . . . . 52667 1 56 . 1 1 195 195 TYR N N 15 0.808 0.204 . . . . . 52667 1 57 . 1 1 196 196 LEU N N 15 0.741 0.154 . . . . . 52667 1 58 . 1 1 197 197 GLN N N 15 0.797 0.156 . . . . . 52667 1 59 . 1 1 199 199 ASP N N 15 2.11 0.221 . . . . . 52667 1 60 . 1 1 200 200 ALA N N 15 0.61 0.122 . . . . . 52667 1 61 . 1 1 201 201 ASN N N 15 0.722 0.196 . . . . . 52667 1 62 . 1 1 202 202 GLU N N 15 0.659 0.267 . . . . . 52667 1 63 . 1 1 203 203 CYS N N 15 0.747 0.239 . . . . . 52667 1 64 . 1 1 204 204 TRP N N 15 0.578 0.195 . . . . . 52667 1 65 . 1 1 205 205 ILE N N 15 0.685 0.229 . . . . . 52667 1 66 . 1 1 207 207 MET N N 15 0.735 0.176 . . . . . 52667 1 67 . 1 1 208 208 MET N N 15 0.665 0.166 . . . . . 52667 1 68 . 1 1 209 209 ARG N N 15 0.74 0.243 . . . . . 52667 1 69 . 1 1 210 210 VAL N N 15 0.643 0.265 . . . . . 52667 1 70 . 1 1 211 211 LEU N N 15 0.594 0.215 . . . . . 52667 1 71 . 1 1 212 212 GLN N N 15 0.504 0.118 . . . . . 52667 1 72 . 1 1 213 213 GLN N N 15 0.554 0.131 . . . . . 52667 1 73 . 1 1 215 215 LEU N N 15 0.573 0.152 . . . . . 52667 1 74 . 1 1 216 216 GLU N N 15 0.614 0.146 . . . . . 52667 1 75 . 1 1 217 217 ALA N N 15 0.719 0.172 . . . . . 52667 1 76 . 1 1 218 218 ILE N N 15 0.681 0.157 . . . . . 52667 1 77 . 1 1 219 219 GLU N N 15 0.595 0.127 . . . . . 52667 1 78 . 1 1 220 220 ASP N N 15 0.616 0.114 . . . . . 52667 1 79 . 1 1 221 221 ASP N N 15 0.651 0.101 . . . . . 52667 1 80 . 1 1 222 222 SER N N 15 1.96 0.418 . . . . . 52667 1 81 . 1 1 223 223 VAL N N 15 1.83 0.193 . . . . . 52667 1 82 . 1 1 224 224 LYS N N 15 2.04 0.147 . . . . . 52667 1 83 . 1 1 225 225 GLU N N 15 2.08 0.171 . . . . . 52667 1 84 . 1 1 226 226 THR N N 15 2.03 0.21 . . . . . 52667 1 85 . 1 1 227 227 ASP N N 15 0.558 0.13 . . . . . 52667 1 86 . 1 1 233 233 ALA N N 15 2.03 0.193 . . . . . 52667 1 87 . 1 1 234 234 ALA N N 15 1.95 0.186 . . . . . 52667 1 88 . 1 1 235 235 THR N N 15 1.88 0.185 . . . . . 52667 1 89 . 1 1 239 239 LYS N N 15 0.766 0.217 . . . . . 52667 1 90 . 1 1 240 240 LYS N N 15 1.94 0.174 . . . . . 52667 1 91 . 1 1 241 241 SER N N 15 1.78 0.179 . . . . . 52667 1 92 . 1 1 242 242 LEU N N 15 1.49 0.217 . . . . . 52667 1 93 . 1 1 243 243 ILE N N 15 1.05 0.193 . . . . . 52667 1 94 . 1 1 245 245 GLN N N 15 0.651 0.135 . . . . . 52667 1 95 . 1 1 251 251 PHE N N 15 0.738 0.154 . . . . . 52667 1 96 . 1 1 252 252 GLU N N 15 1.12 0.334 . . . . . 52667 1 97 . 1 1 253 253 THR N N 15 0.607 0.162 . . . . . 52667 1 98 . 1 1 254 254 THR N N 15 0.645 0.153 . . . . . 52667 1 99 . 1 1 255 255 MET N N 15 0.678 0.184 . . . . . 52667 1 100 . 1 1 256 256 LYS N N 15 0.675 0.175 . . . . . 52667 1 101 . 1 1 257 257 CYS N N 15 0.713 0.169 . . . . . 52667 1 102 . 1 1 258 258 THR N N 15 0.694 0.184 . . . . . 52667 1 103 . 1 1 259 259 GLU N N 15 0.766 0.281 . . . . . 52667 1 104 . 1 1 262 262 GLU N N 15 0.873 0.175 . . . . . 52667 1 105 . 1 1 263 263 GLU N N 15 1.17 0.282 . . . . . 52667 1 106 . 1 1 264 264 GLU N N 15 0.883 0.159 . . . . . 52667 1 107 . 1 1 265 265 VAL N N 15 0.784 0.121 . . . . . 52667 1 108 . 1 1 266 266 THR N N 15 0.812 0.206 . . . . . 52667 1 109 . 1 1 267 267 LYS N N 15 0.764 0.18 . . . . . 52667 1 110 . 1 1 268 268 GLY N N 15 0.745 0.168 . . . . . 52667 1 111 . 1 1 269 269 LYS N N 15 1.03 0.232 . . . . . 52667 1 112 . 1 1 270 270 GLU N N 15 0.721 0.178 . . . . . 52667 1 113 . 1 1 271 271 ASN N N 15 0.883 0.185 . . . . . 52667 1 114 . 1 1 272 272 GLN N N 15 0.543 0.14 . . . . . 52667 1 115 . 1 1 275 275 LEU N N 15 0.646 0.186 . . . . . 52667 1 116 . 1 1 276 276 SER N N 15 0.637 0.159 . . . . . 52667 1 117 . 1 1 277 277 CYS N N 15 0.745 0.167 . . . . . 52667 1 118 . 1 1 278 278 PHE N N 15 0.636 0.127 . . . . . 52667 1 119 . 1 1 280 280 ASN N N 15 0.675 0.132 . . . . . 52667 1 120 . 1 1 282 282 GLU N N 15 0.749 0.163 . . . . . 52667 1 121 . 1 1 283 283 VAL N N 15 0.861 0.23 . . . . . 52667 1 122 . 1 1 286 286 LEU N N 15 0.748 0.219 . . . . . 52667 1 123 . 1 1 287 287 PHE N N 15 0.688 0.199 . . . . . 52667 1 124 . 1 1 288 288 THR N N 15 0.736 0.199 . . . . . 52667 1 125 . 1 1 289 289 GLY N N 15 1.29 0.233 . . . . . 52667 1 126 . 1 1 290 290 LEU N N 15 0.626 0.161 . . . . . 52667 1 127 . 1 1 291 291 LYS N N 15 0.666 0.196 . . . . . 52667 1 128 . 1 1 292 292 LEU N N 15 0.516 0.131 . . . . . 52667 1 129 . 1 1 293 293 ARG N N 15 0.613 0.109 . . . . . 52667 1 130 . 1 1 294 294 LEU N N 15 0.653 0.166 . . . . . 52667 1 131 . 1 1 295 295 GLN N N 15 0.709 0.13 . . . . . 52667 1 132 . 1 1 296 296 GLU N N 15 0.625 0.133 . . . . . 52667 1 133 . 1 1 297 297 GLU N N 15 0.795 0.246 . . . . . 52667 1 134 . 1 1 298 298 ILE N N 15 0.458 0.0718 . . . . . 52667 1 135 . 1 1 299 299 THR N N 15 0.717 0.162 . . . . . 52667 1 136 . 1 1 300 300 LYS N N 15 0.739 0.158 . . . . . 52667 1 137 . 1 1 301 301 GLN N N 15 0.97 0.197 . . . . . 52667 1 138 . 1 1 302 302 SER N N 15 0.919 0.187 . . . . . 52667 1 139 . 1 1 306 306 GLN N N 15 1.52 0.171 . . . . . 52667 1 140 . 1 1 307 307 ARG N N 15 0.906 0.199 . . . . . 52667 1 141 . 1 1 309 309 ALA N N 15 0.919 0.229 . . . . . 52667 1 142 . 1 1 310 310 LEU N N 15 0.86 0.177 . . . . . 52667 1 143 . 1 1 311 311 TYR N N 15 0.739 0.155 . . . . . 52667 1 144 . 1 1 312 312 ILE N N 15 0.766 0.182 . . . . . 52667 1 145 . 1 1 313 313 LYS N N 15 0.669 0.169 . . . . . 52667 1 146 . 1 1 314 314 SER N N 15 0.633 0.131 . . . . . 52667 1 147 . 1 1 315 315 SER N N 15 0.71 0.158 . . . . . 52667 1 148 . 1 1 316 316 LYS N N 15 0.688 0.186 . . . . . 52667 1 149 . 1 1 317 317 ILE N N 15 0.527 0.157 . . . . . 52667 1 150 . 1 1 320 320 LEU N N 15 2.13 0.185 . . . . . 52667 1 151 . 1 1 329 329 VAL N N 15 0.715 0.209 . . . . . 52667 1 152 . 1 1 330 330 ARG N N 15 0.601 0.171 . . . . . 52667 1 153 . 1 1 332 332 PHE N N 15 0.622 0.21 . . . . . 52667 1 154 . 1 1 333 333 TYR N N 15 0.444 0.137 . . . . . 52667 1 155 . 1 1 339 339 VAL N N 15 0.649 0.173 . . . . . 52667 1 156 . 1 1 340 340 ASN N N 15 0.0539 0.0841 . . . . . 52667 1 157 . 1 1 341 341 ALA N N 15 0.817 0.177 . . . . . 52667 1 158 . 1 1 342 342 LYS N N 15 0.94 0.211 . . . . . 52667 1 159 . 1 1 343 343 VAL N N 15 0.738 0.224 . . . . . 52667 1 160 . 1 1 345 345 LYS N N 15 1.37 0.235 . . . . . 52667 1 161 . 1 1 346 346 ASP N N 15 0.842 0.241 . . . . . 52667 1 162 . 1 1 347 347 VAL N N 15 1.23 0.15 . . . . . 52667 1 163 . 1 1 348 348 LYS N N 15 0.923 0.156 . . . . . 52667 1 164 . 1 1 349 349 PHE N N 15 0.656 0.199 . . . . . 52667 1 165 . 1 1 351 351 LEU N N 15 0.943 0.371 . . . . . 52667 1 166 . 1 1 352 352 MET N N 15 0.682 0.187 . . . . . 52667 1 167 . 1 1 354 354 ASP N N 15 0.798 0.179 . . . . . 52667 1 168 . 1 1 356 356 TYR N N 15 0.585 0.179 . . . . . 52667 1 169 . 1 1 357 357 GLU N N 15 0.695 0.189 . . . . . 52667 1 170 . 1 1 358 358 LEU N N 15 0.844 0.216 . . . . . 52667 1 171 . 1 1 362 362 GLU N N 15 0.712 0.136 . . . . . 52667 1 172 . 1 1 363 363 LEU N N 15 0.751 0.172 . . . . . 52667 1 173 . 1 1 365 365 GLU N N 15 1.03 0.314 . . . . . 52667 1 174 . 1 1 366 366 LYS N N 15 0.643 0.15 . . . . . 52667 1 175 . 1 1 368 368 VAL N N 15 1.99 0.182 . . . . . 52667 1 176 . 1 1 370 370 PHE N N 15 0.716 0.192 . . . . . 52667 1 177 . 1 1 371 371 ARG N N 15 0.623 0.187 . . . . . 52667 1 178 . 1 1 372 372 SER N N 15 0.724 0.192 . . . . . 52667 1 179 . 1 1 373 373 LYS N N 15 0.611 0.187 . . . . . 52667 1 180 . 1 1 374 374 PHE N N 15 0.602 0.165 . . . . . 52667 1 181 . 1 1 375 375 LYS N N 15 0.943 0.24 . . . . . 52667 1 182 . 1 1 376 376 ASP N N 15 0.643 0.185 . . . . . 52667 1 183 . 1 1 377 377 LEU N N 15 0.841 0.183 . . . . . 52667 1 184 . 1 1 378 378 GLU N N 15 0.716 0.202 . . . . . 52667 1 185 . 1 1 379 379 ASP N N 15 0.921 0.209 . . . . . 52667 1 186 . 1 1 380 380 LYS N N 15 0.853 0.224 . . . . . 52667 1 187 . 1 1 381 381 LYS N N 15 1.14 0.222 . . . . . 52667 1 188 . 1 1 382 382 VAL N N 15 1.32 0.207 . . . . . 52667 1 189 . 1 1 385 385 GLN N N 15 0.666 0.118 . . . . . 52667 1 190 . 1 1 391 391 LYS N N 15 1.72 0.182 . . . . . 52667 1 191 . 1 1 397 397 LYS N N 15 1.47 0.191 . . . . . 52667 1 192 . 1 1 398 398 GLU N N 15 1.63 0.195 . . . . . 52667 1 193 . 1 1 399 399 VAL N N 15 1.72 0.218 . . . . . 52667 1 194 . 1 1 400 400 LYS N N 15 1.72 0.196 . . . . . 52667 1 195 . 1 1 401 401 TYR N N 15 1.89 0.166 . . . . . 52667 1 196 . 1 1 402 402 GLU N N 15 2.05 0.186 . . . . . 52667 1 197 . 1 1 404 404 PHE N N 15 2.16 0.177 . . . . . 52667 1 198 . 1 1 405 405 SER N N 15 2.19 0.214 . . . . . 52667 1 199 . 1 1 406 406 PHE N N 15 1.89 0.212 . . . . . 52667 1 200 . 1 1 408 408 ASP N N 15 1.88 0.193 . . . . . 52667 1 201 . 1 1 409 409 ASP N N 15 1.63 0.208 . . . . . 52667 1 202 . 1 1 410 410 ILE N N 15 1.21 0.122 . . . . . 52667 1 203 . 1 1 411 411 GLY N N 15 0.843 0.0969 . . . . . 52667 1 204 . 1 1 412 412 SER N N 15 0.653 0.119 . . . . . 52667 1 205 . 1 1 413 413 ASN N N 15 0.704 0.15 . . . . . 52667 1 206 . 1 1 414 414 ASN N N 15 0.735 0.271 . . . . . 52667 1 207 . 1 1 415 415 CYS N N 15 0.751 0.195 . . . . . 52667 1 208 . 1 1 418 418 TYR N N 15 0.828 0.229 . . . . . 52667 1 209 . 1 1 425 425 THR N N 15 0.601 0.137 . . . . . 52667 1 210 . 1 1 426 426 HIS N N 15 0.643 0.159 . . . . . 52667 1 211 . 1 1 435 435 HIS N N 15 0.745 0.201 . . . . . 52667 1 212 . 1 1 436 436 TYR N N 15 1.97 0.171 . . . . . 52667 1 213 . 1 1 437 437 VAL N N 15 0.542 0.459 . . . . . 52667 1 214 . 1 1 438 438 SER N N 15 0.803 1.21 . . . . . 52667 1 215 . 1 1 439 439 TRP N N 15 0.84 0.288 . . . . . 52667 1 216 . 1 1 440 440 VAL N N 15 0.569 0.175 . . . . . 52667 1 217 . 1 1 441 441 LYS N N 15 1.17 0.328 . . . . . 52667 1 218 . 1 1 442 442 ARG N N 15 1.05 0.264 . . . . . 52667 1 219 . 1 1 445 445 ASP N N 15 0.685 0.196 . . . . . 52667 1 220 . 1 1 446 446 GLU N N 15 0.988 0.288 . . . . . 52667 1 221 . 1 1 447 447 TRP N N 15 1.06 0.493 . . . . . 52667 1 222 . 1 1 448 448 ILE N N 15 0.599 0.411 . . . . . 52667 1 223 . 1 1 449 449 LYS N N 15 0.552 0.153 . . . . . 52667 1 224 . 1 1 450 450 PHE N N 15 0.755 0.203 . . . . . 52667 1 225 . 1 1 451 451 ASP N N 15 2.17 0.337 . . . . . 52667 1 226 . 1 1 453 453 ASP N N 15 0.785 0.146 . . . . . 52667 1 227 . 1 1 454 454 LYS N N 15 1.02 0.343 . . . . . 52667 1 228 . 1 1 455 455 VAL N N 15 0.93 0.158 . . . . . 52667 1 229 . 1 1 456 456 SER N N 15 1.15 0.192 . . . . . 52667 1 230 . 1 1 457 457 ILE N N 15 0.645 0.177 . . . . . 52667 1 231 . 1 1 458 458 VAL N N 15 1.01 0.548 . . . . . 52667 1 232 . 1 1 459 459 THR N N 15 0.636 0.198 . . . . . 52667 1 233 . 1 1 461 461 GLU N N 15 1.03 0.0248 . . . . . 52667 1 234 . 1 1 465 465 ARG N N 15 0.708 0.21 . . . . . 52667 1 235 . 1 1 466 466 LEU N N 15 0.713 0.209 . . . . . 52667 1 236 . 1 1 467 467 SER N N 15 0.806 0.224 . . . . . 52667 1 237 . 1 1 468 468 GLY N N 15 0.67 0.237 . . . . . 52667 1 238 . 1 1 469 469 GLY N N 15 1.92 0.378 . . . . . 52667 1 239 . 1 1 470 470 GLY N N 15 0.476 0.136 . . . . . 52667 1 240 . 1 1 472 472 TRP N N 15 0.848 0.191 . . . . . 52667 1 241 . 1 1 474 474 ILE N N 15 1.2 0.144 . . . . . 52667 1 242 . 1 1 475 475 ALA N N 15 0.696 0.211 . . . . . 52667 1 243 . 1 1 476 476 TYR N N 15 0.443 0.112 . . . . . 52667 1 244 . 1 1 483 483 ARG N N 15 0.66 0.135 . . . . . 52667 1 245 . 1 1 484 484 ARG N N 15 0.754 0.201 . . . . . 52667 1 246 . 1 1 485 485 VAL N N 15 0.686 0.194 . . . . . 52667 1 247 . 1 1 486 486 GLU N N 15 0.784 0.175 . . . . . 52667 1 248 . 1 1 487 487 ILE N N 15 0.859 0.249 . . . . . 52667 1 249 . 1 1 488 488 MET N N 15 0.671 0.232 . . . . . 52667 1 250 . 1 1 489 489 GLU N N 15 0.629 0.22 . . . . . 52667 1 251 . 1 1 490 490 GLU N N 15 0.695 0.221 . . . . . 52667 1 252 . 1 1 491 491 GLU N N 15 0.676 0.191 . . . . . 52667 1 253 . 1 1 492 492 SER N N 15 0.909 0.312 . . . . . 52667 1 254 . 1 1 493 493 GLU N N 15 1.04 0.179 . . . . . 52667 1 255 . 1 1 494 494 GLN N N 15 0.824 0.295 . . . . . 52667 1 stop_ save_ save_heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Entry_ID 52667 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Name R1_900 _Heteronucl_T1_list.Sample_condition_list_ID 2 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T1_list.Spectrometer_frequency_1H 900 _Heteronucl_T1_list.T1_coherence_type Iz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 'T1/R1 relaxation' . . . 52667 2 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 6 $software_6 . . 52667 2 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 105 105 CYS N N 15 0.977 0.116 . . . . . 52667 2 2 . 1 1 106 106 GLY N N 15 0.95 0.155 . . . . . 52667 2 3 . 1 1 107 107 LEU N N 15 0.976 0.139 . . . . . 52667 2 4 . 1 1 108 108 THR N N 15 0.947 0.124 . . . . . 52667 2 5 . 1 1 109 109 ASN N N 15 0.983 0.13 . . . . . 52667 2 6 . 1 1 111 111 GLY N N 15 0.907 0.147 . . . . . 52667 2 7 . 1 1 112 112 ASN N N 15 1.04 0.155 . . . . . 52667 2 8 . 1 1 113 113 THR N N 15 0.851 0.197 . . . . . 52667 2 9 . 1 1 114 114 CYS N N 15 1.85 0.0638 . . . . . 52667 2 10 . 1 1 115 115 TYR N N 15 1.18 0.211 . . . . . 52667 2 11 . 1 1 117 117 ASN N N 15 1.08 0.182 . . . . . 52667 2 12 . 1 1 118 118 ALA N N 15 1.05 0.155 . . . . . 52667 2 13 . 1 1 119 119 THR N N 15 0.977 0.113 . . . . . 52667 2 14 . 1 1 120 120 VAL N N 15 1.76 0.0801 . . . . . 52667 2 15 . 1 1 121 121 GLN N N 15 0.841 0.171 . . . . . 52667 2 16 . 1 1 122 122 CYS N N 15 1.11 0.148 . . . . . 52667 2 17 . 1 1 124 124 ARG N N 15 0.568 0.291 . . . . . 52667 2 18 . 1 1 125 125 SER N N 15 0.95 0.117 . . . . . 52667 2 19 . 1 1 126 126 VAL N N 15 0.886 0.142 . . . . . 52667 2 20 . 1 1 128 128 GLU N N 15 0.946 0.149 . . . . . 52667 2 21 . 1 1 129 129 LEU N N 15 0.971 0.141 . . . . . 52667 2 22 . 1 1 130 130 LYS N N 15 0.979 0.197 . . . . . 52667 2 23 . 1 1 131 131 ASP N N 15 1.29 0.124 . . . . . 52667 2 24 . 1 1 132 132 ALA N N 15 0.888 0.133 . . . . . 52667 2 25 . 1 1 133 133 LEU N N 15 0.716 0.137 . . . . . 52667 2 26 . 1 1 134 134 LYS N N 15 0.91 0.148 . . . . . 52667 2 27 . 1 1 135 135 ARG N N 15 0.922 0.121 . . . . . 52667 2 28 . 1 1 136 136 TYR N N 15 0.941 0.148 . . . . . 52667 2 29 . 1 1 137 137 ALA N N 15 0.72 0.0997 . . . . . 52667 2 30 . 1 1 139 139 ALA N N 15 1.43 0.089 . . . . . 52667 2 31 . 1 1 140 140 LEU N N 15 1.36 0.119 . . . . . 52667 2 32 . 1 1 142 142 ALA N N 15 1.3 0.147 . . . . . 52667 2 33 . 1 1 149 149 ALA N N 15 1.19 0.15 . . . . . 52667 2 34 . 1 1 152 152 ILE N N 15 1.08 0.307 . . . . . 52667 2 35 . 1 1 153 153 THR N N 15 0.987 0.209 . . . . . 52667 2 36 . 1 1 154 154 ALA N N 15 1.86 0.1 . . . . . 52667 2 37 . 1 1 155 155 ALA N N 15 1.67 0.0953 . . . . . 52667 2 38 . 1 1 156 156 LEU N N 15 1.88 0.0923 . . . . . 52667 2 39 . 1 1 157 157 ARG N N 15 1.47 0.138 . . . . . 52667 2 40 . 1 1 158 158 ASP N N 15 1.12 0.159 . . . . . 52667 2 41 . 1 1 160 160 PHE N N 15 0.957 0.159 . . . . . 52667 2 42 . 1 1 161 161 ASP N N 15 0.956 0.144 . . . . . 52667 2 43 . 1 1 162 162 SER N N 15 1.36 0.119 . . . . . 52667 2 44 . 1 1 163 163 MET N N 15 0.91 0.132 . . . . . 52667 2 45 . 1 1 164 164 ASP N N 15 0.99 0.118 . . . . . 52667 2 46 . 1 1 165 165 LYS N N 15 1.04 0.141 . . . . . 52667 2 47 . 1 1 166 166 THR N N 15 1.04 0.138 . . . . . 52667 2 48 . 1 1 168 168 SER N N 15 1.38 0.122 . . . . . 52667 2 49 . 1 1 169 169 SER N N 15 1.63 0.0915 . . . . . 52667 2 50 . 1 1 170 170 ILE N N 15 1.03 0.123 . . . . . 52667 2 51 . 1 1 185 185 GLN N N 15 0.98 0.167 . . . . . 52667 2 52 . 1 1 186 186 PHE N N 15 1.26 0.146 . . . . . 52667 2 53 . 1 1 187 187 ALA N N 15 0.843 0.14 . . . . . 52667 2 54 . 1 1 188 188 GLU N N 15 0.906 0.121 . . . . . 52667 2 55 . 1 1 189 189 LYS N N 15 0.785 0.114 . . . . . 52667 2 56 . 1 1 190 190 GLY N N 15 0.932 0.12 . . . . . 52667 2 57 . 1 1 193 193 GLY N N 15 1.21 0.146 . . . . . 52667 2 58 . 1 1 194 194 GLN N N 15 1.28 0.341 . . . . . 52667 2 59 . 1 1 195 195 TYR N N 15 0.982 0.124 . . . . . 52667 2 60 . 1 1 196 196 LEU N N 15 0.991 0.141 . . . . . 52667 2 61 . 1 1 197 197 GLN N N 15 0.774 0.122 . . . . . 52667 2 62 . 1 1 199 199 ASP N N 15 0.876 0.149 . . . . . 52667 2 63 . 1 1 200 200 ALA N N 15 0.967 0.121 . . . . . 52667 2 64 . 1 1 201 201 ASN N N 15 1.03 0.334 . . . . . 52667 2 65 . 1 1 202 202 GLU N N 15 0.993 0.136 . . . . . 52667 2 66 . 1 1 203 203 CYS N N 15 1.14 0.147 . . . . . 52667 2 67 . 1 1 204 204 TRP N N 15 1.46 0.202 . . . . . 52667 2 68 . 1 1 205 205 ILE N N 15 0.895 0.121 . . . . . 52667 2 69 . 1 1 206 206 GLN N N 15 1.02 0.145 . . . . . 52667 2 70 . 1 1 207 207 MET N N 15 1.11 0.164 . . . . . 52667 2 71 . 1 1 208 208 MET N N 15 1.18 0.112 . . . . . 52667 2 72 . 1 1 209 209 ARG N N 15 0.797 0.149 . . . . . 52667 2 73 . 1 1 210 210 VAL N N 15 0.824 0.145 . . . . . 52667 2 74 . 1 1 211 211 LEU N N 15 0.874 0.194 . . . . . 52667 2 75 . 1 1 212 212 GLN N N 15 0.858 0.118 . . . . . 52667 2 76 . 1 1 213 213 GLN N N 15 0.773 0.127 . . . . . 52667 2 77 . 1 1 214 214 LYS N N 15 0.831 0.153 . . . . . 52667 2 78 . 1 1 215 215 LEU N N 15 0.877 0.127 . . . . . 52667 2 79 . 1 1 216 216 GLU N N 15 0.929 0.144 . . . . . 52667 2 80 . 1 1 217 217 ALA N N 15 0.835 0.105 . . . . . 52667 2 81 . 1 1 218 218 ILE N N 15 0.776 0.111 . . . . . 52667 2 82 . 1 1 219 219 GLU N N 15 0.865 0.0909 . . . . . 52667 2 83 . 1 1 220 220 ASP N N 15 1.81 0.0891 . . . . . 52667 2 84 . 1 1 221 221 ASP N N 15 1.93 0.0722 . . . . . 52667 2 85 . 1 1 222 222 SER N N 15 1.99 0.0602 . . . . . 52667 2 86 . 1 1 223 223 VAL N N 15 2.09 0.051 . . . . . 52667 2 87 . 1 1 224 224 LYS N N 15 2.16 0.0542 . . . . . 52667 2 88 . 1 1 225 225 GLU N N 15 2.08 0.0635 . . . . . 52667 2 89 . 1 1 226 226 THR N N 15 2.13 0.0515 . . . . . 52667 2 90 . 1 1 227 227 ASP N N 15 2.14 0.0501 . . . . . 52667 2 91 . 1 1 233 233 ALA N N 15 2.05 0.0658 . . . . . 52667 2 92 . 1 1 234 234 ALA N N 15 2 0.0542 . . . . . 52667 2 93 . 1 1 235 235 THR N N 15 1.97 0.0591 . . . . . 52667 2 94 . 1 1 238 238 LYS N N 15 1.97 0.0599 . . . . . 52667 2 95 . 1 1 239 239 LYS N N 15 1.83 0.0658 . . . . . 52667 2 96 . 1 1 240 240 LYS N N 15 1.65 0.0939 . . . . . 52667 2 97 . 1 1 241 241 SER N N 15 1.32 0.125 . . . . . 52667 2 98 . 1 1 242 242 LEU N N 15 0.929 0.128 . . . . . 52667 2 99 . 1 1 243 243 ILE N N 15 0.766 0.154 . . . . . 52667 2 100 . 1 1 245 245 GLN N N 15 0.929 0.169 . . . . . 52667 2 101 . 1 1 249 249 VAL N N 15 0.789 0.196 . . . . . 52667 2 102 . 1 1 251 251 PHE N N 15 0.868 0.153 . . . . . 52667 2 103 . 1 1 252 252 GLU N N 15 0.954 0.149 . . . . . 52667 2 104 . 1 1 253 253 THR N N 15 0.97 0.146 . . . . . 52667 2 105 . 1 1 254 254 THR N N 15 0.923 0.152 . . . . . 52667 2 106 . 1 1 255 255 MET N N 15 0.937 0.141 . . . . . 52667 2 107 . 1 1 256 256 LYS N N 15 0.994 0.135 . . . . . 52667 2 108 . 1 1 257 257 CYS N N 15 1.09 0.121 . . . . . 52667 2 109 . 1 1 258 258 THR N N 15 1.22 0.147 . . . . . 52667 2 110 . 1 1 259 259 GLU N N 15 1.08 0.195 . . . . . 52667 2 111 . 1 1 262 262 GLU N N 15 1.39 0.118 . . . . . 52667 2 112 . 1 1 263 263 GLU N N 15 2.4 0.59 . . . . . 52667 2 113 . 1 1 264 264 GLU N N 15 1.14 0.123 . . . . . 52667 2 114 . 1 1 265 265 VAL N N 15 0.987 0.0968 . . . . . 52667 2 115 . 1 1 266 266 THR N N 15 0.96 0.153 . . . . . 52667 2 116 . 1 1 267 267 LYS N N 15 1.01 0.15 . . . . . 52667 2 117 . 1 1 268 268 GLY N N 15 0.973 0.126 . . . . . 52667 2 118 . 1 1 269 269 LYS N N 15 1.17 0.157 . . . . . 52667 2 119 . 1 1 270 270 GLU N N 15 0.996 0.145 . . . . . 52667 2 120 . 1 1 271 271 ASN N N 15 1.08 0.138 . . . . . 52667 2 121 . 1 1 272 272 GLN N N 15 0.791 0.126 . . . . . 52667 2 122 . 1 1 274 274 GLN N N 15 0.89 0.152 . . . . . 52667 2 123 . 1 1 275 275 LEU N N 15 0.91 0.148 . . . . . 52667 2 124 . 1 1 276 276 SER N N 15 0.979 0.122 . . . . . 52667 2 125 . 1 1 277 277 CYS N N 15 0.896 0.113 . . . . . 52667 2 126 . 1 1 278 278 PHE N N 15 0.904 0.14 . . . . . 52667 2 127 . 1 1 279 279 ILE N N 15 1.66 0.0999 . . . . . 52667 2 128 . 1 1 280 280 ASN N N 15 0.935 0.142 . . . . . 52667 2 129 . 1 1 282 282 GLU N N 15 1.14 0.138 . . . . . 52667 2 130 . 1 1 283 283 VAL N N 15 1.09 0.119 . . . . . 52667 2 131 . 1 1 286 286 LEU N N 15 0.926 0.14 . . . . . 52667 2 132 . 1 1 287 287 PHE N N 15 0.941 0.156 . . . . . 52667 2 133 . 1 1 288 288 THR N N 15 1.43 0.138 . . . . . 52667 2 134 . 1 1 289 289 GLY N N 15 0.868 0.162 . . . . . 52667 2 135 . 1 1 290 290 LEU N N 15 0.99 0.13 . . . . . 52667 2 136 . 1 1 291 291 LYS N N 15 0.869 0.138 . . . . . 52667 2 137 . 1 1 292 292 LEU N N 15 0.858 0.122 . . . . . 52667 2 138 . 1 1 293 293 ARG N N 15 0.871 0.123 . . . . . 52667 2 139 . 1 1 294 294 LEU N N 15 0.891 0.126 . . . . . 52667 2 140 . 1 1 295 295 GLN N N 15 0.866 0.12 . . . . . 52667 2 141 . 1 1 296 296 GLU N N 15 1.34 0.335 . . . . . 52667 2 142 . 1 1 297 297 GLU N N 15 0.626 0.0876 . . . . . 52667 2 143 . 1 1 298 298 ILE N N 15 1.01 0.118 . . . . . 52667 2 144 . 1 1 299 299 THR N N 15 0.876 0.124 . . . . . 52667 2 145 . 1 1 300 300 LYS N N 15 1.21 0.114 . . . . . 52667 2 146 . 1 1 301 301 GLN N N 15 1.15 0.129 . . . . . 52667 2 147 . 1 1 302 302 SER N N 15 1.62 0.0805 . . . . . 52667 2 148 . 1 1 306 306 GLN N N 15 1.12 0.111 . . . . . 52667 2 149 . 1 1 307 307 ARG N N 15 1.12 0.118 . . . . . 52667 2 150 . 1 1 309 309 ALA N N 15 1.13 0.12 . . . . . 52667 2 151 . 1 1 310 310 LEU N N 15 1.04 0.12 . . . . . 52667 2 152 . 1 1 311 311 TYR N N 15 1.1 0.113 . . . . . 52667 2 153 . 1 1 312 312 ILE N N 15 0.946 0.142 . . . . . 52667 2 154 . 1 1 313 313 LYS N N 15 0.86 0.121 . . . . . 52667 2 155 . 1 1 314 314 SER N N 15 0.976 0.133 . . . . . 52667 2 156 . 1 1 315 315 SER N N 15 0.978 0.149 . . . . . 52667 2 157 . 1 1 316 316 LYS N N 15 0.933 0.152 . . . . . 52667 2 158 . 1 1 317 317 ILE N N 15 0.878 0.164 . . . . . 52667 2 159 . 1 1 318 318 SER N N 15 1.2 0.252 . . . . . 52667 2 160 . 1 1 320 320 LEU N N 15 0.875 0.14 . . . . . 52667 2 161 . 1 1 325 325 THR N N 15 0.934 0.151 . . . . . 52667 2 162 . 1 1 327 327 GLN N N 15 0.861 0.162 . . . . . 52667 2 163 . 1 1 328 328 MET N N 15 0.901 0.15 . . . . . 52667 2 164 . 1 1 329 329 VAL N N 15 0.893 0.162 . . . . . 52667 2 165 . 1 1 330 330 ARG N N 15 1 0.139 . . . . . 52667 2 166 . 1 1 332 332 PHE N N 15 1.17 0.168 . . . . . 52667 2 167 . 1 1 333 333 TYR N N 15 1.28 0.134 . . . . . 52667 2 168 . 1 1 339 339 VAL N N 15 1.35 0.149 . . . . . 52667 2 169 . 1 1 340 340 ASN N N 15 1.25 0.124 . . . . . 52667 2 170 . 1 1 341 341 ALA N N 15 1.42 0.0818 . . . . . 52667 2 171 . 1 1 342 342 LYS N N 15 1.15 0.107 . . . . . 52667 2 172 . 1 1 343 343 VAL N N 15 1.03 0.182 . . . . . 52667 2 173 . 1 1 345 345 LYS N N 15 1.17 0.2 . . . . . 52667 2 174 . 1 1 346 346 ASP N N 15 0.95 0.154 . . . . . 52667 2 175 . 1 1 347 347 VAL N N 15 0.917 0.162 . . . . . 52667 2 176 . 1 1 348 348 LYS N N 15 0.931 0.155 . . . . . 52667 2 177 . 1 1 349 349 PHE N N 15 0.886 0.138 . . . . . 52667 2 178 . 1 1 351 351 LEU N N 15 0.923 0.158 . . . . . 52667 2 179 . 1 1 352 352 MET N N 15 1.02 0.158 . . . . . 52667 2 180 . 1 1 353 353 LEU N N 15 1.03 0.179 . . . . . 52667 2 181 . 1 1 354 354 ASP N N 15 0.823 0.141 . . . . . 52667 2 182 . 1 1 356 356 TYR N N 15 1.98 0.06 . . . . . 52667 2 183 . 1 1 357 357 GLU N N 15 0.878 0.134 . . . . . 52667 2 184 . 1 1 358 358 LEU N N 15 0.858 0.152 . . . . . 52667 2 185 . 1 1 362 362 GLU N N 15 1.19 0.142 . . . . . 52667 2 186 . 1 1 363 363 LEU N N 15 0.871 0.144 . . . . . 52667 2 187 . 1 1 365 365 GLU N N 15 0.862 0.14 . . . . . 52667 2 188 . 1 1 366 366 LYS N N 15 0.894 0.144 . . . . . 52667 2 189 . 1 1 367 367 MET N N 15 1.08 0.186 . . . . . 52667 2 190 . 1 1 368 368 VAL N N 15 0.906 0.131 . . . . . 52667 2 191 . 1 1 370 370 PHE N N 15 1.08 0.114 . . . . . 52667 2 192 . 1 1 371 371 ARG N N 15 0.977 0.154 . . . . . 52667 2 193 . 1 1 372 372 SER N N 15 0.928 0.201 . . . . . 52667 2 194 . 1 1 373 373 LYS N N 15 1.1 0.15 . . . . . 52667 2 195 . 1 1 374 374 PHE N N 15 1.08 0.128 . . . . . 52667 2 196 . 1 1 375 375 LYS N N 15 1.33 0.107 . . . . . 52667 2 197 . 1 1 376 376 ASP N N 15 1.5 0.111 . . . . . 52667 2 198 . 1 1 377 377 LEU N N 15 1.54 0.0845 . . . . . 52667 2 199 . 1 1 378 378 GLU N N 15 1.73 0.0789 . . . . . 52667 2 200 . 1 1 379 379 ASP N N 15 1.77 0.0859 . . . . . 52667 2 201 . 1 1 380 380 LYS N N 15 1.77 0.0821 . . . . . 52667 2 202 . 1 1 381 381 LYS N N 15 1.9 0.0699 . . . . . 52667 2 203 . 1 1 382 382 VAL N N 15 1.95 0.0632 . . . . . 52667 2 204 . 1 1 385 385 GLN N N 15 2.06 0.0591 . . . . . 52667 2 205 . 1 1 391 391 LYS N N 15 2.14 0.0505 . . . . . 52667 2 206 . 1 1 392 392 LYS N N 15 2.13 0.0509 . . . . . 52667 2 207 . 1 1 396 396 GLN N N 15 1.95 0.0684 . . . . . 52667 2 208 . 1 1 397 397 LYS N N 15 1.95 0.0636 . . . . . 52667 2 209 . 1 1 398 398 GLU N N 15 1.77 0.0842 . . . . . 52667 2 210 . 1 1 399 399 VAL N N 15 1.38 0.0752 . . . . . 52667 2 211 . 1 1 400 400 LYS N N 15 1.02 0.0815 . . . . . 52667 2 212 . 1 1 401 401 TYR N N 15 0.866 0.109 . . . . . 52667 2 213 . 1 1 402 402 GLU N N 15 0.992 0.12 . . . . . 52667 2 214 . 1 1 404 404 PHE N N 15 1.01 0.157 . . . . . 52667 2 215 . 1 1 405 405 SER N N 15 0.991 0.139 . . . . . 52667 2 216 . 1 1 406 406 PHE N N 15 0.853 0.13 . . . . . 52667 2 217 . 1 1 408 408 ASP N N 15 0.965 0.14 . . . . . 52667 2 218 . 1 1 409 409 ASP N N 15 0.917 0.137 . . . . . 52667 2 219 . 1 1 410 410 ILE N N 15 0.817 0.131 . . . . . 52667 2 220 . 1 1 411 411 GLY N N 15 0.921 0.142 . . . . . 52667 2 221 . 1 1 412 412 SER N N 15 1.26 0.203 . . . . . 52667 2 222 . 1 1 413 413 ASN N N 15 0.944 0.14 . . . . . 52667 2 223 . 1 1 414 414 ASN N N 15 0.929 0.132 . . . . . 52667 2 224 . 1 1 415 415 CYS N N 15 1.07 0.367 . . . . . 52667 2 225 . 1 1 416 416 GLY N N 15 2.13 0.0816 . . . . . 52667 2 226 . 1 1 417 417 TYR N N 15 1.26 0.178 . . . . . 52667 2 227 . 1 1 418 418 TYR N N 15 0.837 0.164 . . . . . 52667 2 228 . 1 1 425 425 THR N N 15 1.22 0.188 . . . . . 52667 2 229 . 1 1 426 426 HIS N N 15 0.942 0.18 . . . . . 52667 2 230 . 1 1 427 427 GLN N N 15 0.895 0.196 . . . . . 52667 2 231 . 1 1 433 433 SER N N 15 1.48 0.174 . . . . . 52667 2 232 . 1 1 434 434 GLY N N 15 1.3 0.118 . . . . . 52667 2 233 . 1 1 435 435 HIS N N 15 1.01 0.146 . . . . . 52667 2 234 . 1 1 436 436 TYR N N 15 0.749 0.162 . . . . . 52667 2 235 . 1 1 437 437 VAL N N 15 1.28 0.156 . . . . . 52667 2 236 . 1 1 438 438 SER N N 15 0.994 0.194 . . . . . 52667 2 237 . 1 1 439 439 TRP N N 15 0.952 0.149 . . . . . 52667 2 238 . 1 1 440 440 VAL N N 15 0.891 0.138 . . . . . 52667 2 239 . 1 1 441 441 LYS N N 15 0.957 0.158 . . . . . 52667 2 240 . 1 1 442 442 ARG N N 15 0.976 0.141 . . . . . 52667 2 241 . 1 1 443 443 LYS N N 15 1.68 0.178 . . . . . 52667 2 242 . 1 1 445 445 ASP N N 15 1.3 0.152 . . . . . 52667 2 243 . 1 1 446 446 GLU N N 15 1.43 0.0962 . . . . . 52667 2 244 . 1 1 447 447 TRP N N 15 0.885 0.117 . . . . . 52667 2 245 . 1 1 448 448 ILE N N 15 1.05 0.149 . . . . . 52667 2 246 . 1 1 449 449 LYS N N 15 0.903 0.145 . . . . . 52667 2 247 . 1 1 450 450 PHE N N 15 0.965 0.144 . . . . . 52667 2 248 . 1 1 451 451 ASP N N 15 0.93 0.135 . . . . . 52667 2 249 . 1 1 452 452 ASP N N 15 0.951 0.156 . . . . . 52667 2 250 . 1 1 453 453 ASP N N 15 1.03 0.169 . . . . . 52667 2 251 . 1 1 454 454 LYS N N 15 1.81 0.135 . . . . . 52667 2 252 . 1 1 455 455 VAL N N 15 0.752 0.127 . . . . . 52667 2 253 . 1 1 456 456 SER N N 15 1.01 0.18 . . . . . 52667 2 254 . 1 1 457 457 ILE N N 15 0.776 0.138 . . . . . 52667 2 255 . 1 1 458 458 VAL N N 15 0.933 0.153 . . . . . 52667 2 256 . 1 1 459 459 THR N N 15 0.893 0.148 . . . . . 52667 2 257 . 1 1 461 461 GLU N N 15 0.894 0.121 . . . . . 52667 2 258 . 1 1 462 462 ASP N N 15 0.573 0.184 . . . . . 52667 2 259 . 1 1 463 463 ILE N N 15 0.926 0.133 . . . . . 52667 2 260 . 1 1 464 464 LEU N N 15 0.983 0.151 . . . . . 52667 2 261 . 1 1 465 465 ARG N N 15 0.963 0.144 . . . . . 52667 2 262 . 1 1 466 466 LEU N N 15 1.06 0.157 . . . . . 52667 2 263 . 1 1 467 467 SER N N 15 0.922 0.126 . . . . . 52667 2 264 . 1 1 468 468 GLY N N 15 1.01 0.154 . . . . . 52667 2 265 . 1 1 469 469 GLY N N 15 1 0.168 . . . . . 52667 2 266 . 1 1 470 470 GLY N N 15 1.08 0.145 . . . . . 52667 2 267 . 1 1 472 472 TRP N N 15 1.27 0.125 . . . . . 52667 2 268 . 1 1 473 473 HIS N N 15 1.41 0.151 . . . . . 52667 2 269 . 1 1 474 474 ILE N N 15 1.14 0.141 . . . . . 52667 2 270 . 1 1 475 475 ALA N N 15 0.931 0.161 . . . . . 52667 2 271 . 1 1 476 476 TYR N N 15 0.998 0.172 . . . . . 52667 2 272 . 1 1 483 483 ARG N N 15 1.1 0.132 . . . . . 52667 2 273 . 1 1 484 484 ARG N N 15 0.938 0.111 . . . . . 52667 2 274 . 1 1 485 485 VAL N N 15 0.955 0.121 . . . . . 52667 2 275 . 1 1 486 486 GLU N N 15 0.88 0.0996 . . . . . 52667 2 276 . 1 1 487 487 ILE N N 15 1.19 0.102 . . . . . 52667 2 277 . 1 1 488 488 MET N N 15 1.36 0.0822 . . . . . 52667 2 278 . 1 1 489 489 GLU N N 15 1.84 0.0746 . . . . . 52667 2 279 . 1 1 490 490 GLU N N 15 2.16 0.0542 . . . . . 52667 2 280 . 1 1 491 491 GLU N N 15 2.16 0.0542 . . . . . 52667 2 281 . 1 1 492 492 SER N N 15 2.08 0.0551 . . . . . 52667 2 282 . 1 1 493 493 GLU N N 15 2.08 0.061 . . . . . 52667 2 283 . 1 1 494 494 GLN N N 15 1.24 0.027 . . . . . 52667 2 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Entry_ID 52667 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Name R2_800 _Heteronucl_T2_list.Sample_condition_list_ID 2 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T2_list.Temp_calibration_method Thermocouple _Heteronucl_T2_list.Temp_control_method 'no temperature control applied' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type I(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 14 'T2/R2 relaxation' . . . 52667 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 6 $software_6 . . 52667 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 105 105 CYS N N 15 75.1 6.46 . . . . . . . 52667 1 2 . 1 1 106 106 GLY N N 15 53.3 4.4 . . . . . . . 52667 1 3 . 1 1 107 107 LEU N N 15 85.7 20 . . . . . . . 52667 1 4 . 1 1 108 108 THR N N 15 80.4 11.7 . . . . . . . 52667 1 5 . 1 1 109 109 ASN N N 15 77.9 6.51 . . . . . . . 52667 1 6 . 1 1 111 111 GLY N N 15 73.7 7.72 . . . . . . . 52667 1 7 . 1 1 112 112 ASN N N 15 66.7 2.69 . . . . . . . 52667 1 8 . 1 1 115 115 TYR N N 15 68 15.9 . . . . . . . 52667 1 9 . 1 1 117 117 ASN N N 15 6.28 1.3 . . . . . . . 52667 1 10 . 1 1 118 118 ALA N N 15 79.8 30.1 . . . . . . . 52667 1 11 . 1 1 119 119 THR N N 15 94.8 310 . . . . . . . 52667 1 12 . 1 1 120 120 VAL N N 15 76.4 10.5 . . . . . . . 52667 1 13 . 1 1 121 121 GLN N N 15 45.5 13.7 . . . . . . . 52667 1 14 . 1 1 122 122 CYS N N 15 5.84 0.181 . . . . . . . 52667 1 15 . 1 1 124 124 ARG N N 15 59.9 27.3 . . . . . . . 52667 1 16 . 1 1 125 125 SER N N 15 257 361 . . . . . . . 52667 1 17 . 1 1 126 126 VAL N N 15 223 183 . . . . . . . 52667 1 18 . 1 1 128 128 GLU N N 15 93.3 40.3 . . . . . . . 52667 1 19 . 1 1 129 129 LEU N N 15 65.5 8.13 . . . . . . . 52667 1 20 . 1 1 130 130 LYS N N 15 75.5 42.2 . . . . . . . 52667 1 21 . 1 1 131 131 ASP N N 15 106 50.4 . . . . . . . 52667 1 22 . 1 1 132 132 ALA N N 15 40.5 8.63 . . . . . . . 52667 1 23 . 1 1 133 133 LEU N N 15 55.1 6.75 . . . . . . . 52667 1 24 . 1 1 134 134 LYS N N 15 49.9 18.7 . . . . . . . 52667 1 25 . 1 1 135 135 ARG N N 15 84.3 15.4 . . . . . . . 52667 1 26 . 1 1 136 136 TYR N N 15 68.2 24.3 . . . . . . . 52667 1 27 . 1 1 139 139 ALA N N 15 41.4 3.93 . . . . . . . 52667 1 28 . 1 1 140 140 LEU N N 15 124 53 . . . . . . . 52667 1 29 . 1 1 142 142 ALA N N 15 76.7 17.7 . . . . . . . 52667 1 30 . 1 1 153 153 THR N N 15 27.6 4.68 . . . . . . . 52667 1 31 . 1 1 155 155 ALA N N 15 35.2 3.65 . . . . . . . 52667 1 32 . 1 1 156 156 LEU N N 15 73.7 24.9 . . . . . . . 52667 1 33 . 1 1 157 157 ARG N N 15 10.9 16.5 . . . . . . . 52667 1 34 . 1 1 160 160 PHE N N 15 9.45 0.526 . . . . . . . 52667 1 35 . 1 1 161 161 ASP N N 15 13.4 0.374 . . . . . . . 52667 1 36 . 1 1 162 162 SER N N 15 29.4 3.68 . . . . . . . 52667 1 37 . 1 1 163 163 MET N N 15 18.4 10.1 . . . . . . . 52667 1 38 . 1 1 164 164 ASP N N 15 1.44 3.55 . . . . . . . 52667 1 39 . 1 1 165 165 LYS N N 15 65.8 2.18 . . . . . . . 52667 1 40 . 1 1 166 166 THR N N 15 57.1 13.1 . . . . . . . 52667 1 41 . 1 1 168 168 SER N N 15 66.9 24.2 . . . . . . . 52667 1 42 . 1 1 169 169 SER N N 15 18.3 3.09 . . . . . . . 52667 1 43 . 1 1 170 170 ILE N N 15 71.2 32.5 . . . . . . . 52667 1 44 . 1 1 185 185 GLN N N 15 69 16.6 . . . . . . . 52667 1 45 . 1 1 186 186 PHE N N 15 70.6 15.7 . . . . . . . 52667 1 46 . 1 1 187 187 ALA N N 15 50.8 13 . . . . . . . 52667 1 47 . 1 1 188 188 GLU N N 15 32.1 1.49 . . . . . . . 52667 1 48 . 1 1 189 189 LYS N N 15 62.9 8.04 . . . . . . . 52667 1 49 . 1 1 190 190 GLY N N 15 74.5 6.97 . . . . . . . 52667 1 50 . 1 1 193 193 GLY N N 15 51 13.1 . . . . . . . 52667 1 51 . 1 1 194 194 GLN N N 15 56 6.84 . . . . . . . 52667 1 52 . 1 1 195 195 TYR N N 15 69.6 17.4 . . . . . . . 52667 1 53 . 1 1 196 196 LEU N N 15 57.7 1.96 . . . . . . . 52667 1 54 . 1 1 197 197 GLN N N 15 67.2 2.68 . . . . . . . 52667 1 55 . 1 1 199 199 ASP N N 15 18.1 3.34 . . . . . . . 52667 1 56 . 1 1 200 200 ALA N N 15 73.3 11.3 . . . . . . . 52667 1 57 . 1 1 201 201 ASN N N 15 58.5 5.65 . . . . . . . 52667 1 58 . 1 1 203 203 CYS N N 15 105 322 . . . . . . . 52667 1 59 . 1 1 204 204 TRP N N 15 3.07 0.396 . . . . . . . 52667 1 60 . 1 1 205 205 ILE N N 15 74.6 9.72 . . . . . . . 52667 1 61 . 1 1 207 207 MET N N 15 29.4 9.75 . . . . . . . 52667 1 62 . 1 1 208 208 MET N N 15 108 86.3 . . . . . . . 52667 1 63 . 1 1 209 209 ARG N N 15 48.4 42.3 . . . . . . . 52667 1 64 . 1 1 210 210 VAL N N 15 76.6 265 . . . . . . . 52667 1 65 . 1 1 211 211 LEU N N 15 14.8 9 . . . . . . . 52667 1 66 . 1 1 212 212 GLN N N 15 72.7 16.1 . . . . . . . 52667 1 67 . 1 1 213 213 GLN N N 15 99.7 251 . . . . . . . 52667 1 68 . 1 1 215 215 LEU N N 15 41.7 20.3 . . . . . . . 52667 1 69 . 1 1 216 216 GLU N N 15 44.6 9.52 . . . . . . . 52667 1 70 . 1 1 217 217 ALA N N 15 62.8 8.97 . . . . . . . 52667 1 71 . 1 1 218 218 ILE N N 15 90.2 8.15 . . . . . . . 52667 1 72 . 1 1 219 219 GLU N N 15 52.2 26.5 . . . . . . . 52667 1 73 . 1 1 220 220 ASP N N 15 30.9 13.3 . . . . . . . 52667 1 74 . 1 1 221 221 ASP N N 15 71.3 12.1 . . . . . . . 52667 1 75 . 1 1 222 222 SER N N 15 21.8 6.57 . . . . . . . 52667 1 76 . 1 1 223 223 VAL N N 15 69.9 5.46 . . . . . . . 52667 1 77 . 1 1 224 224 LYS N N 15 76.3 14.5 . . . . . . . 52667 1 78 . 1 1 225 225 GLU N N 15 61.9 3.63 . . . . . . . 52667 1 79 . 1 1 226 226 THR N N 15 64.8 8.29 . . . . . . . 52667 1 80 . 1 1 227 227 ASP N N 15 70.5 11 . . . . . . . 52667 1 81 . 1 1 233 233 ALA N N 15 16.8 0.233 . . . . . . . 52667 1 82 . 1 1 234 234 ALA N N 15 9.25 0.094 . . . . . . . 52667 1 83 . 1 1 235 235 THR N N 15 6.89 0.073 . . . . . . . 52667 1 84 . 1 1 239 239 LYS N N 15 44.5 17.7 . . . . . . . 52667 1 85 . 1 1 240 240 LYS N N 15 6.48 0.06 . . . . . . . 52667 1 86 . 1 1 241 241 SER N N 15 5.63 0.081 . . . . . . . 52667 1 87 . 1 1 242 242 LEU N N 15 4.14 0.093 . . . . . . . 52667 1 88 . 1 1 243 243 ILE N N 15 4.14 0.091 . . . . . . . 52667 1 89 . 1 1 245 245 GLN N N 15 5.74 0.068 . . . . . . . 52667 1 90 . 1 1 251 251 PHE N N 15 11.8 0.25 . . . . . . . 52667 1 91 . 1 1 252 252 GLU N N 15 26.2 0.508 . . . . . . . 52667 1 92 . 1 1 253 253 THR N N 15 31.6 1.15 . . . . . . . 52667 1 93 . 1 1 254 254 THR N N 15 50.3 5.43 . . . . . . . 52667 1 94 . 1 1 255 255 MET N N 15 130 60.7 . . . . . . . 52667 1 95 . 1 1 256 256 LYS N N 15 117 61.2 . . . . . . . 52667 1 96 . 1 1 257 257 CYS N N 15 61 79.5 . . . . . . . 52667 1 97 . 1 1 258 258 THR N N 15 77 4.03 . . . . . . . 52667 1 98 . 1 1 259 259 GLU N N 15 69.3 4.79 . . . . . . . 52667 1 99 . 1 1 262 262 GLU N N 15 79.1 4.49 . . . . . . . 52667 1 100 . 1 1 263 263 GLU N N 15 69.5 10.3 . . . . . . . 52667 1 101 . 1 1 264 264 GLU N N 15 61.3 6.28 . . . . . . . 52667 1 102 . 1 1 265 265 VAL N N 15 89.7 13.2 . . . . . . . 52667 1 103 . 1 1 266 266 THR N N 15 67.4 15.7 . . . . . . . 52667 1 104 . 1 1 267 267 LYS N N 15 78.2 46.1 . . . . . . . 52667 1 105 . 1 1 268 268 GLY N N 15 60.9 15.3 . . . . . . . 52667 1 106 . 1 1 269 269 LYS N N 15 68.5 2.87 . . . . . . . 52667 1 107 . 1 1 270 270 GLU N N 15 62.2 5.95 . . . . . . . 52667 1 108 . 1 1 271 271 ASN N N 15 51.3 4.02 . . . . . . . 52667 1 109 . 1 1 272 272 GLN N N 15 59 2.33 . . . . . . . 52667 1 110 . 1 1 275 275 LEU N N 15 61.3 5.47 . . . . . . . 52667 1 111 . 1 1 276 276 SER N N 15 32.8 8.42 . . . . . . . 52667 1 112 . 1 1 277 277 CYS N N 15 74 8.06 . . . . . . . 52667 1 113 . 1 1 278 278 PHE N N 15 62.3 16 . . . . . . . 52667 1 114 . 1 1 280 280 ASN N N 15 74.1 1.89 . . . . . . . 52667 1 115 . 1 1 282 282 GLU N N 15 -0.46 9.3 . . . . . . . 52667 1 116 . 1 1 283 283 VAL N N 15 80.2 7.83 . . . . . . . 52667 1 117 . 1 1 286 286 LEU N N 15 50.9 7.24 . . . . . . . 52667 1 118 . 1 1 287 287 PHE N N 15 65.5 3.16 . . . . . . . 52667 1 119 . 1 1 288 288 THR N N 15 63.9 14.1 . . . . . . . 52667 1 120 . 1 1 289 289 GLY N N 15 65.9 8.83 . . . . . . . 52667 1 121 . 1 1 290 290 LEU N N 15 63.1 8.57 . . . . . . . 52667 1 122 . 1 1 291 291 LYS N N 15 56.2 15.5 . . . . . . . 52667 1 123 . 1 1 292 292 LEU N N 15 85.1 17 . . . . . . . 52667 1 124 . 1 1 293 293 ARG N N 15 79.8 19.4 . . . . . . . 52667 1 125 . 1 1 294 294 LEU N N 15 57.6 12.5 . . . . . . . 52667 1 126 . 1 1 295 295 GLN N N 15 74.1 18.1 . . . . . . . 52667 1 127 . 1 1 296 296 GLU N N 15 161 293 . . . . . . . 52667 1 128 . 1 1 297 297 GLU N N 15 71.4 4.72 . . . . . . . 52667 1 129 . 1 1 298 298 ILE N N 15 99.3 33.1 . . . . . . . 52667 1 130 . 1 1 299 299 THR N N 15 57.9 12 . . . . . . . 52667 1 131 . 1 1 300 300 LYS N N 15 68.3 22.2 . . . . . . . 52667 1 132 . 1 1 301 301 GLN N N 15 77.6 17.1 . . . . . . . 52667 1 133 . 1 1 302 302 SER N N 15 64.4 9.82 . . . . . . . 52667 1 134 . 1 1 306 306 GLN N N 15 73.1 24.4 . . . . . . . 52667 1 135 . 1 1 307 307 ARG N N 15 66.1 6.73 . . . . . . . 52667 1 136 . 1 1 309 309 ALA N N 15 -1.78 3.47 . . . . . . . 52667 1 137 . 1 1 310 310 LEU N N 15 67.5 3.51 . . . . . . . 52667 1 138 . 1 1 311 311 TYR N N 15 47 4.3 . . . . . . . 52667 1 139 . 1 1 312 312 ILE N N 15 30.1 0.337 . . . . . . . 52667 1 140 . 1 1 313 313 LYS N N 15 69.4 14.5 . . . . . . . 52667 1 141 . 1 1 314 314 SER N N 15 78 10.1 . . . . . . . 52667 1 142 . 1 1 315 315 SER N N 15 66.9 2.04 . . . . . . . 52667 1 143 . 1 1 316 316 LYS N N 15 65.2 4.56 . . . . . . . 52667 1 144 . 1 1 317 317 ILE N N 15 69.4 2.25 . . . . . . . 52667 1 145 . 1 1 320 320 LEU N N 15 53.2 9.88 . . . . . . . 52667 1 146 . 1 1 329 329 VAL N N 15 66.7 2.45 . . . . . . . 52667 1 147 . 1 1 330 330 ARG N N 15 65.5 3.21 . . . . . . . 52667 1 148 . 1 1 332 332 PHE N N 15 65.3 12.9 . . . . . . . 52667 1 149 . 1 1 333 333 TYR N N 15 59.5 2.38 . . . . . . . 52667 1 150 . 1 1 339 339 VAL N N 15 62.6 4.57 . . . . . . . 52667 1 151 . 1 1 340 340 ASN N N 15 95.4 372 . . . . . . . 52667 1 152 . 1 1 341 341 ALA N N 15 67.5 2.65 . . . . . . . 52667 1 153 . 1 1 342 342 LYS N N 15 75 5.92 . . . . . . . 52667 1 154 . 1 1 343 343 VAL N N 15 32.9 0.395 . . . . . . . 52667 1 155 . 1 1 345 345 LYS N N 15 86.1 47 . . . . . . . 52667 1 156 . 1 1 346 346 ASP N N 15 97.2 430 . . . . . . . 52667 1 157 . 1 1 347 347 VAL N N 15 26 6.8 . . . . . . . 52667 1 158 . 1 1 348 348 LYS N N 15 6.98 1.6 . . . . . . . 52667 1 159 . 1 1 349 349 PHE N N 15 59.9 9.03 . . . . . . . 52667 1 160 . 1 1 351 351 LEU N N 15 24 20.3 . . . . . . . 52667 1 161 . 1 1 352 352 MET N N 15 70.6 28.7 . . . . . . . 52667 1 162 . 1 1 354 354 ASP N N 15 35 6.72 . . . . . . . 52667 1 163 . 1 1 356 356 TYR N N 15 38.3 0.782 . . . . . . . 52667 1 164 . 1 1 357 357 GLU N N 15 65.2 1.7 . . . . . . . 52667 1 165 . 1 1 358 358 LEU N N 15 66.9 24.9 . . . . . . . 52667 1 166 . 1 1 362 362 GLU N N 15 93 47.7 . . . . . . . 52667 1 167 . 1 1 363 363 LEU N N 15 71.6 7.85 . . . . . . . 52667 1 168 . 1 1 365 365 GLU N N 15 170 179 . . . . . . . 52667 1 169 . 1 1 366 366 LYS N N 15 69.3 14.2 . . . . . . . 52667 1 170 . 1 1 368 368 VAL N N 15 72.3 254 . . . . . . . 52667 1 171 . 1 1 370 370 PHE N N 15 78 14.5 . . . . . . . 52667 1 172 . 1 1 371 371 ARG N N 15 70.5 6.56 . . . . . . . 52667 1 173 . 1 1 372 372 SER N N 15 58 3.29 . . . . . . . 52667 1 174 . 1 1 373 373 LYS N N 15 127 87.9 . . . . . . . 52667 1 175 . 1 1 374 374 PHE N N 15 68.7 20.3 . . . . . . . 52667 1 176 . 1 1 375 375 LYS N N 15 10.3 0.078 . . . . . . . 52667 1 177 . 1 1 376 376 ASP N N 15 69 1.74 . . . . . . . 52667 1 178 . 1 1 377 377 LEU N N 15 72.8 9.86 . . . . . . . 52667 1 179 . 1 1 378 378 GLU N N 15 66.6 12.3 . . . . . . . 52667 1 180 . 1 1 379 379 ASP N N 15 66.2 5.61 . . . . . . . 52667 1 181 . 1 1 380 380 LYS N N 15 108 387 . . . . . . . 52667 1 182 . 1 1 381 381 LYS N N 15 79.3 5.04 . . . . . . . 52667 1 183 . 1 1 382 382 VAL N N 15 54.6 5 . . . . . . . 52667 1 184 . 1 1 385 385 GLN N N 15 101 24.7 . . . . . . . 52667 1 185 . 1 1 391 391 LYS N N 15 61.5 45.3 . . . . . . . 52667 1 186 . 1 1 397 397 LYS N N 15 49.9 15.7 . . . . . . . 52667 1 187 . 1 1 398 398 GLU N N 15 0.936 2.73 . . . . . . . 52667 1 188 . 1 1 399 399 VAL N N 15 86.8 25.5 . . . . . . . 52667 1 189 . 1 1 400 400 LYS N N 15 57 12.3 . . . . . . . 52667 1 190 . 1 1 401 401 TYR N N 15 60.2 3.61 . . . . . . . 52667 1 191 . 1 1 402 402 GLU N N 15 40.7 0.739 . . . . . . . 52667 1 192 . 1 1 404 404 PHE N N 15 40.6 0.554 . . . . . . . 52667 1 193 . 1 1 405 405 SER N N 15 30.4 0.371 . . . . . . . 52667 1 194 . 1 1 406 406 PHE N N 15 29.4 0.301 . . . . . . . 52667 1 195 . 1 1 408 408 ASP N N 15 27.9 0.272 . . . . . . . 52667 1 196 . 1 1 409 409 ASP N N 15 17.9 0.167 . . . . . . . 52667 1 197 . 1 1 410 410 ILE N N 15 8.35 0.137 . . . . . . . 52667 1 198 . 1 1 411 411 GLY N N 15 5.31 0.086 . . . . . . . 52667 1 199 . 1 1 412 412 SER N N 15 5.62 0.073 . . . . . . . 52667 1 200 . 1 1 413 413 ASN N N 15 8.69 0.108 . . . . . . . 52667 1 201 . 1 1 414 414 ASN N N 15 11.4 0.13 . . . . . . . 52667 1 202 . 1 1 418 418 TYR N N 15 21.9 0.256 . . . . . . . 52667 1 203 . 1 1 425 425 THR N N 15 52.3 1.67 . . . . . . . 52667 1 204 . 1 1 426 426 HIS N N 15 62 1.07 . . . . . . . 52667 1 205 . 1 1 434 434 GLY N N 15 83 31.8 . . . . . . . 52667 1 206 . 1 1 435 435 HIS N N 15 89 29.3 . . . . . . . 52667 1 207 . 1 1 436 436 TYR N N 15 86.5 45.5 . . . . . . . 52667 1 208 . 1 1 438 438 SER N N 15 80.2 405 . . . . . . . 52667 1 209 . 1 1 439 439 TRP N N 15 86 23.5 . . . . . . . 52667 1 210 . 1 1 440 440 VAL N N 15 66.9 3.16 . . . . . . . 52667 1 211 . 1 1 441 441 LYS N N 15 68.1 37.9 . . . . . . . 52667 1 212 . 1 1 442 442 ARG N N 15 70.6 29.2 . . . . . . . 52667 1 213 . 1 1 445 445 ASP N N 15 69.5 14.9 . . . . . . . 52667 1 214 . 1 1 446 446 GLU N N 15 16.2 1.12 . . . . . . . 52667 1 215 . 1 1 447 447 TRP N N 15 43.6 39.7 . . . . . . . 52667 1 216 . 1 1 448 448 ILE N N 15 70.9 60.2 . . . . . . . 52667 1 217 . 1 1 449 449 LYS N N 15 64.9 19.4 . . . . . . . 52667 1 218 . 1 1 450 450 PHE N N 15 91.8 20.1 . . . . . . . 52667 1 219 . 1 1 451 451 ASP N N 15 206 308 . . . . . . . 52667 1 220 . 1 1 452 452 ASP N N 15 0.942 0.363 . . . . . . . 52667 1 221 . 1 1 453 453 ASP N N 15 57.8 7.54 . . . . . . . 52667 1 222 . 1 1 454 454 LYS N N 15 74.2 25.1 . . . . . . . 52667 1 223 . 1 1 455 455 VAL N N 15 79.3 10.7 . . . . . . . 52667 1 224 . 1 1 456 456 SER N N 15 115 67.6 . . . . . . . 52667 1 225 . 1 1 457 457 ILE N N 15 87.2 13.6 . . . . . . . 52667 1 226 . 1 1 458 458 VAL N N 15 68.7 18.7 . . . . . . . 52667 1 227 . 1 1 459 459 THR N N 15 88.6 46.3 . . . . . . . 52667 1 228 . 1 1 461 461 GLU N N 15 44.9 6.66 . . . . . . . 52667 1 229 . 1 1 463 463 ILE N N 15 17.8 0.155 . . . . . . . 52667 1 230 . 1 1 464 464 LEU N N 15 6.95 0.029 . . . . . . . 52667 1 231 . 1 1 465 465 ARG N N 15 78.4 20.8 . . . . . . . 52667 1 232 . 1 1 466 466 LEU N N 15 80.9 19.7 . . . . . . . 52667 1 233 . 1 1 467 467 SER N N 15 8.52 0.137 . . . . . . . 52667 1 234 . 1 1 469 469 GLY N N 15 67.8 12.7 . . . . . . . 52667 1 235 . 1 1 470 470 GLY N N 15 24.3 1.82 . . . . . . . 52667 1 236 . 1 1 472 472 TRP N N 15 80.2 31.6 . . . . . . . 52667 1 237 . 1 1 473 473 HIS N N 15 40.3 0.519 . . . . . . . 52667 1 238 . 1 1 474 474 ILE N N 15 39.1 5.39 . . . . . . . 52667 1 239 . 1 1 475 475 ALA N N 15 73.8 6.32 . . . . . . . 52667 1 240 . 1 1 476 476 TYR N N 15 57.6 15.6 . . . . . . . 52667 1 241 . 1 1 483 483 ARG N N 15 64.7 4.79 . . . . . . . 52667 1 242 . 1 1 484 484 ARG N N 15 65.7 5.27 . . . . . . . 52667 1 243 . 1 1 485 485 VAL N N 15 75.9 16.7 . . . . . . . 52667 1 244 . 1 1 486 486 GLU N N 15 69.6 406 . . . . . . . 52667 1 245 . 1 1 487 487 ILE N N 15 77.4 33.3 . . . . . . . 52667 1 246 . 1 1 488 488 MET N N 15 34.6 3.86 . . . . . . . 52667 1 247 . 1 1 489 489 GLU N N 15 68.7 5.98 . . . . . . . 52667 1 248 . 1 1 490 490 GLU N N 15 80.3 21 . . . . . . . 52667 1 249 . 1 1 491 491 GLU N N 15 51 3.28 . . . . . . . 52667 1 250 . 1 1 492 492 SER N N 15 56.6 6.62 . . . . . . . 52667 1 251 . 1 1 493 493 GLU N N 15 71.6 9.53 . . . . . . . 52667 1 252 . 1 1 494 494 GLN N N 15 69.4 9.73 . . . . . . . 52667 1 stop_ save_ save_heteronucl_T2_relaxation_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronucl_T2_relaxation_2 _Heteronucl_T2_list.Entry_ID 52667 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Name R2_900 _Heteronucl_T2_list.Sample_condition_list_ID 2 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T2_list.Temp_calibration_method Thermocouple _Heteronucl_T2_list.Temp_control_method 'no temperature control applied' _Heteronucl_T2_list.Spectrometer_frequency_1H 900 _Heteronucl_T2_list.T2_coherence_type I(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 11 'T2/R2 relaxation' . . . 52667 2 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 6 $software_6 . . 52667 2 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 105 105 CYS N N 15 78.2 6.94 . . . . . . . 52667 2 2 . 1 1 106 106 GLY N N 15 85.5 14.2 . . . . . . . 52667 2 3 . 1 1 107 107 LEU N N 15 78.4 17 . . . . . . . 52667 2 4 . 1 1 108 108 THR N N 15 86.5 55.8 . . . . . . . 52667 2 5 . 1 1 109 109 ASN N N 15 91.7 3.59 . . . . . . . 52667 2 6 . 1 1 111 111 GLY N N 15 67.7 11.7 . . . . . . . 52667 2 7 . 1 1 112 112 ASN N N 15 75.5 1.39 . . . . . . . 52667 2 8 . 1 1 115 115 TYR N N 15 133 34.6 . . . . . . . 52667 2 9 . 1 1 117 117 ASN N N 15 85.3 156 . . . . . . . 52667 2 10 . 1 1 118 118 ALA N N 15 105 12.3 . . . . . . . 52667 2 11 . 1 1 119 119 THR N N 15 99.5 16.9 . . . . . . . 52667 2 12 . 1 1 120 120 VAL N N 15 5.74 0.12 . . . . . . . 52667 2 13 . 1 1 121 121 GLN N N 15 108 58.7 . . . . . . . 52667 2 14 . 1 1 122 122 CYS N N 15 72 14.1 . . . . . . . 52667 2 15 . 1 1 124 124 ARG N N 15 234 260 . . . . . . . 52667 2 16 . 1 1 125 125 SER N N 15 85.6 14.2 . . . . . . . 52667 2 17 . 1 1 126 126 VAL N N 15 99.3 17 . . . . . . . 52667 2 18 . 1 1 128 128 GLU N N 15 94.5 12.9 . . . . . . . 52667 2 19 . 1 1 129 129 LEU N N 15 71.6 13.7 . . . . . . . 52667 2 20 . 1 1 130 130 LYS N N 15 110 25.1 . . . . . . . 52667 2 21 . 1 1 131 131 ASP N N 15 14.4 5.52 . . . . . . . 52667 2 22 . 1 1 132 132 ALA N N 15 99.8 5.65 . . . . . . . 52667 2 23 . 1 1 133 133 LEU N N 15 95.4 49.2 . . . . . . . 52667 2 24 . 1 1 134 134 LYS N N 15 90 4.68 . . . . . . . 52667 2 25 . 1 1 135 135 ARG N N 15 77.9 32.8 . . . . . . . 52667 2 26 . 1 1 136 136 TYR N N 15 81.2 14.9 . . . . . . . 52667 2 27 . 1 1 137 137 ALA N N 15 211 349 . . . . . . . 52667 2 28 . 1 1 139 139 ALA N N 15 19.1 4.43 . . . . . . . 52667 2 29 . 1 1 140 140 LEU N N 15 50.1 5.07 . . . . . . . 52667 2 30 . 1 1 142 142 ALA N N 15 88 28.3 . . . . . . . 52667 2 31 . 1 1 149 149 ALA N N 15 1.11 0.16 . . . . . . . 52667 2 32 . 1 1 153 153 THR N N 15 144 62.2 . . . . . . . 52667 2 33 . 1 1 155 155 ALA N N 15 7.92 0.49 . . . . . . . 52667 2 34 . 1 1 156 156 LEU N N 15 9.87 0.25 . . . . . . . 52667 2 35 . 1 1 157 157 ARG N N 15 29.2 1.5 . . . . . . . 52667 2 36 . 1 1 158 158 ASP N N 15 54.7 19.1 . . . . . . . 52667 2 37 . 1 1 160 160 PHE N N 15 75.1 2.88 . . . . . . . 52667 2 38 . 1 1 161 161 ASP N N 15 79.9 22.3 . . . . . . . 52667 2 39 . 1 1 162 162 SER N N 15 48.1 12.5 . . . . . . . 52667 2 40 . 1 1 163 163 MET N N 15 78.2 10.7 . . . . . . . 52667 2 41 . 1 1 164 164 ASP N N 15 102 8.76 . . . . . . . 52667 2 42 . 1 1 165 165 LYS N N 15 85.3 2.76 . . . . . . . 52667 2 43 . 1 1 166 166 THR N N 15 72.9 5.06 . . . . . . . 52667 2 44 . 1 1 168 168 SER N N 15 64.5 23.2 . . . . . . . 52667 2 45 . 1 1 169 169 SER N N 15 34.7 2.18 . . . . . . . 52667 2 46 . 1 1 170 170 ILE N N 15 74.3 5.16 . . . . . . . 52667 2 47 . 1 1 185 185 GLN N N 15 86.9 9.74 . . . . . . . 52667 2 48 . 1 1 186 186 PHE N N 15 9.47 1.36 . . . . . . . 52667 2 49 . 1 1 187 187 ALA N N 15 79.3 8.28 . . . . . . . 52667 2 50 . 1 1 188 188 GLU N N 15 77.3 2.11 . . . . . . . 52667 2 51 . 1 1 189 189 LYS N N 15 35.8 8.17 . . . . . . . 52667 2 52 . 1 1 190 190 GLY N N 15 68.4 2.98 . . . . . . . 52667 2 53 . 1 1 193 193 GLY N N 15 80.5 15.5 . . . . . . . 52667 2 54 . 1 1 194 194 GLN N N 15 63.8 16.3 . . . . . . . 52667 2 55 . 1 1 195 195 TYR N N 15 61.1 6.96 . . . . . . . 52667 2 56 . 1 1 196 196 LEU N N 15 73.4 3.37 . . . . . . . 52667 2 57 . 1 1 197 197 GLN N N 15 72.8 6.56 . . . . . . . 52667 2 58 . 1 1 199 199 ASP N N 15 73.8 24.1 . . . . . . . 52667 2 59 . 1 1 200 200 ALA N N 15 107 47.2 . . . . . . . 52667 2 60 . 1 1 201 201 ASN N N 15 106 64.3 . . . . . . . 52667 2 61 . 1 1 202 202 GLU N N 15 86.9 21.3 . . . . . . . 52667 2 62 . 1 1 203 203 CYS N N 15 22.2 8.2 . . . . . . . 52667 2 63 . 1 1 204 204 TRP N N 15 79.4 18 . . . . . . . 52667 2 64 . 1 1 205 205 ILE N N 15 86.5 7.4 . . . . . . . 52667 2 65 . 1 1 206 206 GLN N N 15 44.1 30.4 . . . . . . . 52667 2 66 . 1 1 207 207 MET N N 15 26.2 9.93 . . . . . . . 52667 2 67 . 1 1 208 208 MET N N 15 5.64 0.25 . . . . . . . 52667 2 68 . 1 1 209 209 ARG N N 15 114 67.4 . . . . . . . 52667 2 69 . 1 1 210 210 VAL N N 15 112 22.9 . . . . . . . 52667 2 70 . 1 1 211 211 LEU N N 15 98 54.4 . . . . . . . 52667 2 71 . 1 1 212 212 GLN N N 15 79.1 6.05 . . . . . . . 52667 2 72 . 1 1 213 213 GLN N N 15 91.3 26.3 . . . . . . . 52667 2 73 . 1 1 214 214 LYS N N 15 193 151 . . . . . . . 52667 2 74 . 1 1 215 215 LEU N N 15 20.5 7.94 . . . . . . . 52667 2 75 . 1 1 216 216 GLU N N 15 78.4 2.1 . . . . . . . 52667 2 76 . 1 1 217 217 ALA N N 15 36.6 8.88 . . . . . . . 52667 2 77 . 1 1 218 218 ILE N N 15 71.2 1.77 . . . . . . . 52667 2 78 . 1 1 219 219 GLU N N 15 68 5.47 . . . . . . . 52667 2 79 . 1 1 220 220 ASP N N 15 26.4 1.67 . . . . . . . 52667 2 80 . 1 1 221 221 ASP N N 15 15.1 0.17 . . . . . . . 52667 2 81 . 1 1 222 222 SER N N 15 15.9 0.17 . . . . . . . 52667 2 82 . 1 1 223 223 VAL N N 15 9.46 0.13 . . . . . . . 52667 2 83 . 1 1 224 224 LYS N N 15 6.98 0.15 . . . . . . . 52667 2 84 . 1 1 225 225 GLU N N 15 6.05 0.16 . . . . . . . 52667 2 85 . 1 1 226 226 THR N N 15 5.55 0.14 . . . . . . . 52667 2 86 . 1 1 227 227 ASP N N 15 4.36 0.25 . . . . . . . 52667 2 87 . 1 1 233 233 ALA N N 15 4.29 0.17 . . . . . . . 52667 2 88 . 1 1 234 234 ALA N N 15 4.14 0.15 . . . . . . . 52667 2 89 . 1 1 235 235 THR N N 15 5.95 0.13 . . . . . . . 52667 2 90 . 1 1 238 238 LYS N N 15 13.7 0.13 . . . . . . . 52667 2 91 . 1 1 239 239 LYS N N 15 26.1 0.69 . . . . . . . 52667 2 92 . 1 1 240 240 LYS N N 15 37.5 1.05 . . . . . . . 52667 2 93 . 1 1 241 241 SER N N 15 74 11.2 . . . . . . . 52667 2 94 . 1 1 242 242 LEU N N 15 45.8 40.8 . . . . . . . 52667 2 95 . 1 1 243 243 ILE N N 15 146 72.6 . . . . . . . 52667 2 96 . 1 1 245 245 GLN N N 15 102 86.4 . . . . . . . 52667 2 97 . 1 1 249 249 VAL N N 15 105 42.1 . . . . . . . 52667 2 98 . 1 1 251 251 PHE N N 15 92 3.12 . . . . . . . 52667 2 99 . 1 1 252 252 GLU N N 15 75.6 0.85 . . . . . . . 52667 2 100 . 1 1 253 253 THR N N 15 88.4 14.3 . . . . . . . 52667 2 101 . 1 1 254 254 THR N N 15 93.6 9.18 . . . . . . . 52667 2 102 . 1 1 255 255 MET N N 15 69 7.98 . . . . . . . 52667 2 103 . 1 1 256 256 LYS N N 15 81 9.46 . . . . . . . 52667 2 104 . 1 1 257 257 CYS N N 15 88.5 1.72 . . . . . . . 52667 2 105 . 1 1 258 258 THR N N 15 102 23.6 . . . . . . . 52667 2 106 . 1 1 259 259 GLU N N 15 76.7 134 . . . . . . . 52667 2 107 . 1 1 262 262 GLU N N 15 26.7 7.78 . . . . . . . 52667 2 108 . 1 1 263 263 GLU N N 15 -6.63 12.4 . . . . . . . 52667 2 109 . 1 1 264 264 GLU N N 15 78.6 4.59 . . . . . . . 52667 2 110 . 1 1 265 265 VAL N N 15 70.6 0.88 . . . . . . . 52667 2 111 . 1 1 266 266 THR N N 15 41 14.5 . . . . . . . 52667 2 112 . 1 1 267 267 LYS N N 15 71 2.59 . . . . . . . 52667 2 113 . 1 1 268 268 GLY N N 15 81.4 8.36 . . . . . . . 52667 2 114 . 1 1 269 269 LYS N N 15 73.7 9.27 . . . . . . . 52667 2 115 . 1 1 270 270 GLU N N 15 89.4 9.22 . . . . . . . 52667 2 116 . 1 1 271 271 ASN N N 15 76.9 17.3 . . . . . . . 52667 2 117 . 1 1 272 272 GLN N N 15 82 6.41 . . . . . . . 52667 2 118 . 1 1 274 274 GLN N N 15 35.2 517 . . . . . . . 52667 2 119 . 1 1 275 275 LEU N N 15 85.6 2.73 . . . . . . . 52667 2 120 . 1 1 276 276 SER N N 15 68.4 2.76 . . . . . . . 52667 2 121 . 1 1 277 277 CYS N N 15 73.7 0.7 . . . . . . . 52667 2 122 . 1 1 278 278 PHE N N 15 95.1 14.6 . . . . . . . 52667 2 123 . 1 1 279 279 ILE N N 15 30.5 2.86 . . . . . . . 52667 2 124 . 1 1 280 280 ASN N N 15 76.8 8.44 . . . . . . . 52667 2 125 . 1 1 282 282 GLU N N 15 61.5 16.4 . . . . . . . 52667 2 126 . 1 1 283 283 VAL N N 15 73 4.93 . . . . . . . 52667 2 127 . 1 1 286 286 LEU N N 15 96.4 43.7 . . . . . . . 52667 2 128 . 1 1 287 287 PHE N N 15 89.7 5.52 . . . . . . . 52667 2 129 . 1 1 288 288 THR N N 15 28.4 3.12 . . . . . . . 52667 2 130 . 1 1 289 289 GLY N N 15 86.2 13.9 . . . . . . . 52667 2 131 . 1 1 290 290 LEU N N 15 32.3 29.4 . . . . . . . 52667 2 132 . 1 1 291 291 LYS N N 15 110 19.2 . . . . . . . 52667 2 133 . 1 1 292 292 LEU N N 15 93.3 19.7 . . . . . . . 52667 2 134 . 1 1 293 293 ARG N N 15 78.2 4.02 . . . . . . . 52667 2 135 . 1 1 294 294 LEU N N 15 77.4 13.5 . . . . . . . 52667 2 136 . 1 1 295 295 GLN N N 15 68.8 8.29 . . . . . . . 52667 2 137 . 1 1 296 296 GLU N N 15 82.7 148 . . . . . . . 52667 2 138 . 1 1 297 297 GLU N N 15 73.7 1.19 . . . . . . . 52667 2 139 . 1 1 298 298 ILE N N 15 75.1 2.92 . . . . . . . 52667 2 140 . 1 1 299 299 THR N N 15 90.8 18.7 . . . . . . . 52667 2 141 . 1 1 300 300 LYS N N 15 77.4 2.07 . . . . . . . 52667 2 142 . 1 1 301 301 GLN N N 15 67.9 0.88 . . . . . . . 52667 2 143 . 1 1 302 302 SER N N 15 29 0.32 . . . . . . . 52667 2 144 . 1 1 306 306 GLN N N 15 80.2 88.9 . . . . . . . 52667 2 145 . 1 1 307 307 ARG N N 15 78 7.11 . . . . . . . 52667 2 146 . 1 1 309 309 ALA N N 15 71.8 2.77 . . . . . . . 52667 2 147 . 1 1 310 310 LEU N N 15 77.3 3.93 . . . . . . . 52667 2 148 . 1 1 311 311 TYR N N 15 71.8 4.77 . . . . . . . 52667 2 149 . 1 1 312 312 ILE N N 15 76.9 3.16 . . . . . . . 52667 2 150 . 1 1 313 313 LYS N N 15 83.8 16.6 . . . . . . . 52667 2 151 . 1 1 314 314 SER N N 15 80 3.96 . . . . . . . 52667 2 152 . 1 1 315 315 SER N N 15 78.2 2.39 . . . . . . . 52667 2 153 . 1 1 316 316 LYS N N 15 75.4 14.8 . . . . . . . 52667 2 154 . 1 1 317 317 ILE N N 15 81.2 24.6 . . . . . . . 52667 2 155 . 1 1 318 318 SER N N 15 126 236 . . . . . . . 52667 2 156 . 1 1 320 320 LEU N N 15 76.3 12.9 . . . . . . . 52667 2 157 . 1 1 325 325 THR N N 15 78.3 18.3 . . . . . . . 52667 2 158 . 1 1 327 327 GLN N N 15 81.7 8.83 . . . . . . . 52667 2 159 . 1 1 328 328 MET N N 15 71 4.79 . . . . . . . 52667 2 160 . 1 1 329 329 VAL N N 15 84.4 34.4 . . . . . . . 52667 2 161 . 1 1 330 330 ARG N N 15 74.3 4.54 . . . . . . . 52667 2 162 . 1 1 332 332 PHE N N 15 83 5.54 . . . . . . . 52667 2 163 . 1 1 333 333 TYR N N 15 72 6.83 . . . . . . . 52667 2 164 . 1 1 339 339 VAL N N 15 104 48.4 . . . . . . . 52667 2 165 . 1 1 340 340 ASN N N 15 14.8 1.79 . . . . . . . 52667 2 166 . 1 1 341 341 ALA N N 15 41.8 1.21 . . . . . . . 52667 2 167 . 1 1 342 342 LYS N N 15 66.4 0.88 . . . . . . . 52667 2 168 . 1 1 343 343 VAL N N 15 69.6 20.1 . . . . . . . 52667 2 169 . 1 1 345 345 LYS N N 15 95.3 18.9 . . . . . . . 52667 2 170 . 1 1 346 346 ASP N N 15 87.4 5.24 . . . . . . . 52667 2 171 . 1 1 347 347 VAL N N 15 6.57 2.17 . . . . . . . 52667 2 172 . 1 1 348 348 LYS N N 15 87.5 7.06 . . . . . . . 52667 2 173 . 1 1 349 349 PHE N N 15 88.5 4.54 . . . . . . . 52667 2 174 . 1 1 351 351 LEU N N 15 84.7 9.11 . . . . . . . 52667 2 175 . 1 1 352 352 MET N N 15 6.32 0.36 . . . . . . . 52667 2 176 . 1 1 353 353 LEU N N 15 83.3 12.2 . . . . . . . 52667 2 177 . 1 1 354 354 ASP N N 15 54.2 11.6 . . . . . . . 52667 2 178 . 1 1 356 356 TYR N N 15 10.5 0.13 . . . . . . . 52667 2 179 . 1 1 357 357 GLU N N 15 89.4 12.6 . . . . . . . 52667 2 180 . 1 1 358 358 LEU N N 15 107 32.9 . . . . . . . 52667 2 181 . 1 1 362 362 GLU N N 15 18.9 0.87 . . . . . . . 52667 2 182 . 1 1 363 363 LEU N N 15 78.6 15.1 . . . . . . . 52667 2 183 . 1 1 365 365 GLU N N 15 83.5 11.4 . . . . . . . 52667 2 184 . 1 1 366 366 LYS N N 15 88 14.8 . . . . . . . 52667 2 185 . 1 1 367 367 MET N N 15 59.2 15.6 . . . . . . . 52667 2 186 . 1 1 368 368 VAL N N 15 86.9 14.3 . . . . . . . 52667 2 187 . 1 1 370 370 PHE N N 15 101 4.58 . . . . . . . 52667 2 188 . 1 1 371 371 ARG N N 15 75.7 32.5 . . . . . . . 52667 2 189 . 1 1 372 372 SER N N 15 44.1 11.9 . . . . . . . 52667 2 190 . 1 1 373 373 LYS N N 15 85.7 5.38 . . . . . . . 52667 2 191 . 1 1 374 374 PHE N N 15 69.8 20.2 . . . . . . . 52667 2 192 . 1 1 375 375 LYS N N 15 48.1 1.35 . . . . . . . 52667 2 193 . 1 1 376 376 ASP N N 15 44.4 0.56 . . . . . . . 52667 2 194 . 1 1 377 377 LEU N N 15 43.4 0.92 . . . . . . . 52667 2 195 . 1 1 378 378 GLU N N 15 31.4 1.07 . . . . . . . 52667 2 196 . 1 1 379 379 ASP N N 15 31.8 0.68 . . . . . . . 52667 2 197 . 1 1 380 380 LYS N N 15 29.7 0.34 . . . . . . . 52667 2 198 . 1 1 381 381 LYS N N 15 24 0.35 . . . . . . . 52667 2 199 . 1 1 382 382 VAL N N 15 19.6 0.12 . . . . . . . 52667 2 200 . 1 1 385 385 GLN N N 15 7.96 0.14 . . . . . . . 52667 2 201 . 1 1 391 391 LYS N N 15 5.38 0.13 . . . . . . . 52667 2 202 . 1 1 392 392 LYS N N 15 5.47 0.12 . . . . . . . 52667 2 203 . 1 1 396 396 GLN N N 15 8.16 0.18 . . . . . . . 52667 2 204 . 1 1 397 397 LYS N N 15 12.1 0.09 . . . . . . . 52667 2 205 . 1 1 398 398 GLU N N 15 20.9 0.69 . . . . . . . 52667 2 206 . 1 1 399 399 VAL N N 15 34.6 0.69 . . . . . . . 52667 2 207 . 1 1 400 400 LYS N N 15 58.9 1.35 . . . . . . . 52667 2 208 . 1 1 401 401 TYR N N 15 70.3 4.19 . . . . . . . 52667 2 209 . 1 1 402 402 GLU N N 15 73.1 1.83 . . . . . . . 52667 2 210 . 1 1 404 404 PHE N N 15 82.2 14.1 . . . . . . . 52667 2 211 . 1 1 405 405 SER N N 15 91.4 20.4 . . . . . . . 52667 2 212 . 1 1 406 406 PHE N N 15 97.9 10 . . . . . . . 52667 2 213 . 1 1 408 408 ASP N N 15 108 49.1 . . . . . . . 52667 2 214 . 1 1 409 409 ASP N N 15 99.7 21.7 . . . . . . . 52667 2 215 . 1 1 410 410 ILE N N 15 76.1 5.59 . . . . . . . 52667 2 216 . 1 1 411 411 GLY N N 15 86.6 22.9 . . . . . . . 52667 2 217 . 1 1 412 412 SER N N 15 95.2 67.7 . . . . . . . 52667 2 218 . 1 1 413 413 ASN N N 15 88 4.98 . . . . . . . 52667 2 219 . 1 1 414 414 ASN N N 15 68.5 10.2 . . . . . . . 52667 2 220 . 1 1 416 416 GLY N N 15 16.4 0.56 . . . . . . . 52667 2 221 . 1 1 418 418 TYR N N 15 61.2 21.8 . . . . . . . 52667 2 222 . 1 1 425 425 THR N N 15 117 51.3 . . . . . . . 52667 2 223 . 1 1 426 426 HIS N N 15 119 108 . . . . . . . 52667 2 224 . 1 1 433 433 SER N N 15 91.1 46.4 . . . . . . . 52667 2 225 . 1 1 434 434 GLY N N 15 62.1 7.72 . . . . . . . 52667 2 226 . 1 1 435 435 HIS N N 15 107 348 . . . . . . . 52667 2 227 . 1 1 436 436 TYR N N 15 72.6 35.4 . . . . . . . 52667 2 228 . 1 1 438 438 SER N N 15 92.4 11.8 . . . . . . . 52667 2 229 . 1 1 439 439 TRP N N 15 86.5 6.84 . . . . . . . 52667 2 230 . 1 1 440 440 VAL N N 15 81.4 5.77 . . . . . . . 52667 2 231 . 1 1 441 441 LYS N N 15 111 38.3 . . . . . . . 52667 2 232 . 1 1 442 442 ARG N N 15 79.1 4.06 . . . . . . . 52667 2 233 . 1 1 443 443 LYS N N 15 13.8 0.63 . . . . . . . 52667 2 234 . 1 1 445 445 ASP N N 15 86.9 6.78 . . . . . . . 52667 2 235 . 1 1 446 446 GLU N N 15 26.4 2.4 . . . . . . . 52667 2 236 . 1 1 447 447 TRP N N 15 82.4 9.38 . . . . . . . 52667 2 237 . 1 1 448 448 ILE N N 15 75.8 4.74 . . . . . . . 52667 2 238 . 1 1 449 449 LYS N N 15 80 9.37 . . . . . . . 52667 2 239 . 1 1 450 450 PHE N N 15 82.3 5.42 . . . . . . . 52667 2 240 . 1 1 451 451 ASP N N 15 83.9 20.3 . . . . . . . 52667 2 241 . 1 1 452 452 ASP N N 15 57.3 465 . . . . . . . 52667 2 242 . 1 1 453 453 ASP N N 15 92.4 26 . . . . . . . 52667 2 243 . 1 1 454 454 LYS N N 15 26.3 1.61 . . . . . . . 52667 2 244 . 1 1 455 455 VAL N N 15 91.8 14.9 . . . . . . . 52667 2 245 . 1 1 456 456 SER N N 15 80.5 19.1 . . . . . . . 52667 2 246 . 1 1 457 457 ILE N N 15 32.1 14.1 . . . . . . . 52667 2 247 . 1 1 458 458 VAL N N 15 80.1 5.83 . . . . . . . 52667 2 248 . 1 1 459 459 THR N N 15 76.8 15.7 . . . . . . . 52667 2 249 . 1 1 461 461 GLU N N 15 74.5 7.82 . . . . . . . 52667 2 250 . 1 1 462 462 ASP N N 15 66 21.6 . . . . . . . 52667 2 251 . 1 1 463 463 ILE N N 15 78 33.9 . . . . . . . 52667 2 252 . 1 1 464 464 LEU N N 15 102 13.8 . . . . . . . 52667 2 253 . 1 1 465 465 ARG N N 15 75.5 20.4 . . . . . . . 52667 2 254 . 1 1 466 466 LEU N N 15 93 8.55 . . . . . . . 52667 2 255 . 1 1 467 467 SER N N 15 66.3 464 . . . . . . . 52667 2 256 . 1 1 469 469 GLY N N 15 93.9 21.6 . . . . . . . 52667 2 257 . 1 1 470 470 GLY N N 15 72.9 11.2 . . . . . . . 52667 2 258 . 1 1 472 472 TRP N N 15 70.2 6.18 . . . . . . . 52667 2 259 . 1 1 473 473 HIS N N 15 109 361 . . . . . . . 52667 2 260 . 1 1 474 474 ILE N N 15 11.9 1.51 . . . . . . . 52667 2 261 . 1 1 475 475 ALA N N 15 90.5 4.16 . . . . . . . 52667 2 262 . 1 1 476 476 TYR N N 15 76.1 14 . . . . . . . 52667 2 263 . 1 1 483 483 ARG N N 15 74.3 10.2 . . . . . . . 52667 2 264 . 1 1 484 484 ARG N N 15 53.3 3.3 . . . . . . . 52667 2 265 . 1 1 485 485 VAL N N 15 77.8 1.83 . . . . . . . 52667 2 266 . 1 1 486 486 GLU N N 15 70.9 4.47 . . . . . . . 52667 2 267 . 1 1 487 487 ILE N N 15 11.1 0.37 . . . . . . . 52667 2 268 . 1 1 488 488 MET N N 15 47.4 1.95 . . . . . . . 52667 2 269 . 1 1 489 489 GLU N N 15 18 0.19 . . . . . . . 52667 2 270 . 1 1 490 490 GLU N N 15 6.63 0.11 . . . . . . . 52667 2 271 . 1 1 491 491 GLU N N 15 6.63 0.11 . . . . . . . 52667 2 272 . 1 1 492 492 SER N N 15 3.4 0.18 . . . . . . . 52667 2 273 . 1 1 493 493 GLU N N 15 2.56 0.19 . . . . . . . 52667 2 274 . 1 1 494 494 GLN N N 15 1.53 0.11 . . . . . . . 52667 2 stop_ save_