data_16279 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16279 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the yeast Hsp90 Middle Domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-05-07 _Entry.Accession_date 2009-05-07 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'NMR backbone resonance assignment of yeast Hsp90 middle domain' _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.Entry_ID 1 Franz Hagn . . . 16279 2 Marco Retzlaff . . . 16279 3 Julia Rohrberg . . . 16279 4 Johannes Buchner . . . 16279 5 Horst Kessler . . . 16279 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Kessler group, TU Muenchen' . 16279 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16279 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 671 16279 '15N chemical shifts' 201 16279 '1H chemical shifts' 201 16279 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-05-16 2009-05-07 update BMRB 'update entry citation' 16279 1 . . 2011-08-31 2009-05-07 original author 'original release' 16279 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16279 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21892170 _Citation.Full_citation . _Citation.Title 'Structural analysis of the interaction between Hsp90 and the tumor suppressor protein p53.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Mol. Biol.' _Citation.Journal_name_full 'Nature structural & molecular biology' _Citation.Journal_volume 18 _Citation.Journal_issue 10 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1086 _Citation.Page_last 1093 _Citation.Year 2011 _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.Entry_ID _Citation_author.Citation_ID 1 Franz Hagn . . . 16279 1 2 Stephan Lagleder . . . 16279 1 3 Marco Retzlaff . . . 16279 1 4 Julia Rohrberg . . . 16279 1 5 Oliver Demmer . . . 16279 1 6 Klaus Richter . . . 16279 1 7 Johannes Buchner . . . 16279 1 8 Horst Kessler . . . 16279 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16279 _Assembly.ID 1 _Assembly.Name 'Hsp90 middle domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Hsp90 middle domain' 1 $Hsp90M A . yes native no no . . . 16279 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Hsp90M _Entity.Sf_category entity _Entity.Sf_framecode Hsp90M _Entity.Entry_ID 16279 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Hsp90M _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 ; GSHMKTKPLWTRNPSDITQE EYNAFYKSISNDWEDPLYVK HFSVEGQLEFRAILFIPKRA PFDLFESKKKKNNIKLYVRR VFITDEAEDLIPEWLSFVKG VVDSEDLPLNLSREMLQQNK IMKVIRKNIVKKLIEAFNEI AEDSEQFEKFYSAFSKNIKL GVHEDTQNRAALAKLLRYNS TKSVDELTSLTDYVTRMPEH QKNIYYITGESLKAVEKSPF LDALKAKNFEVLFLTDPIDE YAFTQLKEFEGKTLVDITKD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'residues 1-4 represent a clonig artifact after tag removal.' _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 260 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Yeast Hsp90 Middle Domain' _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 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PIR HHBY90 . "heat shock protein 90 - yeast" . . . . . . . . . . . . . . 16279 1 2 no PDB 1HK7 . "Middle Domain Of Hsp90" . . . . . 98.08 288 100.00 100.00 0.00e+00 . . . . 16279 1 3 no PDB 1USU . "The Structure Of The Complex Between Aha1 And Hsp90" . . . . . 98.08 260 99.61 100.00 0.00e+00 . . . . 16279 1 4 no PDB 1USV . "The Structure Of The Complex Between Aha1 And Hsp90" . . . . . 98.46 260 100.00 100.00 0.00e+00 . . . . 16279 1 5 no PDB 2CG9 . "Crystal Structure Of An Hsp90-Sba1 Closed Chaperone Complex" . . . . . 98.46 677 100.00 100.00 3.69e-180 . . . . 16279 1 6 no PDB 2CGE . "Crystal Structure Of An Hsp90-Sba1 Closed Chaperone Complex" . . . . . 98.08 405 100.00 100.00 0.00e+00 . . . . 16279 1 7 no DBJ GAA25634 . "K7_Hsc82p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 98.46 705 99.22 100.00 5.54e-179 . . . . 16279 1 8 no DBJ GAA26739 . "K7_Hsp82p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 98.46 709 99.61 99.61 3.93e-179 . . . . 16279 1 9 no EMBL CAA89919 . "Hsc82p [Saccharomyces cerevisiae]" . . . . . 98.46 705 99.22 100.00 5.54e-179 . . . . 16279 1 10 no EMBL CAA91604 . "HSP90/HSP82? [Saccharomyces cerevisiae]" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 11 no EMBL CAA97961 . "HSP82 [Saccharomyces cerevisiae]" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 12 no EMBL CAY82016 . "Hsc82p [Saccharomyces cerevisiae EC1118]" . . . . . 98.46 705 99.22 100.00 5.48e-179 . . . . 16279 1 13 no EMBL CAY86720 . "Hsp82p [Saccharomyces cerevisiae EC1118]" . . . . . 98.46 709 100.00 100.00 5.11e-180 . . . . 16279 1 14 no GB AAA02743 . "hsp82 protein [Saccharomyces cerevisiae]" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 15 no GB AAA02813 . "hsc82 protein [Saccharomyces cerevisiae]" . . . . . 98.46 705 99.22 100.00 6.67e-179 . . . . 16279 1 16 no GB AHY76639 . "Hsc82p [Saccharomyces cerevisiae YJM993]" . . . . . 98.46 705 100.00 100.00 6.53e-180 . . . . 16279 1 17 no GB AHY77944 . "Hsp82p [Saccharomyces cerevisiae YJM993]" . . . . . 98.46 705 100.00 100.00 8.56e-180 . . . . 16279 1 18 no GB AJP40879 . "Hsc82p [Saccharomyces cerevisiae YJM1078]" . . . . . 98.46 705 99.22 100.00 6.18e-179 . . . . 16279 1 19 no REF NP_013911 . "Hsp90 family chaperone HSC82 [Saccharomyces cerevisiae S288c]" . . . . . 98.46 705 99.22 100.00 5.54e-179 . . . . 16279 1 20 no REF NP_015084 . "Hsp90 family chaperone HSP82 [Saccharomyces cerevisiae S288c]" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 21 no SP P02829 . "RecName: Full=ATP-dependent molecular chaperone HSP82; AltName: Full=82 kDa heat shock protein; AltName: Full=Heat shock protei" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 22 no SP P15108 . "RecName: Full=ATP-dependent molecular chaperone HSC82; AltName: Full=82 kDa heat shock cognate protein; AltName: Full=Heat shoc" . . . . . 98.46 705 99.22 100.00 5.54e-179 . . . . 16279 1 23 no TPG DAA10084 . "TPA: Hsp90 family chaperone HSC82 [Saccharomyces cerevisiae S288c]" . . . . . 98.46 705 99.22 100.00 5.54e-179 . . . . 16279 1 24 no TPG DAA11197 . "TPA: Hsp90 family chaperone HSP82 [Saccharomyces cerevisiae S288c]" . . . . . 98.46 709 100.00 100.00 5.16e-180 . . . . 16279 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; Molecular chaperone that promotes the maturation, structural maintenance and proper regulation of specific target proteins involved in cell cycle control and signal transduction. Undergoes a functional cycle that is linked to its ATPase activity. The nucleotide-free form of the dimer is found in an open conformation in which the N-termini are not dimerized and the complex is ready for client protein binding. Binding of ATP induces large conformational changes, resulting in the formation of a ring-like closed structure in which the N-terminal domains associate intramolecularly with the middle domain and also dimerize with each other, stimulating their intrinsic ATPase activity and acting as a clamp on the substrate. Finally, ATP hydrolysis results in the release of the substrate. This cycle probably induces conformational changes in the client proteins, thereby causing their activation. Interacts dynamically with various co-chaperones that modulate its substrate recognition, ATPase cycle and chaperone function. Required for growth at high temperatures. ; 16279 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 268 GLY . 16279 1 2 269 SER . 16279 1 3 270 HIS . 16279 1 4 271 MET . 16279 1 5 272 LYS . 16279 1 6 273 THR . 16279 1 7 274 LYS . 16279 1 8 275 PRO . 16279 1 9 276 LEU . 16279 1 10 277 TRP . 16279 1 11 278 THR . 16279 1 12 279 ARG . 16279 1 13 280 ASN . 16279 1 14 281 PRO . 16279 1 15 282 SER . 16279 1 16 283 ASP . 16279 1 17 284 ILE . 16279 1 18 285 THR . 16279 1 19 286 GLN . 16279 1 20 287 GLU . 16279 1 21 288 GLU . 16279 1 22 289 TYR . 16279 1 23 290 ASN . 16279 1 24 291 ALA . 16279 1 25 292 PHE . 16279 1 26 293 TYR . 16279 1 27 294 LYS . 16279 1 28 295 SER . 16279 1 29 296 ILE . 16279 1 30 297 SER . 16279 1 31 298 ASN . 16279 1 32 299 ASP . 16279 1 33 300 TRP . 16279 1 34 301 GLU . 16279 1 35 302 ASP . 16279 1 36 303 PRO . 16279 1 37 304 LEU . 16279 1 38 305 TYR . 16279 1 39 306 VAL . 16279 1 40 307 LYS . 16279 1 41 308 HIS . 16279 1 42 309 PHE . 16279 1 43 310 SER . 16279 1 44 311 VAL . 16279 1 45 312 GLU . 16279 1 46 313 GLY . 16279 1 47 314 GLN . 16279 1 48 315 LEU . 16279 1 49 316 GLU . 16279 1 50 317 PHE . 16279 1 51 318 ARG . 16279 1 52 319 ALA . 16279 1 53 320 ILE . 16279 1 54 321 LEU . 16279 1 55 322 PHE . 16279 1 56 323 ILE . 16279 1 57 324 PRO . 16279 1 58 325 LYS . 16279 1 59 326 ARG . 16279 1 60 327 ALA . 16279 1 61 328 PRO . 16279 1 62 329 PHE . 16279 1 63 330 ASP . 16279 1 64 331 LEU . 16279 1 65 332 PHE . 16279 1 66 333 GLU . 16279 1 67 334 SER . 16279 1 68 335 LYS . 16279 1 69 336 LYS . 16279 1 70 337 LYS . 16279 1 71 338 LYS . 16279 1 72 339 ASN . 16279 1 73 340 ASN . 16279 1 74 341 ILE . 16279 1 75 342 LYS . 16279 1 76 343 LEU . 16279 1 77 344 TYR . 16279 1 78 345 VAL . 16279 1 79 346 ARG . 16279 1 80 347 ARG . 16279 1 81 348 VAL . 16279 1 82 349 PHE . 16279 1 83 350 ILE . 16279 1 84 351 THR . 16279 1 85 352 ASP . 16279 1 86 353 GLU . 16279 1 87 354 ALA . 16279 1 88 355 GLU . 16279 1 89 356 ASP . 16279 1 90 357 LEU . 16279 1 91 358 ILE . 16279 1 92 359 PRO . 16279 1 93 360 GLU . 16279 1 94 361 TRP . 16279 1 95 362 LEU . 16279 1 96 363 SER . 16279 1 97 364 PHE . 16279 1 98 365 VAL . 16279 1 99 366 LYS . 16279 1 100 367 GLY . 16279 1 101 368 VAL . 16279 1 102 369 VAL . 16279 1 103 370 ASP . 16279 1 104 371 SER . 16279 1 105 372 GLU . 16279 1 106 373 ASP . 16279 1 107 374 LEU . 16279 1 108 375 PRO . 16279 1 109 376 LEU . 16279 1 110 377 ASN . 16279 1 111 378 LEU . 16279 1 112 379 SER . 16279 1 113 380 ARG . 16279 1 114 381 GLU . 16279 1 115 382 MET . 16279 1 116 383 LEU . 16279 1 117 384 GLN . 16279 1 118 385 GLN . 16279 1 119 386 ASN . 16279 1 120 387 LYS . 16279 1 121 388 ILE . 16279 1 122 389 MET . 16279 1 123 390 LYS . 16279 1 124 391 VAL . 16279 1 125 392 ILE . 16279 1 126 393 ARG . 16279 1 127 394 LYS . 16279 1 128 395 ASN . 16279 1 129 396 ILE . 16279 1 130 397 VAL . 16279 1 131 398 LYS . 16279 1 132 399 LYS . 16279 1 133 400 LEU . 16279 1 134 401 ILE . 16279 1 135 402 GLU . 16279 1 136 403 ALA . 16279 1 137 404 PHE . 16279 1 138 405 ASN . 16279 1 139 406 GLU . 16279 1 140 407 ILE . 16279 1 141 408 ALA . 16279 1 142 409 GLU . 16279 1 143 410 ASP . 16279 1 144 411 SER . 16279 1 145 412 GLU . 16279 1 146 413 GLN . 16279 1 147 414 PHE . 16279 1 148 415 GLU . 16279 1 149 416 LYS . 16279 1 150 417 PHE . 16279 1 151 418 TYR . 16279 1 152 419 SER . 16279 1 153 420 ALA . 16279 1 154 421 PHE . 16279 1 155 422 SER . 16279 1 156 423 LYS . 16279 1 157 424 ASN . 16279 1 158 425 ILE . 16279 1 159 426 LYS . 16279 1 160 427 LEU . 16279 1 161 428 GLY . 16279 1 162 429 VAL . 16279 1 163 430 HIS . 16279 1 164 431 GLU . 16279 1 165 432 ASP . 16279 1 166 433 THR . 16279 1 167 434 GLN . 16279 1 168 435 ASN . 16279 1 169 436 ARG . 16279 1 170 437 ALA . 16279 1 171 438 ALA . 16279 1 172 439 LEU . 16279 1 173 440 ALA . 16279 1 174 441 LYS . 16279 1 175 442 LEU . 16279 1 176 443 LEU . 16279 1 177 444 ARG . 16279 1 178 445 TYR . 16279 1 179 446 ASN . 16279 1 180 447 SER . 16279 1 181 448 THR . 16279 1 182 449 LYS . 16279 1 183 450 SER . 16279 1 184 451 VAL . 16279 1 185 452 ASP . 16279 1 186 453 GLU . 16279 1 187 454 LEU . 16279 1 188 455 THR . 16279 1 189 456 SER . 16279 1 190 457 LEU . 16279 1 191 458 THR . 16279 1 192 459 ASP . 16279 1 193 460 TYR . 16279 1 194 461 VAL . 16279 1 195 462 THR . 16279 1 196 463 ARG . 16279 1 197 464 MET . 16279 1 198 465 PRO . 16279 1 199 466 GLU . 16279 1 200 467 HIS . 16279 1 201 468 GLN . 16279 1 202 469 LYS . 16279 1 203 470 ASN . 16279 1 204 471 ILE . 16279 1 205 472 TYR . 16279 1 206 473 TYR . 16279 1 207 474 ILE . 16279 1 208 475 THR . 16279 1 209 476 GLY . 16279 1 210 477 GLU . 16279 1 211 478 SER . 16279 1 212 479 LEU . 16279 1 213 480 LYS . 16279 1 214 481 ALA . 16279 1 215 482 VAL . 16279 1 216 483 GLU . 16279 1 217 484 LYS . 16279 1 218 485 SER . 16279 1 219 486 PRO . 16279 1 220 487 PHE . 16279 1 221 488 LEU . 16279 1 222 489 ASP . 16279 1 223 490 ALA . 16279 1 224 491 LEU . 16279 1 225 492 LYS . 16279 1 226 493 ALA . 16279 1 227 494 LYS . 16279 1 228 495 ASN . 16279 1 229 496 PHE . 16279 1 230 497 GLU . 16279 1 231 498 VAL . 16279 1 232 499 LEU . 16279 1 233 500 PHE . 16279 1 234 501 LEU . 16279 1 235 502 THR . 16279 1 236 503 ASP . 16279 1 237 504 PRO . 16279 1 238 505 ILE . 16279 1 239 506 ASP . 16279 1 240 507 GLU . 16279 1 241 508 TYR . 16279 1 242 509 ALA . 16279 1 243 510 PHE . 16279 1 244 511 THR . 16279 1 245 512 GLN . 16279 1 246 513 LEU . 16279 1 247 514 LYS . 16279 1 248 515 GLU . 16279 1 249 516 PHE . 16279 1 250 517 GLU . 16279 1 251 518 GLY . 16279 1 252 519 LYS . 16279 1 253 520 THR . 16279 1 254 521 LEU . 16279 1 255 522 VAL . 16279 1 256 523 ASP . 16279 1 257 524 ILE . 16279 1 258 525 THR . 16279 1 259 526 LYS . 16279 1 260 527 ASP . 16279 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 . GLY 1 1 16279 1 . SER 2 2 16279 1 . HIS 3 3 16279 1 . MET 4 4 16279 1 . LYS 5 5 16279 1 . THR 6 6 16279 1 . LYS 7 7 16279 1 . PRO 8 8 16279 1 . LEU 9 9 16279 1 . TRP 10 10 16279 1 . THR 11 11 16279 1 . ARG 12 12 16279 1 . ASN 13 13 16279 1 . PRO 14 14 16279 1 . SER 15 15 16279 1 . ASP 16 16 16279 1 . ILE 17 17 16279 1 . THR 18 18 16279 1 . GLN 19 19 16279 1 . GLU 20 20 16279 1 . GLU 21 21 16279 1 . TYR 22 22 16279 1 . ASN 23 23 16279 1 . ALA 24 24 16279 1 . PHE 25 25 16279 1 . TYR 26 26 16279 1 . LYS 27 27 16279 1 . SER 28 28 16279 1 . ILE 29 29 16279 1 . SER 30 30 16279 1 . ASN 31 31 16279 1 . ASP 32 32 16279 1 . TRP 33 33 16279 1 . GLU 34 34 16279 1 . ASP 35 35 16279 1 . PRO 36 36 16279 1 . LEU 37 37 16279 1 . TYR 38 38 16279 1 . VAL 39 39 16279 1 . LYS 40 40 16279 1 . HIS 41 41 16279 1 . PHE 42 42 16279 1 . SER 43 43 16279 1 . VAL 44 44 16279 1 . GLU 45 45 16279 1 . GLY 46 46 16279 1 . GLN 47 47 16279 1 . LEU 48 48 16279 1 . GLU 49 49 16279 1 . PHE 50 50 16279 1 . ARG 51 51 16279 1 . ALA 52 52 16279 1 . ILE 53 53 16279 1 . LEU 54 54 16279 1 . PHE 55 55 16279 1 . ILE 56 56 16279 1 . PRO 57 57 16279 1 . LYS 58 58 16279 1 . ARG 59 59 16279 1 . ALA 60 60 16279 1 . PRO 61 61 16279 1 . PHE 62 62 16279 1 . ASP 63 63 16279 1 . LEU 64 64 16279 1 . PHE 65 65 16279 1 . GLU 66 66 16279 1 . SER 67 67 16279 1 . LYS 68 68 16279 1 . LYS 69 69 16279 1 . LYS 70 70 16279 1 . LYS 71 71 16279 1 . ASN 72 72 16279 1 . ASN 73 73 16279 1 . ILE 74 74 16279 1 . LYS 75 75 16279 1 . LEU 76 76 16279 1 . TYR 77 77 16279 1 . VAL 78 78 16279 1 . ARG 79 79 16279 1 . ARG 80 80 16279 1 . VAL 81 81 16279 1 . PHE 82 82 16279 1 . ILE 83 83 16279 1 . THR 84 84 16279 1 . ASP 85 85 16279 1 . GLU 86 86 16279 1 . ALA 87 87 16279 1 . GLU 88 88 16279 1 . ASP 89 89 16279 1 . LEU 90 90 16279 1 . ILE 91 91 16279 1 . PRO 92 92 16279 1 . GLU 93 93 16279 1 . TRP 94 94 16279 1 . LEU 95 95 16279 1 . SER 96 96 16279 1 . PHE 97 97 16279 1 . VAL 98 98 16279 1 . LYS 99 99 16279 1 . GLY 100 100 16279 1 . VAL 101 101 16279 1 . VAL 102 102 16279 1 . ASP 103 103 16279 1 . SER 104 104 16279 1 . GLU 105 105 16279 1 . ASP 106 106 16279 1 . LEU 107 107 16279 1 . PRO 108 108 16279 1 . LEU 109 109 16279 1 . ASN 110 110 16279 1 . LEU 111 111 16279 1 . SER 112 112 16279 1 . ARG 113 113 16279 1 . GLU 114 114 16279 1 . MET 115 115 16279 1 . LEU 116 116 16279 1 . GLN 117 117 16279 1 . GLN 118 118 16279 1 . ASN 119 119 16279 1 . LYS 120 120 16279 1 . ILE 121 121 16279 1 . MET 122 122 16279 1 . LYS 123 123 16279 1 . VAL 124 124 16279 1 . ILE 125 125 16279 1 . ARG 126 126 16279 1 . LYS 127 127 16279 1 . ASN 128 128 16279 1 . ILE 129 129 16279 1 . VAL 130 130 16279 1 . LYS 131 131 16279 1 . LYS 132 132 16279 1 . LEU 133 133 16279 1 . ILE 134 134 16279 1 . GLU 135 135 16279 1 . ALA 136 136 16279 1 . PHE 137 137 16279 1 . ASN 138 138 16279 1 . GLU 139 139 16279 1 . ILE 140 140 16279 1 . ALA 141 141 16279 1 . GLU 142 142 16279 1 . ASP 143 143 16279 1 . SER 144 144 16279 1 . GLU 145 145 16279 1 . GLN 146 146 16279 1 . PHE 147 147 16279 1 . GLU 148 148 16279 1 . LYS 149 149 16279 1 . PHE 150 150 16279 1 . TYR 151 151 16279 1 . SER 152 152 16279 1 . ALA 153 153 16279 1 . PHE 154 154 16279 1 . SER 155 155 16279 1 . LYS 156 156 16279 1 . ASN 157 157 16279 1 . ILE 158 158 16279 1 . LYS 159 159 16279 1 . LEU 160 160 16279 1 . GLY 161 161 16279 1 . VAL 162 162 16279 1 . HIS 163 163 16279 1 . GLU 164 164 16279 1 . ASP 165 165 16279 1 . THR 166 166 16279 1 . GLN 167 167 16279 1 . ASN 168 168 16279 1 . ARG 169 169 16279 1 . ALA 170 170 16279 1 . ALA 171 171 16279 1 . LEU 172 172 16279 1 . ALA 173 173 16279 1 . LYS 174 174 16279 1 . LEU 175 175 16279 1 . LEU 176 176 16279 1 . ARG 177 177 16279 1 . TYR 178 178 16279 1 . ASN 179 179 16279 1 . SER 180 180 16279 1 . THR 181 181 16279 1 . LYS 182 182 16279 1 . SER 183 183 16279 1 . VAL 184 184 16279 1 . ASP 185 185 16279 1 . GLU 186 186 16279 1 . LEU 187 187 16279 1 . THR 188 188 16279 1 . SER 189 189 16279 1 . LEU 190 190 16279 1 . THR 191 191 16279 1 . ASP 192 192 16279 1 . TYR 193 193 16279 1 . VAL 194 194 16279 1 . THR 195 195 16279 1 . ARG 196 196 16279 1 . MET 197 197 16279 1 . PRO 198 198 16279 1 . GLU 199 199 16279 1 . HIS 200 200 16279 1 . GLN 201 201 16279 1 . LYS 202 202 16279 1 . ASN 203 203 16279 1 . ILE 204 204 16279 1 . TYR 205 205 16279 1 . TYR 206 206 16279 1 . ILE 207 207 16279 1 . THR 208 208 16279 1 . GLY 209 209 16279 1 . GLU 210 210 16279 1 . SER 211 211 16279 1 . LEU 212 212 16279 1 . LYS 213 213 16279 1 . ALA 214 214 16279 1 . VAL 215 215 16279 1 . GLU 216 216 16279 1 . LYS 217 217 16279 1 . SER 218 218 16279 1 . PRO 219 219 16279 1 . PHE 220 220 16279 1 . LEU 221 221 16279 1 . ASP 222 222 16279 1 . ALA 223 223 16279 1 . LEU 224 224 16279 1 . LYS 225 225 16279 1 . ALA 226 226 16279 1 . LYS 227 227 16279 1 . ASN 228 228 16279 1 . PHE 229 229 16279 1 . GLU 230 230 16279 1 . VAL 231 231 16279 1 . LEU 232 232 16279 1 . PHE 233 233 16279 1 . LEU 234 234 16279 1 . THR 235 235 16279 1 . ASP 236 236 16279 1 . PRO 237 237 16279 1 . ILE 238 238 16279 1 . ASP 239 239 16279 1 . GLU 240 240 16279 1 . TYR 241 241 16279 1 . ALA 242 242 16279 1 . PHE 243 243 16279 1 . THR 244 244 16279 1 . GLN 245 245 16279 1 . LEU 246 246 16279 1 . LYS 247 247 16279 1 . GLU 248 248 16279 1 . PHE 249 249 16279 1 . GLU 250 250 16279 1 . GLY 251 251 16279 1 . LYS 252 252 16279 1 . THR 253 253 16279 1 . LEU 254 254 16279 1 . VAL 255 255 16279 1 . ASP 256 256 16279 1 . ILE 257 257 16279 1 . THR 258 258 16279 1 . LYS 259 259 16279 1 . ASP 260 260 16279 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16279 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Hsp90M . 4932 organism . 'Saccharomyces cerevisiae' 'baker's yeast' . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 16279 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 16279 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Hsp90M . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pET28a . . . 'cleavable N-terminal hexahistidine tag' . . 16279 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16279 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 Hsp90M '[U-99% 13C; U-99% 15N; U-95% 2H]' . . 1 $Hsp90M . . 1.2 . . mM 0.2 . . . 16279 1 2 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 16279 1 3 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16279 1 4 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16279 1 5 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16279 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16279 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 0.02 M 16279 1 pH 7.5 0.1 pH 16279 1 pressure 1 . atm 16279 1 temperature 298 1 K 16279 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16279 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' 'Rheinstetten, Germany' . 16279 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16279 1 processing 16279 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 16279 _Software.ID 2 _Software.Name SPARKY _Software.Version 2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard 'UCSF, San Francisco' . 16279 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16279 2 'peak picking' 16279 2 stop_ save_ save_PASTA _Software.Sf_category software _Software.Sf_framecode PASTA _Software.Entry_ID 16279 _Software.ID 3 _Software.Name PASTA _Software.Version 0.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kessler 'TUM, Munich' . 16279 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16279 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_DMX750 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode DMX750 _NMR_spectrometer.Entry_ID 16279 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16279 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 DMX750 Bruker DMX . 750 . . . 16279 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16279 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 3 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 7 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 8 '3D HN(CO)CACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $DMX750 . . . . . . . . . . . . . . . . 16279 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16279 _Chem_shift_reference.ID 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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16279 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16279 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16279 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16279 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16279 1 2 '2D 1H-13C HSQC' . . . 16279 1 3 '3D HN(CO)CA' . . . 16279 1 4 '3D HNCACB' . . . 16279 1 5 '3D HNCO' . . . 16279 1 6 '3D HNCA' . . . 16279 1 7 '3D HN(CA)CO' . . . 16279 1 8 '3D HN(CO)CACB' . . . 16279 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 9 9 LEU C C 13 176.81 0.05 . 1 . . . . 276 LEU C . 16279 1 2 . 1 1 9 9 LEU CA C 13 57.95 0.05 . 1 . . . . 276 LEU CA . 16279 1 3 . 1 1 9 9 LEU CB C 13 41.29 0.05 . 1 . . . . 276 LEU CB . 16279 1 4 . 1 1 10 10 TRP H H 1 6.21 0.02 . 1 . . . . 277 TRP H . 16279 1 5 . 1 1 10 10 TRP CA C 13 58.84 0.05 . 1 . . . . 277 TRP CA . 16279 1 6 . 1 1 10 10 TRP CB C 13 26.36 0.05 . 1 . . . . 277 TRP CB . 16279 1 7 . 1 1 10 10 TRP N N 15 106.57 0.05 . 1 . . . . 277 TRP N . 16279 1 8 . 1 1 11 11 THR H H 1 7.07 0.02 . 1 . . . . 278 THR H . 16279 1 9 . 1 1 11 11 THR C C 13 174.14 0.05 . 1 . . . . 278 THR C . 16279 1 10 . 1 1 11 11 THR CA C 13 61.98 0.05 . 1 . . . . 278 THR CA . 16279 1 11 . 1 1 11 11 THR CB C 13 68.61 0.05 . 1 . . . . 278 THR CB . 16279 1 12 . 1 1 11 11 THR N N 15 112.32 0.05 . 1 . . . . 278 THR N . 16279 1 13 . 1 1 12 12 ARG H H 1 6.96 0.02 . 1 . . . . 279 ARG H . 16279 1 14 . 1 1 12 12 ARG C C 13 174.86 0.05 . 1 . . . . 279 ARG C . 16279 1 15 . 1 1 12 12 ARG CA C 13 54.86 0.05 . 1 . . . . 279 ARG CA . 16279 1 16 . 1 1 12 12 ARG CB C 13 30.16 0.05 . 1 . . . . 279 ARG CB . 16279 1 17 . 1 1 12 12 ARG N N 15 122.78 0.05 . 1 . . . . 279 ARG N . 16279 1 18 . 1 1 13 13 ASN H H 1 8.56 0.02 . 1 . . . . 280 ASN H . 16279 1 19 . 1 1 13 13 ASN C C 13 174.80 0.05 . 1 . . . . 280 ASN C . 16279 1 20 . 1 1 13 13 ASN CA C 13 50.67 0.05 . 1 . . . . 280 ASN CA . 16279 1 21 . 1 1 13 13 ASN CB C 13 37.64 0.05 . 1 . . . . 280 ASN CB . 16279 1 22 . 1 1 13 13 ASN N N 15 120.91 0.05 . 1 . . . . 280 ASN N . 16279 1 23 . 1 1 14 14 PRO CA C 13 64.89 0.05 . 1 . . . . 281 PRO CA . 16279 1 24 . 1 1 14 14 PRO CB C 13 31.21 0.05 . 1 . . . . 281 PRO CB . 16279 1 25 . 1 1 15 15 SER H H 1 7.86 0.02 . 1 . . . . 282 SER H . 16279 1 26 . 1 1 15 15 SER C C 13 174.90 0.05 . 1 . . . . 282 SER C . 16279 1 27 . 1 1 15 15 SER CA C 13 59.94 0.05 . 1 . . . . 282 SER CA . 16279 1 28 . 1 1 15 15 SER CB C 13 62.06 0.05 . 1 . . . . 282 SER CB . 16279 1 29 . 1 1 15 15 SER N N 15 109.28 0.05 . 1 . . . . 282 SER N . 16279 1 30 . 1 1 16 16 ASP H H 1 8.05 0.02 . 1 . . . . 283 ASP H . 16279 1 31 . 1 1 16 16 ASP C C 13 175.00 0.05 . 1 . . . . 283 ASP C . 16279 1 32 . 1 1 16 16 ASP CA C 13 53.66 0.05 . 1 . . . . 283 ASP CA . 16279 1 33 . 1 1 16 16 ASP CB C 13 42.07 0.05 . 1 . . . . 283 ASP CB . 16279 1 34 . 1 1 16 16 ASP N N 15 120.46 0.05 . 1 . . . . 283 ASP N . 16279 1 35 . 1 1 17 17 ILE H H 1 7.06 0.02 . 1 . . . . 284 ILE H . 16279 1 36 . 1 1 17 17 ILE C C 13 176.11 0.05 . 1 . . . . 284 ILE C . 16279 1 37 . 1 1 17 17 ILE CA C 13 60.76 0.05 . 1 . . . . 284 ILE CA . 16279 1 38 . 1 1 17 17 ILE CB C 13 38.55 0.05 . 1 . . . . 284 ILE CB . 16279 1 39 . 1 1 17 17 ILE N N 15 122.65 0.05 . 1 . . . . 284 ILE N . 16279 1 40 . 1 1 18 18 THR H H 1 8.39 0.02 . 1 . . . . 285 THR H . 16279 1 41 . 1 1 18 18 THR C C 13 175.68 0.05 . 1 . . . . 285 THR C . 16279 1 42 . 1 1 18 18 THR CA C 13 60.27 0.05 . 1 . . . . 285 THR CA . 16279 1 43 . 1 1 18 18 THR CB C 13 70.67 0.05 . 1 . . . . 285 THR CB . 16279 1 44 . 1 1 18 18 THR N N 15 118.43 0.05 . 1 . . . . 285 THR N . 16279 1 45 . 1 1 19 19 GLN H H 1 8.95 0.02 . 1 . . . . 286 GLN H . 16279 1 46 . 1 1 19 19 GLN C C 13 178.10 0.05 . 1 . . . . 286 GLN C . 16279 1 47 . 1 1 19 19 GLN CA C 13 58.84 0.05 . 1 . . . . 286 GLN CA . 16279 1 48 . 1 1 19 19 GLN CB C 13 27.31 0.05 . 1 . . . . 286 GLN CB . 16279 1 49 . 1 1 19 19 GLN N N 15 121.83 0.05 . 1 . . . . 286 GLN N . 16279 1 50 . 1 1 20 20 GLU H H 1 8.67 0.02 . 1 . . . . 287 GLU H . 16279 1 51 . 1 1 20 20 GLU C C 13 179.59 0.05 . 1 . . . . 287 GLU C . 16279 1 52 . 1 1 20 20 GLU CA C 13 59.56 0.05 . 1 . . . . 287 GLU CA . 16279 1 53 . 1 1 20 20 GLU CB C 13 27.77 0.05 . 1 . . . . 287 GLU CB . 16279 1 54 . 1 1 20 20 GLU N N 15 117.20 0.05 . 1 . . . . 287 GLU N . 16279 1 55 . 1 1 21 21 GLU H H 1 7.64 0.02 . 1 . . . . 288 GLU H . 16279 1 56 . 1 1 21 21 GLU C C 13 180.78 0.05 . 1 . . . . 288 GLU C . 16279 1 57 . 1 1 21 21 GLU CA C 13 59.32 0.05 . 1 . . . . 288 GLU CA . 16279 1 58 . 1 1 21 21 GLU CB C 13 29.45 0.05 . 1 . . . . 288 GLU CB . 16279 1 59 . 1 1 21 21 GLU N N 15 120.70 0.05 . 1 . . . . 288 GLU N . 16279 1 60 . 1 1 22 22 TYR H H 1 7.85 0.02 . 1 . . . . 289 TYR H . 16279 1 61 . 1 1 22 22 TYR C C 13 178.38 0.05 . 1 . . . . 289 TYR C . 16279 1 62 . 1 1 22 22 TYR CA C 13 62.00 0.05 . 1 . . . . 289 TYR CA . 16279 1 63 . 1 1 22 22 TYR CB C 13 37.60 0.05 . 1 . . . . 289 TYR CB . 16279 1 64 . 1 1 22 22 TYR N N 15 120.40 0.05 . 1 . . . . 289 TYR N . 16279 1 65 . 1 1 23 23 ASN H H 1 8.85 0.02 . 1 . . . . 290 ASN H . 16279 1 66 . 1 1 23 23 ASN C C 13 177.62 0.05 . 1 . . . . 290 ASN C . 16279 1 67 . 1 1 23 23 ASN CA C 13 55.67 0.05 . 1 . . . . 290 ASN CA . 16279 1 68 . 1 1 23 23 ASN CB C 13 36.25 0.05 . 1 . . . . 290 ASN CB . 16279 1 69 . 1 1 23 23 ASN N N 15 119.90 0.05 . 1 . . . . 290 ASN N . 16279 1 70 . 1 1 24 24 ALA H H 1 8.11 0.02 . 1 . . . . 291 ALA H . 16279 1 71 . 1 1 24 24 ALA C C 13 180.72 0.05 . 1 . . . . 291 ALA C . 16279 1 72 . 1 1 24 24 ALA CA C 13 54.39 0.05 . 1 . . . . 291 ALA CA . 16279 1 73 . 1 1 24 24 ALA CB C 13 17.14 0.05 . 1 . . . . 291 ALA CB . 16279 1 74 . 1 1 24 24 ALA N N 15 121.92 0.05 . 1 . . . . 291 ALA N . 16279 1 75 . 1 1 25 25 PHE H H 1 8.00 0.02 . 1 . . . . 292 PHE H . 16279 1 76 . 1 1 25 25 PHE C C 13 178.19 0.05 . 1 . . . . 292 PHE C . 16279 1 77 . 1 1 25 25 PHE CA C 13 60.55 0.05 . 1 . . . . 292 PHE CA . 16279 1 78 . 1 1 25 25 PHE CB C 13 38.91 0.05 . 1 . . . . 292 PHE CB . 16279 1 79 . 1 1 25 25 PHE N N 15 121.39 0.05 . 1 . . . . 292 PHE N . 16279 1 80 . 1 1 26 26 TYR H H 1 8.54 0.02 . 1 . . . . 293 TYR H . 16279 1 81 . 1 1 26 26 TYR C C 13 178.77 0.05 . 1 . . . . 293 TYR C . 16279 1 82 . 1 1 26 26 TYR CA C 13 60.47 0.05 . 1 . . . . 293 TYR CA . 16279 1 83 . 1 1 26 26 TYR CB C 13 35.70 0.05 . 1 . . . . 293 TYR CB . 16279 1 84 . 1 1 26 26 TYR N N 15 120.77 0.05 . 1 . . . . 293 TYR N . 16279 1 85 . 1 1 27 27 LYS H H 1 7.86 0.02 . 1 . . . . 294 LYS H . 16279 1 86 . 1 1 27 27 LYS C C 13 178.22 0.05 . 1 . . . . 294 LYS C . 16279 1 87 . 1 1 27 27 LYS CA C 13 59.84 0.05 . 1 . . . . 294 LYS CA . 16279 1 88 . 1 1 27 27 LYS CB C 13 30.95 0.05 . 1 . . . . 294 LYS CB . 16279 1 89 . 1 1 27 27 LYS N N 15 121.41 0.05 . 1 . . . . 294 LYS N . 16279 1 90 . 1 1 28 28 SER H H 1 7.57 0.02 . 1 . . . . 295 SER H . 16279 1 91 . 1 1 28 28 SER C C 13 176.00 0.05 . 1 . . . . 295 SER C . 16279 1 92 . 1 1 28 28 SER CA C 13 60.35 0.05 . 1 . . . . 295 SER CA . 16279 1 93 . 1 1 28 28 SER CB C 13 62.33 0.05 . 1 . . . . 295 SER CB . 16279 1 94 . 1 1 28 28 SER N N 15 114.65 0.05 . 1 . . . . 295 SER N . 16279 1 95 . 1 1 29 29 ILE H H 1 7.07 0.02 . 1 . . . . 296 ILE H . 16279 1 96 . 1 1 29 29 ILE C C 13 176.06 0.05 . 1 . . . . 296 ILE C . 16279 1 97 . 1 1 29 29 ILE CA C 13 61.41 0.05 . 1 . . . . 296 ILE CA . 16279 1 98 . 1 1 29 29 ILE CB C 13 37.77 0.05 . 1 . . . . 296 ILE CB . 16279 1 99 . 1 1 29 29 ILE N N 15 112.89 0.05 . 1 . . . . 296 ILE N . 16279 1 100 . 1 1 30 30 SER H H 1 7.41 0.02 . 1 . . . . 297 SER H . 16279 1 101 . 1 1 30 30 SER C C 13 174.39 0.05 . 1 . . . . 297 SER C . 16279 1 102 . 1 1 30 30 SER CA C 13 57.90 0.05 . 1 . . . . 297 SER CA . 16279 1 103 . 1 1 30 30 SER CB C 13 65.42 0.05 . 1 . . . . 297 SER CB . 16279 1 104 . 1 1 30 30 SER N N 15 115.57 0.05 . 1 . . . . 297 SER N . 16279 1 105 . 1 1 31 31 ASN C C 13 178.53 0.05 . 1 . . . . 298 ASN C . 16279 1 106 . 1 1 31 31 ASN CA C 13 56.42 0.05 . 1 . . . . 298 ASN CA . 16279 1 107 . 1 1 31 31 ASN CB C 13 36.14 0.05 . 1 . . . . 298 ASN CB . 16279 1 108 . 1 1 32 32 ASP H H 1 8.10 0.02 . 1 . . . . 299 ASP H . 16279 1 109 . 1 1 32 32 ASP C C 13 178.23 0.05 . 1 . . . . 299 ASP C . 16279 1 110 . 1 1 32 32 ASP CA C 13 56.98 0.05 . 1 . . . . 299 ASP CA . 16279 1 111 . 1 1 32 32 ASP CB C 13 40.34 0.05 . 1 . . . . 299 ASP CB . 16279 1 112 . 1 1 32 32 ASP N N 15 121.71 0.05 . 1 . . . . 299 ASP N . 16279 1 113 . 1 1 33 33 TRP H H 1 7.62 0.02 . 1 . . . . 300 TRP H . 16279 1 114 . 1 1 33 33 TRP C C 13 176.72 0.05 . 1 . . . . 300 TRP C . 16279 1 115 . 1 1 33 33 TRP CA C 13 57.22 0.05 . 1 . . . . 300 TRP CA . 16279 1 116 . 1 1 33 33 TRP CB C 13 27.70 0.05 . 1 . . . . 300 TRP CB . 16279 1 117 . 1 1 33 33 TRP N N 15 116.43 0.05 . 1 . . . . 300 TRP N . 16279 1 118 . 1 1 34 34 GLU H H 1 7.51 0.02 . 1 . . . . 301 GLU H . 16279 1 119 . 1 1 34 34 GLU C C 13 175.57 0.05 . 1 . . . . 301 GLU C . 16279 1 120 . 1 1 34 34 GLU CA C 13 55.04 0.05 . 1 . . . . 301 GLU CA . 16279 1 121 . 1 1 34 34 GLU CB C 13 27.89 0.05 . 1 . . . . 301 GLU CB . 16279 1 122 . 1 1 34 34 GLU N N 15 115.54 0.05 . 1 . . . . 301 GLU N . 16279 1 123 . 1 1 36 36 PRO CA C 13 62.09 0.05 . 1 . . . . 303 PRO CA . 16279 1 124 . 1 1 36 36 PRO CB C 13 29.21 0.05 . 1 . . . . 303 PRO CB . 16279 1 125 . 1 1 37 37 LEU H H 1 8.65 0.02 . 1 . . . . 304 LEU H . 16279 1 126 . 1 1 37 37 LEU C C 13 176.80 0.05 . 1 . . . . 304 LEU C . 16279 1 127 . 1 1 37 37 LEU CA C 13 56.51 0.05 . 1 . . . . 304 LEU CA . 16279 1 128 . 1 1 37 37 LEU CB C 13 42.41 0.05 . 1 . . . . 304 LEU CB . 16279 1 129 . 1 1 37 37 LEU N N 15 122.76 0.05 . 1 . . . . 304 LEU N . 16279 1 130 . 1 1 38 38 TYR C C 13 172.29 0.05 . 1 . . . . 305 TYR C . 16279 1 131 . 1 1 38 38 TYR CA C 13 57.56 0.05 . 1 . . . . 305 TYR CA . 16279 1 132 . 1 1 38 38 TYR CB C 13 43.76 0.05 . 1 . . . . 305 TYR CB . 16279 1 133 . 1 1 39 39 VAL H H 1 6.93 0.02 . 1 . . . . 306 VAL H . 16279 1 134 . 1 1 39 39 VAL C C 13 171.97 0.05 . 1 . . . . 306 VAL C . 16279 1 135 . 1 1 39 39 VAL CA C 13 59.38 0.05 . 1 . . . . 306 VAL CA . 16279 1 136 . 1 1 39 39 VAL CB C 13 33.08 0.05 . 1 . . . . 306 VAL CB . 16279 1 137 . 1 1 39 39 VAL N N 15 125.62 0.05 . 1 . . . . 306 VAL N . 16279 1 138 . 1 1 40 40 LYS H H 1 8.76 0.02 . 1 . . . . 307 LYS H . 16279 1 139 . 1 1 40 40 LYS C C 13 172.08 0.05 . 1 . . . . 307 LYS C . 16279 1 140 . 1 1 40 40 LYS CA C 13 52.30 0.05 . 1 . . . . 307 LYS CA . 16279 1 141 . 1 1 40 40 LYS CB C 13 32.52 0.05 . 1 . . . . 307 LYS CB . 16279 1 142 . 1 1 40 40 LYS N N 15 126.96 0.05 . 1 . . . . 307 LYS N . 16279 1 143 . 1 1 41 41 HIS H H 1 9.13 0.02 . 1 . . . . 308 HIS H . 16279 1 144 . 1 1 41 41 HIS C C 13 173.77 0.05 . 1 . . . . 308 HIS C . 16279 1 145 . 1 1 41 41 HIS CA C 13 51.43 0.05 . 1 . . . . 308 HIS CA . 16279 1 146 . 1 1 41 41 HIS CB C 13 33.52 0.05 . 1 . . . . 308 HIS CB . 16279 1 147 . 1 1 41 41 HIS N N 15 131.50 0.05 . 1 . . . . 308 HIS N . 16279 1 148 . 1 1 42 42 PHE H H 1 8.83 0.02 . 1 . . . . 309 PHE H . 16279 1 149 . 1 1 42 42 PHE C C 13 171.05 0.05 . 1 . . . . 309 PHE C . 16279 1 150 . 1 1 42 42 PHE CA C 13 54.98 0.05 . 1 . . . . 309 PHE CA . 16279 1 151 . 1 1 42 42 PHE CB C 13 40.75 0.05 . 1 . . . . 309 PHE CB . 16279 1 152 . 1 1 42 42 PHE N N 15 122.42 0.05 . 1 . . . . 309 PHE N . 16279 1 153 . 1 1 43 43 SER H H 1 8.38 0.02 . 1 . . . . 310 SER H . 16279 1 154 . 1 1 43 43 SER C C 13 172.65 0.05 . 1 . . . . 310 SER C . 16279 1 155 . 1 1 43 43 SER CA C 13 55.64 0.05 . 1 . . . . 310 SER CA . 16279 1 156 . 1 1 43 43 SER CB C 13 65.27 0.05 . 1 . . . . 310 SER CB . 16279 1 157 . 1 1 43 43 SER N N 15 113.33 0.05 . 1 . . . . 310 SER N . 16279 1 158 . 1 1 44 44 VAL H H 1 8.47 0.02 . 1 . . . . 311 VAL H . 16279 1 159 . 1 1 44 44 VAL C C 13 174.00 0.05 . 1 . . . . 311 VAL C . 16279 1 160 . 1 1 44 44 VAL CA C 13 61.37 0.05 . 1 . . . . 311 VAL CA . 16279 1 161 . 1 1 44 44 VAL CB C 13 32.92 0.05 . 1 . . . . 311 VAL CB . 16279 1 162 . 1 1 44 44 VAL N N 15 124.82 0.05 . 1 . . . . 311 VAL N . 16279 1 163 . 1 1 45 45 GLU H H 1 8.17 0.02 . 1 . . . . 312 GLU H . 16279 1 164 . 1 1 45 45 GLU C C 13 175.39 0.05 . 1 . . . . 312 GLU C . 16279 1 165 . 1 1 45 45 GLU CA C 13 54.47 0.05 . 1 . . . . 312 GLU CA . 16279 1 166 . 1 1 45 45 GLU CB C 13 31.79 0.05 . 1 . . . . 312 GLU CB . 16279 1 167 . 1 1 45 45 GLU N N 15 124.96 0.05 . 1 . . . . 312 GLU N . 16279 1 168 . 1 1 46 46 GLY H H 1 8.44 0.02 . 1 . . . . 313 GLY H . 16279 1 169 . 1 1 46 46 GLY C C 13 173.52 0.05 . 1 . . . . 313 GLY C . 16279 1 170 . 1 1 46 46 GLY CA C 13 44.50 0.05 . 1 . . . . 313 GLY CA . 16279 1 171 . 1 1 46 46 GLY N N 15 110.22 0.05 . 1 . . . . 313 GLY N . 16279 1 172 . 1 1 47 47 GLN C C 13 175.24 0.05 . 1 . . . . 314 GLN C . 16279 1 173 . 1 1 47 47 GLN CA C 13 57.79 0.05 . 1 . . . . 314 GLN CA . 16279 1 174 . 1 1 47 47 GLN CB C 13 27.66 0.05 . 1 . . . . 314 GLN CB . 16279 1 175 . 1 1 48 48 LEU H H 1 7.48 0.02 . 1 . . . . 315 LEU H . 16279 1 176 . 1 1 48 48 LEU C C 13 174.36 0.05 . 1 . . . . 315 LEU C . 16279 1 177 . 1 1 48 48 LEU CA C 13 53.37 0.05 . 1 . . . . 315 LEU CA . 16279 1 178 . 1 1 48 48 LEU CB C 13 42.72 0.05 . 1 . . . . 315 LEU CB . 16279 1 179 . 1 1 48 48 LEU N N 15 118.48 0.05 . 1 . . . . 315 LEU N . 16279 1 180 . 1 1 49 49 GLU H H 1 9.03 0.02 . 1 . . . . 316 GLU H . 16279 1 181 . 1 1 49 49 GLU C C 13 176.59 0.05 . 1 . . . . 316 GLU C . 16279 1 182 . 1 1 49 49 GLU CA C 13 53.84 0.05 . 1 . . . . 316 GLU CA . 16279 1 183 . 1 1 49 49 GLU CB C 13 30.87 0.05 . 1 . . . . 316 GLU CB . 16279 1 184 . 1 1 49 49 GLU N N 15 122.16 0.05 . 1 . . . . 316 GLU N . 16279 1 185 . 1 1 50 50 PHE H H 1 8.35 0.02 . 1 . . . . 317 PHE H . 16279 1 186 . 1 1 50 50 PHE C C 13 171.25 0.05 . 1 . . . . 317 PHE C . 16279 1 187 . 1 1 50 50 PHE CA C 13 56.20 0.05 . 1 . . . . 317 PHE CA . 16279 1 188 . 1 1 50 50 PHE CB C 13 39.88 0.05 . 1 . . . . 317 PHE CB . 16279 1 189 . 1 1 50 50 PHE N N 15 120.70 0.05 . 1 . . . . 317 PHE N . 16279 1 190 . 1 1 51 51 ARG H H 1 8.43 0.02 . 1 . . . . 318 ARG H . 16279 1 191 . 1 1 51 51 ARG C C 13 174.15 0.05 . 1 . . . . 318 ARG C . 16279 1 192 . 1 1 51 51 ARG CA C 13 53.95 0.05 . 1 . . . . 318 ARG CA . 16279 1 193 . 1 1 51 51 ARG CB C 13 33.59 0.05 . 1 . . . . 318 ARG CB . 16279 1 194 . 1 1 51 51 ARG N N 15 117.71 0.05 . 1 . . . . 318 ARG N . 16279 1 195 . 1 1 52 52 ALA H H 1 8.32 0.02 . 1 . . . . 319 ALA H . 16279 1 196 . 1 1 52 52 ALA C C 13 175.20 0.05 . 1 . . . . 319 ALA C . 16279 1 197 . 1 1 52 52 ALA CA C 13 50.30 0.05 . 1 . . . . 319 ALA CA . 16279 1 198 . 1 1 52 52 ALA CB C 13 22.28 0.05 . 1 . . . . 319 ALA CB . 16279 1 199 . 1 1 52 52 ALA N N 15 120.92 0.05 . 1 . . . . 319 ALA N . 16279 1 200 . 1 1 57 57 PRO CA C 13 62.16 0.05 . 1 . . . . 324 PRO CA . 16279 1 201 . 1 1 57 57 PRO CB C 13 32.68 0.05 . 1 . . . . 324 PRO CB . 16279 1 202 . 1 1 58 58 LYS H H 1 9.16 0.02 . 1 . . . . 325 LYS H . 16279 1 203 . 1 1 58 58 LYS C C 13 176.07 0.05 . 1 . . . . 325 LYS C . 16279 1 204 . 1 1 58 58 LYS CA C 13 58.45 0.05 . 1 . . . . 325 LYS CA . 16279 1 205 . 1 1 58 58 LYS CB C 13 32.58 0.05 . 1 . . . . 325 LYS CB . 16279 1 206 . 1 1 58 58 LYS N N 15 115.24 0.05 . 1 . . . . 325 LYS N . 16279 1 207 . 1 1 59 59 ARG H H 1 7.38 0.02 . 1 . . . . 326 ARG H . 16279 1 208 . 1 1 59 59 ARG C C 13 174.61 0.05 . 1 . . . . 326 ARG C . 16279 1 209 . 1 1 59 59 ARG CA C 13 52.73 0.05 . 1 . . . . 326 ARG CA . 16279 1 210 . 1 1 59 59 ARG CB C 13 31.39 0.05 . 1 . . . . 326 ARG CB . 16279 1 211 . 1 1 59 59 ARG N N 15 112.39 0.05 . 1 . . . . 326 ARG N . 16279 1 212 . 1 1 60 60 ALA H H 1 8.30 0.02 . 1 . . . . 327 ALA H . 16279 1 213 . 1 1 60 60 ALA C C 13 175.66 0.05 . 1 . . . . 327 ALA C . 16279 1 214 . 1 1 60 60 ALA CA C 13 49.49 0.05 . 1 . . . . 327 ALA CA . 16279 1 215 . 1 1 60 60 ALA CB C 13 16.88 0.05 . 1 . . . . 327 ALA CB . 16279 1 216 . 1 1 60 60 ALA N N 15 124.71 0.05 . 1 . . . . 327 ALA N . 16279 1 217 . 1 1 63 63 ASP C C 13 176.36 0.05 . 1 . . . . 330 ASP C . 16279 1 218 . 1 1 63 63 ASP CA C 13 52.67 0.05 . 1 . . . . 330 ASP CA . 16279 1 219 . 1 1 63 63 ASP CB C 13 39.95 0.05 . 1 . . . . 330 ASP CB . 16279 1 220 . 1 1 64 64 LEU H H 1 7.51 0.02 . 1 . . . . 331 LEU H . 16279 1 221 . 1 1 64 64 LEU C C 13 177.19 0.05 . 1 . . . . 331 LEU C . 16279 1 222 . 1 1 64 64 LEU CA C 13 56.18 0.05 . 1 . . . . 331 LEU CA . 16279 1 223 . 1 1 64 64 LEU CB C 13 41.08 0.05 . 1 . . . . 331 LEU CB . 16279 1 224 . 1 1 64 64 LEU N N 15 122.18 0.05 . 1 . . . . 331 LEU N . 16279 1 225 . 1 1 65 65 PHE H H 1 8.20 0.02 . 1 . . . . 332 PHE H . 16279 1 226 . 1 1 65 65 PHE C C 13 176.02 0.05 . 1 . . . . 332 PHE C . 16279 1 227 . 1 1 65 65 PHE CA C 13 57.30 0.05 . 1 . . . . 332 PHE CA . 16279 1 228 . 1 1 65 65 PHE CB C 13 37.57 0.05 . 1 . . . . 332 PHE CB . 16279 1 229 . 1 1 65 65 PHE N N 15 116.93 0.05 . 1 . . . . 332 PHE N . 16279 1 230 . 1 1 66 66 GLU H H 1 7.77 0.02 . 1 . . . . 333 GLU H . 16279 1 231 . 1 1 66 66 GLU C C 13 176.61 0.05 . 1 . . . . 333 GLU C . 16279 1 232 . 1 1 66 66 GLU CA C 13 56.13 0.05 . 1 . . . . 333 GLU CA . 16279 1 233 . 1 1 66 66 GLU CB C 13 28.97 0.05 . 1 . . . . 333 GLU CB . 16279 1 234 . 1 1 66 66 GLU N N 15 121.07 0.05 . 1 . . . . 333 GLU N . 16279 1 235 . 1 1 69 69 LYS C C 13 176.27 0.05 . 1 . . . . 336 LYS C . 16279 1 236 . 1 1 69 69 LYS CA C 13 55.80 0.05 . 1 . . . . 336 LYS CA . 16279 1 237 . 1 1 69 69 LYS CB C 13 32.16 0.05 . 1 . . . . 336 LYS CB . 16279 1 238 . 1 1 70 70 LYS H H 1 8.15 0.02 . 1 . . . . 337 LYS H . 16279 1 239 . 1 1 70 70 LYS C C 13 176.41 0.05 . 1 . . . . 337 LYS C . 16279 1 240 . 1 1 70 70 LYS CA C 13 55.62 0.05 . 1 . . . . 337 LYS CA . 16279 1 241 . 1 1 70 70 LYS CB C 13 31.45 0.05 . 1 . . . . 337 LYS CB . 16279 1 242 . 1 1 70 70 LYS N N 15 122.97 0.05 . 1 . . . . 337 LYS N . 16279 1 243 . 1 1 71 71 LYS H H 1 8.40 0.02 . 1 . . . . 338 LYS H . 16279 1 244 . 1 1 71 71 LYS C C 13 175.99 0.05 . 1 . . . . 338 LYS C . 16279 1 245 . 1 1 71 71 LYS CA C 13 55.61 0.05 . 1 . . . . 338 LYS CA . 16279 1 246 . 1 1 71 71 LYS CB C 13 31.57 0.05 . 1 . . . . 338 LYS CB . 16279 1 247 . 1 1 71 71 LYS N N 15 123.32 0.05 . 1 . . . . 338 LYS N . 16279 1 248 . 1 1 72 72 ASN H H 1 8.18 0.02 . 1 . . . . 339 ASN H . 16279 1 249 . 1 1 72 72 ASN C C 13 175.05 0.05 . 1 . . . . 339 ASN C . 16279 1 250 . 1 1 72 72 ASN CA C 13 52.34 0.05 . 1 . . . . 339 ASN CA . 16279 1 251 . 1 1 72 72 ASN CB C 13 37.66 0.05 . 1 . . . . 339 ASN CB . 16279 1 252 . 1 1 72 72 ASN N N 15 119.35 0.05 . 1 . . . . 339 ASN N . 16279 1 253 . 1 1 73 73 ASN H H 1 8.43 0.02 . 1 . . . . 340 ASN H . 16279 1 254 . 1 1 73 73 ASN C C 13 174.61 0.05 . 1 . . . . 340 ASN C . 16279 1 255 . 1 1 73 73 ASN CA C 13 54.38 0.05 . 1 . . . . 340 ASN CA . 16279 1 256 . 1 1 73 73 ASN CB C 13 38.41 0.05 . 1 . . . . 340 ASN CB . 16279 1 257 . 1 1 73 73 ASN N N 15 117.86 0.05 . 1 . . . . 340 ASN N . 16279 1 258 . 1 1 74 74 ILE H H 1 8.05 0.02 . 1 . . . . 341 ILE H . 16279 1 259 . 1 1 74 74 ILE C C 13 174.87 0.05 . 1 . . . . 341 ILE C . 16279 1 260 . 1 1 74 74 ILE CA C 13 58.39 0.05 . 1 . . . . 341 ILE CA . 16279 1 261 . 1 1 74 74 ILE CB C 13 37.22 0.05 . 1 . . . . 341 ILE CB . 16279 1 262 . 1 1 74 74 ILE N N 15 120.88 0.05 . 1 . . . . 341 ILE N . 16279 1 263 . 1 1 75 75 LYS H H 1 8.40 0.02 . 1 . . . . 342 LYS H . 16279 1 264 . 1 1 75 75 LYS C C 13 173.45 0.05 . 1 . . . . 342 LYS C . 16279 1 265 . 1 1 75 75 LYS CA C 13 55.39 0.05 . 1 . . . . 342 LYS CA . 16279 1 266 . 1 1 75 75 LYS CB C 13 32.98 0.05 . 1 . . . . 342 LYS CB . 16279 1 267 . 1 1 75 75 LYS N N 15 125.11 0.05 . 1 . . . . 342 LYS N . 16279 1 268 . 1 1 76 76 LEU H H 1 8.61 0.02 . 1 . . . . 343 LEU H . 16279 1 269 . 1 1 76 76 LEU C C 13 173.66 0.05 . 1 . . . . 343 LEU C . 16279 1 270 . 1 1 76 76 LEU CA C 13 53.62 0.05 . 1 . . . . 343 LEU CA . 16279 1 271 . 1 1 76 76 LEU CB C 13 42.72 0.05 . 1 . . . . 343 LEU CB . 16279 1 272 . 1 1 76 76 LEU N N 15 125.66 0.05 . 1 . . . . 343 LEU N . 16279 1 273 . 1 1 77 77 TYR H H 1 9.47 0.02 . 1 . . . . 344 TYR H . 16279 1 274 . 1 1 77 77 TYR C C 13 174.48 0.05 . 1 . . . . 344 TYR C . 16279 1 275 . 1 1 77 77 TYR CA C 13 55.61 0.05 . 1 . . . . 344 TYR CA . 16279 1 276 . 1 1 77 77 TYR CB C 13 40.68 0.05 . 1 . . . . 344 TYR CB . 16279 1 277 . 1 1 77 77 TYR N N 15 127.94 0.05 . 1 . . . . 344 TYR N . 16279 1 278 . 1 1 78 78 VAL H H 1 8.81 0.02 . 1 . . . . 345 VAL H . 16279 1 279 . 1 1 78 78 VAL C C 13 176.44 0.05 . 1 . . . . 345 VAL C . 16279 1 280 . 1 1 78 78 VAL CA C 13 60.22 0.05 . 1 . . . . 345 VAL CA . 16279 1 281 . 1 1 78 78 VAL CB C 13 33.44 0.05 . 1 . . . . 345 VAL CB . 16279 1 282 . 1 1 78 78 VAL N N 15 119.68 0.05 . 1 . . . . 345 VAL N . 16279 1 283 . 1 1 79 79 ARG H H 1 8.75 0.02 . 1 . . . . 346 ARG H . 16279 1 284 . 1 1 79 79 ARG C C 13 175.94 0.05 . 1 . . . . 346 ARG C . 16279 1 285 . 1 1 79 79 ARG CA C 13 57.36 0.05 . 1 . . . . 346 ARG CA . 16279 1 286 . 1 1 79 79 ARG CB C 13 26.79 0.05 . 1 . . . . 346 ARG CB . 16279 1 287 . 1 1 79 79 ARG N N 15 128.27 0.05 . 1 . . . . 346 ARG N . 16279 1 288 . 1 1 80 80 ARG H H 1 9.46 0.02 . 1 . . . . 347 ARG H . 16279 1 289 . 1 1 80 80 ARG C C 13 175.97 0.05 . 1 . . . . 347 ARG C . 16279 1 290 . 1 1 80 80 ARG CA C 13 58.50 0.05 . 1 . . . . 347 ARG CA . 16279 1 291 . 1 1 80 80 ARG CB C 13 27.03 0.05 . 1 . . . . 347 ARG CB . 16279 1 292 . 1 1 80 80 ARG N N 15 110.44 0.05 . 1 . . . . 347 ARG N . 16279 1 293 . 1 1 81 81 VAL H H 1 8.28 0.02 . 1 . . . . 348 VAL H . 16279 1 294 . 1 1 81 81 VAL C C 13 175.45 0.05 . 1 . . . . 348 VAL C . 16279 1 295 . 1 1 81 81 VAL CA C 13 61.75 0.05 . 1 . . . . 348 VAL CA . 16279 1 296 . 1 1 81 81 VAL CB C 13 31.74 0.05 . 1 . . . . 348 VAL CB . 16279 1 297 . 1 1 81 81 VAL N N 15 124.64 0.05 . 1 . . . . 348 VAL N . 16279 1 298 . 1 1 82 82 PHE H H 1 8.72 0.02 . 1 . . . . 349 PHE H . 16279 1 299 . 1 1 82 82 PHE C C 13 174.16 0.05 . 1 . . . . 349 PHE C . 16279 1 300 . 1 1 82 82 PHE CA C 13 58.81 0.05 . 1 . . . . 349 PHE CA . 16279 1 301 . 1 1 82 82 PHE CB C 13 37.38 0.05 . 1 . . . . 349 PHE CB . 16279 1 302 . 1 1 82 82 PHE N N 15 128.80 0.05 . 1 . . . . 349 PHE N . 16279 1 303 . 1 1 83 83 ILE H H 1 8.24 0.02 . 1 . . . . 350 ILE H . 16279 1 304 . 1 1 83 83 ILE C C 13 175.20 0.05 . 1 . . . . 350 ILE C . 16279 1 305 . 1 1 83 83 ILE CA C 13 59.02 0.05 . 1 . . . . 350 ILE CA . 16279 1 306 . 1 1 83 83 ILE CB C 13 36.67 0.05 . 1 . . . . 350 ILE CB . 16279 1 307 . 1 1 83 83 ILE N N 15 127.47 0.05 . 1 . . . . 350 ILE N . 16279 1 308 . 1 1 84 84 THR H H 1 6.59 0.02 . 1 . . . . 351 THR H . 16279 1 309 . 1 1 84 84 THR C C 13 170.61 0.05 . 1 . . . . 351 THR C . 16279 1 310 . 1 1 84 84 THR CA C 13 60.16 0.05 . 1 . . . . 351 THR CA . 16279 1 311 . 1 1 84 84 THR CB C 13 66.81 0.05 . 1 . . . . 351 THR CB . 16279 1 312 . 1 1 84 84 THR N N 15 110.61 0.05 . 1 . . . . 351 THR N . 16279 1 313 . 1 1 85 85 ASP H H 1 8.16 0.02 . 1 . . . . 352 ASP H . 16279 1 314 . 1 1 85 85 ASP C C 13 175.48 0.05 . 1 . . . . 352 ASP C . 16279 1 315 . 1 1 85 85 ASP CA C 13 52.72 0.05 . 1 . . . . 352 ASP CA . 16279 1 316 . 1 1 85 85 ASP CB C 13 40.72 0.05 . 1 . . . . 352 ASP CB . 16279 1 317 . 1 1 85 85 ASP N N 15 125.43 0.05 . 1 . . . . 352 ASP N . 16279 1 318 . 1 1 86 86 GLU H H 1 8.53 0.02 . 1 . . . . 353 GLU H . 16279 1 319 . 1 1 86 86 GLU C C 13 175.88 0.05 . 1 . . . . 353 GLU C . 16279 1 320 . 1 1 86 86 GLU CA C 13 54.40 0.05 . 1 . . . . 353 GLU CA . 16279 1 321 . 1 1 86 86 GLU CB C 13 29.06 0.05 . 1 . . . . 353 GLU CB . 16279 1 322 . 1 1 86 86 GLU N N 15 120.76 0.05 . 1 . . . . 353 GLU N . 16279 1 323 . 1 1 87 87 ALA H H 1 8.26 0.02 . 1 . . . . 354 ALA H . 16279 1 324 . 1 1 87 87 ALA C C 13 177.30 0.05 . 1 . . . . 354 ALA C . 16279 1 325 . 1 1 87 87 ALA CA C 13 51.02 0.05 . 1 . . . . 354 ALA CA . 16279 1 326 . 1 1 87 87 ALA CB C 13 16.68 0.05 . 1 . . . . 354 ALA CB . 16279 1 327 . 1 1 87 87 ALA N N 15 125.95 0.05 . 1 . . . . 354 ALA N . 16279 1 328 . 1 1 88 88 GLU H H 1 8.25 0.02 . 1 . . . . 355 GLU H . 16279 1 329 . 1 1 88 88 GLU C C 13 176.40 0.05 . 1 . . . . 355 GLU C . 16279 1 330 . 1 1 88 88 GLU CA C 13 57.47 0.05 . 1 . . . . 355 GLU CA . 16279 1 331 . 1 1 88 88 GLU CB C 13 29.07 0.05 . 1 . . . . 355 GLU CB . 16279 1 332 . 1 1 88 88 GLU N N 15 123.16 0.05 . 1 . . . . 355 GLU N . 16279 1 333 . 1 1 89 89 ASP H H 1 8.38 0.02 . 1 . . . . 356 ASP H . 16279 1 334 . 1 1 89 89 ASP C C 13 175.98 0.05 . 1 . . . . 356 ASP C . 16279 1 335 . 1 1 89 89 ASP CA C 13 54.53 0.05 . 1 . . . . 356 ASP CA . 16279 1 336 . 1 1 89 89 ASP CB C 13 39.87 0.05 . 1 . . . . 356 ASP CB . 16279 1 337 . 1 1 89 89 ASP N N 15 116.42 0.05 . 1 . . . . 356 ASP N . 16279 1 338 . 1 1 90 90 LEU H H 1 7.48 0.02 . 1 . . . . 357 LEU H . 16279 1 339 . 1 1 90 90 LEU C C 13 173.66 0.05 . 1 . . . . 357 LEU C . 16279 1 340 . 1 1 90 90 LEU CA C 13 56.54 0.05 . 1 . . . . 357 LEU CA . 16279 1 341 . 1 1 90 90 LEU CB C 13 41.80 0.05 . 1 . . . . 357 LEU CB . 16279 1 342 . 1 1 90 90 LEU N N 15 120.58 0.05 . 1 . . . . 357 LEU N . 16279 1 343 . 1 1 91 91 ILE H H 1 6.83 0.02 . 1 . . . . 358 ILE H . 16279 1 344 . 1 1 91 91 ILE C C 13 172.80 0.05 . 1 . . . . 358 ILE C . 16279 1 345 . 1 1 91 91 ILE CA C 13 55.90 0.05 . 1 . . . . 358 ILE CA . 16279 1 346 . 1 1 91 91 ILE CB C 13 40.09 0.05 . 1 . . . . 358 ILE CB . 16279 1 347 . 1 1 91 91 ILE N N 15 107.72 0.05 . 1 . . . . 358 ILE N . 16279 1 348 . 1 1 92 92 PRO CA C 13 61.42 0.05 . 1 . . . . 359 PRO CA . 16279 1 349 . 1 1 93 93 GLU H H 1 8.94 0.02 . 1 . . . . 360 GLU H . 16279 1 350 . 1 1 93 93 GLU C C 13 179.66 0.05 . 1 . . . . 360 GLU C . 16279 1 351 . 1 1 93 93 GLU CA C 13 59.50 0.05 . 1 . . . . 360 GLU CA . 16279 1 352 . 1 1 93 93 GLU CB C 13 28.19 0.05 . 1 . . . . 360 GLU CB . 16279 1 353 . 1 1 93 93 GLU N N 15 122.68 0.05 . 1 . . . . 360 GLU N . 16279 1 354 . 1 1 94 94 TRP H H 1 7.81 0.02 . 1 . . . . 361 TRP H . 16279 1 355 . 1 1 94 94 TRP C C 13 175.80 0.05 . 1 . . . . 361 TRP C . 16279 1 356 . 1 1 94 94 TRP CA C 13 57.96 0.05 . 1 . . . . 361 TRP CA . 16279 1 357 . 1 1 94 94 TRP CB C 13 26.24 0.05 . 1 . . . . 361 TRP CB . 16279 1 358 . 1 1 94 94 TRP N N 15 116.27 0.05 . 1 . . . . 361 TRP N . 16279 1 359 . 1 1 95 95 LEU H H 1 6.67 0.02 . 1 . . . . 362 LEU H . 16279 1 360 . 1 1 95 95 LEU C C 13 176.68 0.05 . 1 . . . . 362 LEU C . 16279 1 361 . 1 1 95 95 LEU CA C 13 52.61 0.05 . 1 . . . . 362 LEU CA . 16279 1 362 . 1 1 95 95 LEU CB C 13 41.16 0.05 . 1 . . . . 362 LEU CB . 16279 1 363 . 1 1 95 95 LEU N N 15 120.40 0.05 . 1 . . . . 362 LEU N . 16279 1 364 . 1 1 96 96 SER H H 1 7.43 0.02 . 1 . . . . 363 SER H . 16279 1 365 . 1 1 96 96 SER C C 13 172.73 0.05 . 1 . . . . 363 SER C . 16279 1 366 . 1 1 96 96 SER CA C 13 60.50 0.05 . 1 . . . . 363 SER CA . 16279 1 367 . 1 1 96 96 SER CB C 13 62.17 0.05 . 1 . . . . 363 SER CB . 16279 1 368 . 1 1 96 96 SER N N 15 113.74 0.05 . 1 . . . . 363 SER N . 16279 1 369 . 1 1 97 97 PHE H H 1 6.53 0.02 . 1 . . . . 364 PHE H . 16279 1 370 . 1 1 97 97 PHE C C 13 174.26 0.05 . 1 . . . . 364 PHE C . 16279 1 371 . 1 1 97 97 PHE CA C 13 55.56 0.05 . 1 . . . . 364 PHE CA . 16279 1 372 . 1 1 97 97 PHE CB C 13 38.30 0.05 . 1 . . . . 364 PHE CB . 16279 1 373 . 1 1 97 97 PHE N N 15 115.77 0.05 . 1 . . . . 364 PHE N . 16279 1 374 . 1 1 98 98 VAL H H 1 6.66 0.02 . 1 . . . . 365 VAL H . 16279 1 375 . 1 1 98 98 VAL C C 13 174.28 0.05 . 1 . . . . 365 VAL C . 16279 1 376 . 1 1 98 98 VAL CA C 13 62.03 0.05 . 1 . . . . 365 VAL CA . 16279 1 377 . 1 1 98 98 VAL CB C 13 30.99 0.05 . 1 . . . . 365 VAL CB . 16279 1 378 . 1 1 98 98 VAL N N 15 120.23 0.05 . 1 . . . . 365 VAL N . 16279 1 379 . 1 1 99 99 LYS C C 13 176.40 0.05 . 1 . . . . 366 LYS C . 16279 1 380 . 1 1 99 99 LYS CA C 13 52.52 0.05 . 1 . . . . 366 LYS CA . 16279 1 381 . 1 1 99 99 LYS CB C 13 35.65 0.05 . 1 . . . . 366 LYS CB . 16279 1 382 . 1 1 100 100 GLY H H 1 8.57 0.02 . 1 . . . . 367 GLY H . 16279 1 383 . 1 1 100 100 GLY C C 13 170.60 0.05 . 1 . . . . 367 GLY C . 16279 1 384 . 1 1 100 100 GLY CA C 13 45.73 0.05 . 1 . . . . 367 GLY CA . 16279 1 385 . 1 1 100 100 GLY N N 15 106.75 0.05 . 1 . . . . 367 GLY N . 16279 1 386 . 1 1 103 103 ASP C C 13 177.08 0.05 . 1 . . . . 370 ASP C . 16279 1 387 . 1 1 103 103 ASP CA C 13 51.12 0.05 . 1 . . . . 370 ASP CA . 16279 1 388 . 1 1 103 103 ASP CB C 13 42.64 0.05 . 1 . . . . 370 ASP CB . 16279 1 389 . 1 1 104 104 SER H H 1 8.80 0.02 . 1 . . . . 371 SER H . 16279 1 390 . 1 1 104 104 SER C C 13 174.80 0.05 . 1 . . . . 371 SER C . 16279 1 391 . 1 1 104 104 SER CA C 13 56.11 0.05 . 1 . . . . 371 SER CA . 16279 1 392 . 1 1 104 104 SER CB C 13 64.78 0.05 . 1 . . . . 371 SER CB . 16279 1 393 . 1 1 104 104 SER N N 15 120.89 0.05 . 1 . . . . 371 SER N . 16279 1 394 . 1 1 105 105 GLU H H 1 8.32 0.02 . 1 . . . . 372 GLU H . 16279 1 395 . 1 1 105 105 GLU C C 13 177.61 0.05 . 1 . . . . 372 GLU C . 16279 1 396 . 1 1 105 105 GLU CA C 13 56.47 0.05 . 1 . . . . 372 GLU CA . 16279 1 397 . 1 1 105 105 GLU CB C 13 29.77 0.05 . 1 . . . . 372 GLU CB . 16279 1 398 . 1 1 105 105 GLU N N 15 124.73 0.05 . 1 . . . . 372 GLU N . 16279 1 399 . 1 1 106 106 ASP H H 1 7.68 0.02 . 1 . . . . 373 ASP H . 16279 1 400 . 1 1 106 106 ASP C C 13 176.06 0.05 . 1 . . . . 373 ASP C . 16279 1 401 . 1 1 106 106 ASP CA C 13 54.47 0.05 . 1 . . . . 373 ASP CA . 16279 1 402 . 1 1 106 106 ASP CB C 13 43.73 0.05 . 1 . . . . 373 ASP CB . 16279 1 403 . 1 1 106 106 ASP N N 15 114.44 0.05 . 1 . . . . 373 ASP N . 16279 1 404 . 1 1 107 107 LEU H H 1 7.03 0.02 . 1 . . . . 374 LEU H . 16279 1 405 . 1 1 107 107 LEU C C 13 173.38 0.05 . 1 . . . . 374 LEU C . 16279 1 406 . 1 1 107 107 LEU CA C 13 53.28 0.05 . 1 . . . . 374 LEU CA . 16279 1 407 . 1 1 107 107 LEU CB C 13 41.47 0.05 . 1 . . . . 374 LEU CB . 16279 1 408 . 1 1 107 107 LEU N N 15 121.65 0.05 . 1 . . . . 374 LEU N . 16279 1 409 . 1 1 108 108 PRO CA C 13 61.90 0.05 . 1 . . . . 375 PRO CA . 16279 1 410 . 1 1 108 108 PRO CB C 13 30.55 0.05 . 1 . . . . 375 PRO CB . 16279 1 411 . 1 1 109 109 LEU H H 1 7.82 0.02 . 1 . . . . 376 LEU H . 16279 1 412 . 1 1 109 109 LEU C C 13 177.31 0.05 . 1 . . . . 376 LEU C . 16279 1 413 . 1 1 109 109 LEU CA C 13 54.78 0.05 . 1 . . . . 376 LEU CA . 16279 1 414 . 1 1 109 109 LEU CB C 13 41.75 0.05 . 1 . . . . 376 LEU CB . 16279 1 415 . 1 1 109 109 LEU N N 15 118.37 0.05 . 1 . . . . 376 LEU N . 16279 1 416 . 1 1 110 110 ASN H H 1 8.04 0.02 . 1 . . . . 377 ASN H . 16279 1 417 . 1 1 110 110 ASN C C 13 174.69 0.05 . 1 . . . . 377 ASN C . 16279 1 418 . 1 1 110 110 ASN CA C 13 52.29 0.05 . 1 . . . . 377 ASN CA . 16279 1 419 . 1 1 110 110 ASN CB C 13 36.90 0.05 . 1 . . . . 377 ASN CB . 16279 1 420 . 1 1 110 110 ASN N N 15 115.42 0.05 . 1 . . . . 377 ASN N . 16279 1 421 . 1 1 111 111 LEU H H 1 7.76 0.02 . 1 . . . . 378 LEU H . 16279 1 422 . 1 1 111 111 LEU C C 13 176.61 0.05 . 1 . . . . 378 LEU C . 16279 1 423 . 1 1 111 111 LEU CA C 13 54.31 0.05 . 1 . . . . 378 LEU CA . 16279 1 424 . 1 1 111 111 LEU CB C 13 41.56 0.05 . 1 . . . . 378 LEU CB . 16279 1 425 . 1 1 111 111 LEU N N 15 121.13 0.05 . 1 . . . . 378 LEU N . 16279 1 426 . 1 1 112 112 SER H H 1 7.80 0.02 . 1 . . . . 379 SER H . 16279 1 427 . 1 1 112 112 SER C C 13 174.70 0.05 . 1 . . . . 379 SER C . 16279 1 428 . 1 1 112 112 SER CA C 13 56.56 0.05 . 1 . . . . 379 SER CA . 16279 1 429 . 1 1 112 112 SER CB C 13 64.11 0.05 . 1 . . . . 379 SER CB . 16279 1 430 . 1 1 112 112 SER N N 15 117.49 0.05 . 1 . . . . 379 SER N . 16279 1 431 . 1 1 113 113 ARG C C 13 178.18 0.05 . 1 . . . . 380 ARG C . 16279 1 432 . 1 1 113 113 ARG CA C 13 58.85 0.05 . 1 . . . . 380 ARG CA . 16279 1 433 . 1 1 113 113 ARG CB C 13 28.76 0.05 . 1 . . . . 380 ARG CB . 16279 1 434 . 1 1 114 114 GLU H H 1 8.61 0.02 . 1 . . . . 381 GLU H . 16279 1 435 . 1 1 114 114 GLU C C 13 178.29 0.05 . 1 . . . . 381 GLU C . 16279 1 436 . 1 1 114 114 GLU CA C 13 58.54 0.05 . 1 . . . . 381 GLU CA . 16279 1 437 . 1 1 114 114 GLU CB C 13 28.02 0.05 . 1 . . . . 381 GLU CB . 16279 1 438 . 1 1 114 114 GLU N N 15 118.40 0.05 . 1 . . . . 381 GLU N . 16279 1 439 . 1 1 115 115 MET H H 1 7.57 0.02 . 1 . . . . 382 MET H . 16279 1 440 . 1 1 115 115 MET C C 13 178.52 0.05 . 1 . . . . 382 MET C . 16279 1 441 . 1 1 115 115 MET CA C 13 56.47 0.05 . 1 . . . . 382 MET CA . 16279 1 442 . 1 1 115 115 MET CB C 13 31.85 0.05 . 1 . . . . 382 MET CB . 16279 1 443 . 1 1 115 115 MET N N 15 118.58 0.05 . 1 . . . . 382 MET N . 16279 1 444 . 1 1 116 116 LEU C C 13 173.43 0.05 . 1 . . . . 383 LEU C . 16279 1 445 . 1 1 116 116 LEU CA C 13 54.22 0.05 . 1 . . . . 383 LEU CA . 16279 1 446 . 1 1 116 116 LEU CB C 13 37.15 0.05 . 1 . . . . 383 LEU CB . 16279 1 447 . 1 1 117 117 GLN H H 1 7.39 0.02 . 1 . . . . 384 GLN H . 16279 1 448 . 1 1 117 117 GLN C C 13 174.64 0.05 . 1 . . . . 384 GLN C . 16279 1 449 . 1 1 117 117 GLN CA C 13 54.85 0.05 . 1 . . . . 384 GLN CA . 16279 1 450 . 1 1 117 117 GLN CB C 13 30.32 0.05 . 1 . . . . 384 GLN CB . 16279 1 451 . 1 1 117 117 GLN N N 15 123.89 0.05 . 1 . . . . 384 GLN N . 16279 1 452 . 1 1 118 118 GLN H H 1 7.84 0.02 . 1 . . . . 385 GLN H . 16279 1 453 . 1 1 118 118 GLN C C 13 176.43 0.05 . 1 . . . . 385 GLN C . 16279 1 454 . 1 1 118 118 GLN CA C 13 56.03 0.05 . 1 . . . . 385 GLN CA . 16279 1 455 . 1 1 118 118 GLN CB C 13 28.11 0.05 . 1 . . . . 385 GLN CB . 16279 1 456 . 1 1 118 118 GLN N N 15 123.13 0.05 . 1 . . . . 385 GLN N . 16279 1 457 . 1 1 119 119 ASN H H 1 7.57 0.02 . 1 . . . . 386 ASN H . 16279 1 458 . 1 1 119 119 ASN C C 13 175.51 0.05 . 1 . . . . 386 ASN C . 16279 1 459 . 1 1 119 119 ASN CA C 13 53.15 0.05 . 1 . . . . 386 ASN CA . 16279 1 460 . 1 1 119 119 ASN CB C 13 40.66 0.05 . 1 . . . . 386 ASN CB . 16279 1 461 . 1 1 119 119 ASN N N 15 120.52 0.05 . 1 . . . . 386 ASN N . 16279 1 462 . 1 1 120 120 LYS H H 1 7.84 0.02 . 1 . . . . 387 LYS H . 16279 1 463 . 1 1 120 120 LYS C C 13 178.19 0.05 . 1 . . . . 387 LYS C . 16279 1 464 . 1 1 120 120 LYS CA C 13 52.56 0.05 . 1 . . . . 387 LYS CA . 16279 1 465 . 1 1 120 120 LYS CB C 13 36.62 0.05 . 1 . . . . 387 LYS CB . 16279 1 466 . 1 1 120 120 LYS N N 15 118.89 0.05 . 1 . . . . 387 LYS N . 16279 1 467 . 1 1 121 121 ILE H H 1 7.85 0.02 . 1 . . . . 388 ILE H . 16279 1 468 . 1 1 121 121 ILE C C 13 178.19 0.05 . 1 . . . . 388 ILE C . 16279 1 469 . 1 1 121 121 ILE CA C 13 63.81 0.05 . 1 . . . . 388 ILE CA . 16279 1 470 . 1 1 121 121 ILE CB C 13 35.94 0.05 . 1 . . . . 388 ILE CB . 16279 1 471 . 1 1 121 121 ILE N N 15 120.47 0.05 . 1 . . . . 388 ILE N . 16279 1 472 . 1 1 122 122 MET H H 1 7.85 0.02 . 1 . . . . 389 MET H . 16279 1 473 . 1 1 122 122 MET C C 13 178.09 0.05 . 1 . . . . 389 MET C . 16279 1 474 . 1 1 122 122 MET CA C 13 57.08 0.05 . 1 . . . . 389 MET CA . 16279 1 475 . 1 1 122 122 MET CB C 13 30.30 0.05 . 1 . . . . 389 MET CB . 16279 1 476 . 1 1 122 122 MET N N 15 118.59 0.05 . 1 . . . . 389 MET N . 16279 1 477 . 1 1 123 123 LYS H H 1 7.40 0.02 . 1 . . . . 390 LYS H . 16279 1 478 . 1 1 123 123 LYS C C 13 179.16 0.05 . 1 . . . . 390 LYS C . 16279 1 479 . 1 1 123 123 LYS CA C 13 59.06 0.05 . 1 . . . . 390 LYS CA . 16279 1 480 . 1 1 123 123 LYS CB C 13 31.01 0.05 . 1 . . . . 390 LYS CB . 16279 1 481 . 1 1 123 123 LYS N N 15 116.82 0.05 . 1 . . . . 390 LYS N . 16279 1 482 . 1 1 124 124 VAL H H 1 7.37 0.02 . 1 . . . . 391 VAL H . 16279 1 483 . 1 1 124 124 VAL C C 13 179.52 0.05 . 1 . . . . 391 VAL C . 16279 1 484 . 1 1 124 124 VAL CA C 13 65.56 0.05 . 1 . . . . 391 VAL CA . 16279 1 485 . 1 1 124 124 VAL CB C 13 30.44 0.05 . 1 . . . . 391 VAL CB . 16279 1 486 . 1 1 124 124 VAL N N 15 120.91 0.05 . 1 . . . . 391 VAL N . 16279 1 487 . 1 1 125 125 ILE H H 1 8.14 0.02 . 1 . . . . 392 ILE H . 16279 1 488 . 1 1 125 125 ILE C C 13 177.47 0.05 . 1 . . . . 392 ILE C . 16279 1 489 . 1 1 125 125 ILE CA C 13 65.95 0.05 . 1 . . . . 392 ILE CA . 16279 1 490 . 1 1 125 125 ILE CB C 13 35.92 0.05 . 1 . . . . 392 ILE CB . 16279 1 491 . 1 1 125 125 ILE N N 15 124.29 0.05 . 1 . . . . 392 ILE N . 16279 1 492 . 1 1 126 126 ARG H H 1 8.16 0.02 . 1 . . . . 393 ARG H . 16279 1 493 . 1 1 126 126 ARG C C 13 177.62 0.05 . 1 . . . . 393 ARG C . 16279 1 494 . 1 1 126 126 ARG CA C 13 59.17 0.05 . 1 . . . . 393 ARG CA . 16279 1 495 . 1 1 126 126 ARG CB C 13 29.21 0.05 . 1 . . . . 393 ARG CB . 16279 1 496 . 1 1 126 126 ARG N N 15 120.32 0.05 . 1 . . . . 393 ARG N . 16279 1 497 . 1 1 127 127 LYS H H 1 7.71 0.02 . 1 . . . . 394 LYS H . 16279 1 498 . 1 1 127 127 LYS C C 13 179.80 0.05 . 1 . . . . 394 LYS C . 16279 1 499 . 1 1 127 127 LYS CA C 13 59.16 0.05 . 1 . . . . 394 LYS CA . 16279 1 500 . 1 1 127 127 LYS CB C 13 31.26 0.05 . 1 . . . . 394 LYS CB . 16279 1 501 . 1 1 127 127 LYS N N 15 116.72 0.05 . 1 . . . . 394 LYS N . 16279 1 502 . 1 1 128 128 ASN H H 1 7.74 0.02 . 1 . . . . 395 ASN H . 16279 1 503 . 1 1 128 128 ASN C C 13 176.68 0.05 . 1 . . . . 395 ASN C . 16279 1 504 . 1 1 128 128 ASN CA C 13 56.92 0.05 . 1 . . . . 395 ASN CA . 16279 1 505 . 1 1 128 128 ASN CB C 13 40.54 0.05 . 1 . . . . 395 ASN CB . 16279 1 506 . 1 1 128 128 ASN N N 15 117.19 0.05 . 1 . . . . 395 ASN N . 16279 1 507 . 1 1 129 129 ILE H H 1 8.75 0.02 . 1 . . . . 396 ILE H . 16279 1 508 . 1 1 129 129 ILE C C 13 176.81 0.05 . 1 . . . . 396 ILE C . 16279 1 509 . 1 1 129 129 ILE CA C 13 66.35 0.05 . 1 . . . . 396 ILE CA . 16279 1 510 . 1 1 129 129 ILE CB C 13 36.19 0.05 . 1 . . . . 396 ILE CB . 16279 1 511 . 1 1 129 129 ILE N N 15 121.27 0.05 . 1 . . . . 396 ILE N . 16279 1 512 . 1 1 130 130 VAL H H 1 8.14 0.02 . 1 . . . . 397 VAL H . 16279 1 513 . 1 1 130 130 VAL C C 13 177.25 0.05 . 1 . . . . 397 VAL C . 16279 1 514 . 1 1 130 130 VAL CA C 13 67.28 0.05 . 1 . . . . 397 VAL CA . 16279 1 515 . 1 1 130 130 VAL CB C 13 30.18 0.05 . 1 . . . . 397 VAL CB . 16279 1 516 . 1 1 130 130 VAL N N 15 118.60 0.05 . 1 . . . . 397 VAL N . 16279 1 517 . 1 1 131 131 LYS H H 1 7.38 0.02 . 1 . . . . 398 LYS H . 16279 1 518 . 1 1 131 131 LYS C C 13 179.71 0.05 . 1 . . . . 398 LYS C . 16279 1 519 . 1 1 131 131 LYS CA C 13 59.26 0.05 . 1 . . . . 398 LYS CA . 16279 1 520 . 1 1 131 131 LYS CB C 13 31.35 0.05 . 1 . . . . 398 LYS CB . 16279 1 521 . 1 1 131 131 LYS N N 15 117.18 0.05 . 1 . . . . 398 LYS N . 16279 1 522 . 1 1 132 132 LYS H H 1 7.68 0.02 . 1 . . . . 399 LYS H . 16279 1 523 . 1 1 132 132 LYS C C 13 178.62 0.05 . 1 . . . . 399 LYS C . 16279 1 524 . 1 1 132 132 LYS CA C 13 56.32 0.05 . 1 . . . . 399 LYS CA . 16279 1 525 . 1 1 132 132 LYS CB C 13 30.64 0.05 . 1 . . . . 399 LYS CB . 16279 1 526 . 1 1 132 132 LYS N N 15 118.28 0.05 . 1 . . . . 399 LYS N . 16279 1 527 . 1 1 134 134 ILE C C 13 178.09 0.05 . 1 . . . . 401 ILE C . 16279 1 528 . 1 1 134 134 ILE CA C 13 65.29 0.05 . 1 . . . . 401 ILE CA . 16279 1 529 . 1 1 134 134 ILE CB C 13 36.03 0.05 . 1 . . . . 401 ILE CB . 16279 1 530 . 1 1 135 135 GLU H H 1 7.41 0.02 . 1 . . . . 402 GLU H . 16279 1 531 . 1 1 135 135 GLU C C 13 178.60 0.05 . 1 . . . . 402 GLU C . 16279 1 532 . 1 1 135 135 GLU CA C 13 59.25 0.05 . 1 . . . . 402 GLU CA . 16279 1 533 . 1 1 135 135 GLU CB C 13 28.62 0.05 . 1 . . . . 402 GLU CB . 16279 1 534 . 1 1 135 135 GLU N N 15 119.60 0.05 . 1 . . . . 402 GLU N . 16279 1 535 . 1 1 136 136 ALA H H 1 7.62 0.02 . 1 . . . . 403 ALA H . 16279 1 536 . 1 1 136 136 ALA C C 13 178.70 0.05 . 1 . . . . 403 ALA C . 16279 1 537 . 1 1 136 136 ALA CA C 13 53.78 0.05 . 1 . . . . 403 ALA CA . 16279 1 538 . 1 1 136 136 ALA CB C 13 16.34 0.05 . 1 . . . . 403 ALA CB . 16279 1 539 . 1 1 136 136 ALA N N 15 121.44 0.05 . 1 . . . . 403 ALA N . 16279 1 540 . 1 1 137 137 PHE C C 13 177.55 0.05 . 1 . . . . 404 PHE C . 16279 1 541 . 1 1 137 137 PHE CA C 13 56.37 0.05 . 1 . . . . 404 PHE CA . 16279 1 542 . 1 1 137 137 PHE CB C 13 36.04 0.05 . 1 . . . . 404 PHE CB . 16279 1 543 . 1 1 138 138 ASN H H 1 8.06 0.02 . 1 . . . . 405 ASN H . 16279 1 544 . 1 1 138 138 ASN C C 13 177.88 0.05 . 1 . . . . 405 ASN C . 16279 1 545 . 1 1 138 138 ASN CA C 13 55.41 0.05 . 1 . . . . 405 ASN CA . 16279 1 546 . 1 1 138 138 ASN CB C 13 37.33 0.05 . 1 . . . . 405 ASN CB . 16279 1 547 . 1 1 138 138 ASN N N 15 117.04 0.05 . 1 . . . . 405 ASN N . 16279 1 548 . 1 1 139 139 GLU H H 1 7.86 0.02 . 1 . . . . 406 GLU H . 16279 1 549 . 1 1 139 139 GLU C C 13 180.73 0.05 . 1 . . . . 406 GLU C . 16279 1 550 . 1 1 139 139 GLU CA C 13 58.69 0.05 . 1 . . . . 406 GLU CA . 16279 1 551 . 1 1 139 139 GLU CB C 13 27.41 0.05 . 1 . . . . 406 GLU CB . 16279 1 552 . 1 1 139 139 GLU N N 15 122.51 0.05 . 1 . . . . 406 GLU N . 16279 1 553 . 1 1 140 140 ILE C C 13 177.24 0.05 . 1 . . . . 407 ILE C . 16279 1 554 . 1 1 140 140 ILE CA C 13 64.70 0.05 . 1 . . . . 407 ILE CA . 16279 1 555 . 1 1 140 140 ILE CB C 13 36.30 0.05 . 1 . . . . 407 ILE CB . 16279 1 556 . 1 1 141 141 ALA H H 1 7.62 0.02 . 1 . . . . 408 ALA H . 16279 1 557 . 1 1 141 141 ALA C C 13 177.89 0.05 . 1 . . . . 408 ALA C . 16279 1 558 . 1 1 141 141 ALA CA C 13 52.92 0.05 . 1 . . . . 408 ALA CA . 16279 1 559 . 1 1 141 141 ALA CB C 13 16.36 0.05 . 1 . . . . 408 ALA CB . 16279 1 560 . 1 1 141 141 ALA N N 15 116.96 0.05 . 1 . . . . 408 ALA N . 16279 1 561 . 1 1 142 142 GLU H H 1 7.07 0.02 . 1 . . . . 409 GLU H . 16279 1 562 . 1 1 142 142 GLU C C 13 175.72 0.05 . 1 . . . . 409 GLU C . 16279 1 563 . 1 1 142 142 GLU CA C 13 56.94 0.05 . 1 . . . . 409 GLU CA . 16279 1 564 . 1 1 142 142 GLU CB C 13 28.79 0.05 . 1 . . . . 409 GLU CB . 16279 1 565 . 1 1 142 142 GLU N N 15 116.38 0.05 . 1 . . . . 409 GLU N . 16279 1 566 . 1 1 143 143 ASP H H 1 7.95 0.02 . 1 . . . . 410 ASP H . 16279 1 567 . 1 1 143 143 ASP C C 13 175.16 0.05 . 1 . . . . 410 ASP C . 16279 1 568 . 1 1 143 143 ASP CA C 13 51.95 0.05 . 1 . . . . 410 ASP CA . 16279 1 569 . 1 1 143 143 ASP CB C 13 42.23 0.05 . 1 . . . . 410 ASP CB . 16279 1 570 . 1 1 143 143 ASP N N 15 121.56 0.05 . 1 . . . . 410 ASP N . 16279 1 571 . 1 1 144 144 SER H H 1 8.73 0.02 . 1 . . . . 411 SER H . 16279 1 572 . 1 1 144 144 SER C C 13 176.72 0.05 . 1 . . . . 411 SER C . 16279 1 573 . 1 1 144 144 SER CA C 13 61.91 0.05 . 1 . . . . 411 SER CA . 16279 1 574 . 1 1 144 144 SER N N 15 120.99 0.05 . 1 . . . . 411 SER N . 16279 1 575 . 1 1 145 145 GLU H H 1 8.09 0.02 . 1 . . . . 412 GLU H . 16279 1 576 . 1 1 145 145 GLU C C 13 179.41 0.05 . 1 . . . . 412 GLU C . 16279 1 577 . 1 1 145 145 GLU CA C 13 58.95 0.05 . 1 . . . . 412 GLU CA . 16279 1 578 . 1 1 145 145 GLU CB C 13 28.70 0.05 . 1 . . . . 412 GLU CB . 16279 1 579 . 1 1 145 145 GLU N N 15 122.21 0.05 . 1 . . . . 412 GLU N . 16279 1 580 . 1 1 146 146 GLN H H 1 8.11 0.02 . 1 . . . . 413 GLN H . 16279 1 581 . 1 1 146 146 GLN C C 13 178.88 0.05 . 1 . . . . 413 GLN C . 16279 1 582 . 1 1 146 146 GLN CA C 13 57.91 0.05 . 1 . . . . 413 GLN CA . 16279 1 583 . 1 1 146 146 GLN CB C 13 28.57 0.05 . 1 . . . . 413 GLN CB . 16279 1 584 . 1 1 146 146 GLN N N 15 120.80 0.05 . 1 . . . . 413 GLN N . 16279 1 585 . 1 1 147 147 PHE H H 1 9.33 0.02 . 1 . . . . 414 PHE H . 16279 1 586 . 1 1 147 147 PHE C C 13 176.79 0.05 . 1 . . . . 414 PHE C . 16279 1 587 . 1 1 147 147 PHE CA C 13 61.99 0.05 . 1 . . . . 414 PHE CA . 16279 1 588 . 1 1 147 147 PHE CB C 13 37.44 0.05 . 1 . . . . 414 PHE CB . 16279 1 589 . 1 1 147 147 PHE N N 15 120.18 0.05 . 1 . . . . 414 PHE N . 16279 1 590 . 1 1 148 148 GLU H H 1 7.97 0.02 . 1 . . . . 415 GLU H . 16279 1 591 . 1 1 148 148 GLU C C 13 179.59 0.05 . 1 . . . . 415 GLU C . 16279 1 592 . 1 1 148 148 GLU CA C 13 59.35 0.05 . 1 . . . . 415 GLU CA . 16279 1 593 . 1 1 148 148 GLU CB C 13 28.05 0.05 . 1 . . . . 415 GLU CB . 16279 1 594 . 1 1 148 148 GLU N N 15 118.77 0.05 . 1 . . . . 415 GLU N . 16279 1 595 . 1 1 149 149 LYS H H 1 7.02 0.02 . 1 . . . . 416 LYS H . 16279 1 596 . 1 1 149 149 LYS C C 13 179.15 0.05 . 1 . . . . 416 LYS C . 16279 1 597 . 1 1 149 149 LYS CA C 13 58.75 0.05 . 1 . . . . 416 LYS CA . 16279 1 598 . 1 1 149 149 LYS CB C 13 31.42 0.05 . 1 . . . . 416 LYS CB . 16279 1 599 . 1 1 149 149 LYS N N 15 118.81 0.05 . 1 . . . . 416 LYS N . 16279 1 600 . 1 1 150 150 PHE H H 1 8.09 0.02 . 1 . . . . 417 PHE H . 16279 1 601 . 1 1 150 150 PHE C C 13 175.40 0.05 . 1 . . . . 417 PHE C . 16279 1 602 . 1 1 150 150 PHE CA C 13 59.83 0.05 . 1 . . . . 417 PHE CA . 16279 1 603 . 1 1 150 150 PHE CB C 13 39.09 0.05 . 1 . . . . 417 PHE CB . 16279 1 604 . 1 1 150 150 PHE N N 15 121.45 0.05 . 1 . . . . 417 PHE N . 16279 1 605 . 1 1 151 151 TYR H H 1 9.34 0.02 . 1 . . . . 418 TYR H . 16279 1 606 . 1 1 151 151 TYR C C 13 177.59 0.05 . 1 . . . . 418 TYR C . 16279 1 607 . 1 1 151 151 TYR CA C 13 61.98 0.05 . 1 . . . . 418 TYR CA . 16279 1 608 . 1 1 151 151 TYR CB C 13 37.23 0.05 . 1 . . . . 418 TYR CB . 16279 1 609 . 1 1 151 151 TYR N N 15 122.07 0.05 . 1 . . . . 418 TYR N . 16279 1 610 . 1 1 152 152 SER H H 1 7.61 0.02 . 1 . . . . 419 SER H . 16279 1 611 . 1 1 152 152 SER C C 13 175.82 0.05 . 1 . . . . 419 SER C . 16279 1 612 . 1 1 152 152 SER CA C 13 60.68 0.05 . 1 . . . . 419 SER CA . 16279 1 613 . 1 1 152 152 SER CB C 13 61.90 0.05 . 1 . . . . 419 SER CB . 16279 1 614 . 1 1 152 152 SER N N 15 111.72 0.05 . 1 . . . . 419 SER N . 16279 1 615 . 1 1 153 153 ALA H H 1 6.61 0.02 . 1 . . . . 420 ALA H . 16279 1 616 . 1 1 153 153 ALA C C 13 179.58 0.05 . 1 . . . . 420 ALA C . 16279 1 617 . 1 1 153 153 ALA CA C 13 53.36 0.05 . 1 . . . . 420 ALA CA . 16279 1 618 . 1 1 153 153 ALA CB C 13 18.07 0.05 . 1 . . . . 420 ALA CB . 16279 1 619 . 1 1 153 153 ALA N N 15 120.80 0.05 . 1 . . . . 420 ALA N . 16279 1 620 . 1 1 154 154 PHE H H 1 7.59 0.02 . 1 . . . . 421 PHE H . 16279 1 621 . 1 1 154 154 PHE C C 13 176.38 0.05 . 1 . . . . 421 PHE C . 16279 1 622 . 1 1 154 154 PHE CA C 13 57.17 0.05 . 1 . . . . 421 PHE CA . 16279 1 623 . 1 1 154 154 PHE CB C 13 37.47 0.05 . 1 . . . . 421 PHE CB . 16279 1 624 . 1 1 154 154 PHE N N 15 112.94 0.05 . 1 . . . . 421 PHE N . 16279 1 625 . 1 1 155 155 SER H H 1 7.58 0.02 . 1 . . . . 422 SER H . 16279 1 626 . 1 1 155 155 SER C C 13 176.41 0.05 . 1 . . . . 422 SER C . 16279 1 627 . 1 1 155 155 SER CA C 13 61.84 0.05 . 1 . . . . 422 SER CA . 16279 1 628 . 1 1 155 155 SER CB C 13 59.50 0.05 . 1 . . . . 422 SER CB . 16279 1 629 . 1 1 155 155 SER N N 15 117.26 0.05 . 1 . . . . 422 SER N . 16279 1 630 . 1 1 156 156 LYS H H 1 8.01 0.02 . 1 . . . . 423 LYS H . 16279 1 631 . 1 1 156 156 LYS C C 13 177.34 0.05 . 1 . . . . 423 LYS C . 16279 1 632 . 1 1 156 156 LYS CA C 13 59.51 0.05 . 1 . . . . 423 LYS CA . 16279 1 633 . 1 1 156 156 LYS CB C 13 30.69 0.05 . 1 . . . . 423 LYS CB . 16279 1 634 . 1 1 156 156 LYS N N 15 121.33 0.05 . 1 . . . . 423 LYS N . 16279 1 635 . 1 1 157 157 ASN H H 1 7.26 0.02 . 1 . . . . 424 ASN H . 16279 1 636 . 1 1 157 157 ASN C C 13 176.61 0.05 . 1 . . . . 424 ASN C . 16279 1 637 . 1 1 157 157 ASN CA C 13 58.08 0.05 . 1 . . . . 424 ASN CA . 16279 1 638 . 1 1 157 157 ASN CB C 13 37.50 0.05 . 1 . . . . 424 ASN CB . 16279 1 639 . 1 1 157 157 ASN N N 15 115.98 0.05 . 1 . . . . 424 ASN N . 16279 1 640 . 1 1 160 160 LEU C C 13 179.70 0.05 . 1 . . . . 427 LEU C . 16279 1 641 . 1 1 160 160 LEU CA C 13 57.23 0.05 . 1 . . . . 427 LEU CA . 16279 1 642 . 1 1 160 160 LEU CB C 13 40.07 0.05 . 1 . . . . 427 LEU CB . 16279 1 643 . 1 1 161 161 GLY H H 1 7.78 0.02 . 1 . . . . 428 GLY H . 16279 1 644 . 1 1 161 161 GLY C C 13 174.91 0.05 . 1 . . . . 428 GLY C . 16279 1 645 . 1 1 161 161 GLY CA C 13 44.98 0.05 . 1 . . . . 428 GLY CA . 16279 1 646 . 1 1 161 161 GLY N N 15 110.07 0.05 . 1 . . . . 428 GLY N . 16279 1 647 . 1 1 162 162 VAL H H 1 7.78 0.02 . 1 . . . . 429 VAL H . 16279 1 648 . 1 1 162 162 VAL C C 13 177.20 0.05 . 1 . . . . 429 VAL C . 16279 1 649 . 1 1 162 162 VAL CA C 13 65.44 0.05 . 1 . . . . 429 VAL CA . 16279 1 650 . 1 1 162 162 VAL CB C 13 29.45 0.05 . 1 . . . . 429 VAL CB . 16279 1 651 . 1 1 162 162 VAL N N 15 121.23 0.05 . 1 . . . . 429 VAL N . 16279 1 652 . 1 1 163 163 HIS H H 1 7.68 0.02 . 1 . . . . 430 HIS H . 16279 1 653 . 1 1 163 163 HIS C C 13 177.06 0.05 . 1 . . . . 430 HIS C . 16279 1 654 . 1 1 163 163 HIS CA C 13 59.64 0.05 . 1 . . . . 430 HIS CA . 16279 1 655 . 1 1 163 163 HIS CB C 13 30.24 0.05 . 1 . . . . 430 HIS CB . 16279 1 656 . 1 1 163 163 HIS N N 15 116.94 0.05 . 1 . . . . 430 HIS N . 16279 1 657 . 1 1 164 164 GLU H H 1 7.83 0.02 . 1 . . . . 431 GLU H . 16279 1 658 . 1 1 164 164 GLU C C 13 176.89 0.05 . 1 . . . . 431 GLU C . 16279 1 659 . 1 1 164 164 GLU CA C 13 57.60 0.05 . 1 . . . . 431 GLU CA . 16279 1 660 . 1 1 164 164 GLU CB C 13 31.49 0.05 . 1 . . . . 431 GLU CB . 16279 1 661 . 1 1 164 164 GLU N N 15 115.67 0.05 . 1 . . . . 431 GLU N . 16279 1 662 . 1 1 165 165 ASP H H 1 8.62 0.02 . 1 . . . . 432 ASP H . 16279 1 663 . 1 1 165 165 ASP C C 13 175.06 0.05 . 1 . . . . 432 ASP C . 16279 1 664 . 1 1 165 165 ASP CA C 13 53.22 0.05 . 1 . . . . 432 ASP CA . 16279 1 665 . 1 1 165 165 ASP CB C 13 40.66 0.05 . 1 . . . . 432 ASP CB . 16279 1 666 . 1 1 165 165 ASP N N 15 121.81 0.05 . 1 . . . . 432 ASP N . 16279 1 667 . 1 1 166 166 THR H H 1 7.85 0.02 . 1 . . . . 433 THR H . 16279 1 668 . 1 1 166 166 THR C C 13 176.53 0.05 . 1 . . . . 433 THR C . 16279 1 669 . 1 1 166 166 THR CA C 13 64.87 0.05 . 1 . . . . 433 THR CA . 16279 1 670 . 1 1 166 166 THR CB C 13 68.11 0.05 . 1 . . . . 433 THR CB . 16279 1 671 . 1 1 166 166 THR N N 15 118.01 0.05 . 1 . . . . 433 THR N . 16279 1 672 . 1 1 167 167 GLN H H 1 8.08 0.02 . 1 . . . . 434 GLN H . 16279 1 673 . 1 1 167 167 GLN C C 13 177.79 0.05 . 1 . . . . 434 GLN C . 16279 1 674 . 1 1 167 167 GLN CA C 13 57.78 0.05 . 1 . . . . 434 GLN CA . 16279 1 675 . 1 1 167 167 GLN CB C 13 28.16 0.05 . 1 . . . . 434 GLN CB . 16279 1 676 . 1 1 167 167 GLN N N 15 119.53 0.05 . 1 . . . . 434 GLN N . 16279 1 677 . 1 1 168 168 ASN H H 1 8.08 0.02 . 1 . . . . 435 ASN H . 16279 1 678 . 1 1 168 168 ASN C C 13 175.42 0.05 . 1 . . . . 435 ASN C . 16279 1 679 . 1 1 168 168 ASN CA C 13 52.41 0.05 . 1 . . . . 435 ASN CA . 16279 1 680 . 1 1 168 168 ASN CB C 13 38.95 0.05 . 1 . . . . 435 ASN CB . 16279 1 681 . 1 1 168 168 ASN N N 15 114.28 0.05 . 1 . . . . 435 ASN N . 16279 1 682 . 1 1 169 169 ARG H H 1 7.57 0.02 . 1 . . . . 436 ARG H . 16279 1 683 . 1 1 169 169 ARG C C 13 176.42 0.05 . 1 . . . . 436 ARG C . 16279 1 684 . 1 1 169 169 ARG CA C 13 60.50 0.05 . 1 . . . . 436 ARG CA . 16279 1 685 . 1 1 169 169 ARG CB C 13 29.54 0.05 . 1 . . . . 436 ARG CB . 16279 1 686 . 1 1 169 169 ARG N N 15 120.52 0.05 . 1 . . . . 436 ARG N . 16279 1 687 . 1 1 170 170 ALA H H 1 8.41 0.02 . 1 . . . . 437 ALA H . 16279 1 688 . 1 1 170 170 ALA C C 13 179.65 0.05 . 1 . . . . 437 ALA C . 16279 1 689 . 1 1 170 170 ALA CA C 13 55.03 0.05 . 1 . . . . 437 ALA CA . 16279 1 690 . 1 1 170 170 ALA CB C 13 16.59 0.05 . 1 . . . . 437 ALA CB . 16279 1 691 . 1 1 170 170 ALA N N 15 121.58 0.05 . 1 . . . . 437 ALA N . 16279 1 692 . 1 1 171 171 ALA H H 1 7.58 0.02 . 1 . . . . 438 ALA H . 16279 1 693 . 1 1 171 171 ALA C C 13 181.98 0.05 . 1 . . . . 438 ALA C . 16279 1 694 . 1 1 171 171 ALA CA C 13 54.14 0.05 . 1 . . . . 438 ALA CA . 16279 1 695 . 1 1 171 171 ALA CB C 13 17.56 0.05 . 1 . . . . 438 ALA CB . 16279 1 696 . 1 1 171 171 ALA N N 15 120.52 0.05 . 1 . . . . 438 ALA N . 16279 1 697 . 1 1 172 172 LEU H H 1 8.11 0.02 . 1 . . . . 439 LEU H . 16279 1 698 . 1 1 172 172 LEU C C 13 179.02 0.05 . 1 . . . . 439 LEU C . 16279 1 699 . 1 1 172 172 LEU CA C 13 56.80 0.05 . 1 . . . . 439 LEU CA . 16279 1 700 . 1 1 172 172 LEU CB C 13 41.61 0.05 . 1 . . . . 439 LEU CB . 16279 1 701 . 1 1 172 172 LEU N N 15 118.94 0.05 . 1 . . . . 439 LEU N . 16279 1 702 . 1 1 173 173 ALA H H 1 8.43 0.02 . 1 . . . . 440 ALA H . 16279 1 703 . 1 1 173 173 ALA C C 13 179.91 0.05 . 1 . . . . 440 ALA C . 16279 1 704 . 1 1 173 173 ALA CA C 13 53.65 0.05 . 1 . . . . 440 ALA CA . 16279 1 705 . 1 1 173 173 ALA CB C 13 17.96 0.05 . 1 . . . . 440 ALA CB . 16279 1 706 . 1 1 173 173 ALA N N 15 119.75 0.05 . 1 . . . . 440 ALA N . 16279 1 707 . 1 1 174 174 LYS H H 1 7.27 0.02 . 1 . . . . 441 LYS H . 16279 1 708 . 1 1 174 174 LYS C C 13 176.70 0.05 . 1 . . . . 441 LYS C . 16279 1 709 . 1 1 174 174 LYS CA C 13 58.10 0.05 . 1 . . . . 441 LYS CA . 16279 1 710 . 1 1 174 174 LYS CB C 13 31.37 0.05 . 1 . . . . 441 LYS CB . 16279 1 711 . 1 1 174 174 LYS N N 15 115.76 0.05 . 1 . . . . 441 LYS N . 16279 1 712 . 1 1 175 175 LEU C C 13 180.87 0.05 . 1 . . . . 442 LEU C . 16279 1 713 . 1 1 175 175 LEU CA C 13 59.45 0.05 . 1 . . . . 442 LEU CA . 16279 1 714 . 1 1 175 175 LEU CB C 13 37.10 0.05 . 1 . . . . 442 LEU CB . 16279 1 715 . 1 1 176 176 LEU H H 1 7.76 0.02 . 1 . . . . 443 LEU H . 16279 1 716 . 1 1 176 176 LEU C C 13 178.86 0.05 . 1 . . . . 443 LEU C . 16279 1 717 . 1 1 176 176 LEU CA C 13 54.50 0.05 . 1 . . . . 443 LEU CA . 16279 1 718 . 1 1 176 176 LEU CB C 13 41.41 0.05 . 1 . . . . 443 LEU CB . 16279 1 719 . 1 1 176 176 LEU N N 15 121.48 0.05 . 1 . . . . 443 LEU N . 16279 1 720 . 1 1 177 177 ARG H H 1 7.51 0.02 . 1 . . . . 444 ARG H . 16279 1 721 . 1 1 177 177 ARG C C 13 173.20 0.05 . 1 . . . . 444 ARG C . 16279 1 722 . 1 1 177 177 ARG CA C 13 52.50 0.05 . 1 . . . . 444 ARG CA . 16279 1 723 . 1 1 177 177 ARG CB C 13 33.19 0.05 . 1 . . . . 444 ARG CB . 16279 1 724 . 1 1 177 177 ARG N N 15 121.54 0.05 . 1 . . . . 444 ARG N . 16279 1 725 . 1 1 178 178 TYR H H 1 8.53 0.02 . 1 . . . . 445 TYR H . 16279 1 726 . 1 1 178 178 TYR C C 13 176.39 0.05 . 1 . . . . 445 TYR C . 16279 1 727 . 1 1 178 178 TYR CA C 13 57.73 0.05 . 1 . . . . 445 TYR CA . 16279 1 728 . 1 1 178 178 TYR CB C 13 44.34 0.05 . 1 . . . . 445 TYR CB . 16279 1 729 . 1 1 178 178 TYR N N 15 117.62 0.05 . 1 . . . . 445 TYR N . 16279 1 730 . 1 1 179 179 ASN H H 1 9.69 0.02 . 1 . . . . 446 ASN H . 16279 1 731 . 1 1 179 179 ASN C C 13 173.26 0.05 . 1 . . . . 446 ASN C . 16279 1 732 . 1 1 179 179 ASN CA C 13 54.47 0.05 . 1 . . . . 446 ASN CA . 16279 1 733 . 1 1 179 179 ASN CB C 13 41.28 0.05 . 1 . . . . 446 ASN CB . 16279 1 734 . 1 1 179 179 ASN N N 15 118.93 0.05 . 1 . . . . 446 ASN N . 16279 1 735 . 1 1 180 180 SER H H 1 8.33 0.02 . 1 . . . . 447 SER H . 16279 1 736 . 1 1 180 180 SER C C 13 174.78 0.05 . 1 . . . . 447 SER C . 16279 1 737 . 1 1 180 180 SER CA C 13 56.04 0.05 . 1 . . . . 447 SER CA . 16279 1 738 . 1 1 180 180 SER CB C 13 67.81 0.05 . 1 . . . . 447 SER CB . 16279 1 739 . 1 1 180 180 SER N N 15 114.99 0.05 . 1 . . . . 447 SER N . 16279 1 740 . 1 1 181 181 THR H H 1 8.02 0.02 . 1 . . . . 448 THR H . 16279 1 741 . 1 1 181 181 THR C C 13 176.29 0.05 . 1 . . . . 448 THR C . 16279 1 742 . 1 1 181 181 THR CA C 13 63.28 0.05 . 1 . . . . 448 THR CA . 16279 1 743 . 1 1 181 181 THR CB C 13 68.56 0.05 . 1 . . . . 448 THR CB . 16279 1 744 . 1 1 181 181 THR N N 15 107.30 0.05 . 1 . . . . 448 THR N . 16279 1 745 . 1 1 182 182 LYS H H 1 7.57 0.02 . 1 . . . . 449 LYS H . 16279 1 746 . 1 1 182 182 LYS C C 13 174.51 0.05 . 1 . . . . 449 LYS C . 16279 1 747 . 1 1 182 182 LYS CA C 13 55.68 0.05 . 1 . . . . 449 LYS CA . 16279 1 748 . 1 1 182 182 LYS CB C 13 31.91 0.05 . 1 . . . . 449 LYS CB . 16279 1 749 . 1 1 182 182 LYS N N 15 118.91 0.05 . 1 . . . . 449 LYS N . 16279 1 750 . 1 1 183 183 SER H H 1 7.45 0.02 . 1 . . . . 450 SER H . 16279 1 751 . 1 1 183 183 SER C C 13 174.66 0.05 . 1 . . . . 450 SER C . 16279 1 752 . 1 1 183 183 SER CA C 13 56.83 0.05 . 1 . . . . 450 SER CA . 16279 1 753 . 1 1 183 183 SER CB C 13 61.51 0.05 . 1 . . . . 450 SER CB . 16279 1 754 . 1 1 183 183 SER N N 15 119.21 0.05 . 1 . . . . 450 SER N . 16279 1 755 . 1 1 184 184 VAL H H 1 8.52 0.02 . 1 . . . . 451 VAL H . 16279 1 756 . 1 1 184 184 VAL C C 13 176.00 0.05 . 1 . . . . 451 VAL C . 16279 1 757 . 1 1 184 184 VAL CA C 13 64.14 0.05 . 1 . . . . 451 VAL CA . 16279 1 758 . 1 1 184 184 VAL CB C 13 31.36 0.05 . 1 . . . . 451 VAL CB . 16279 1 759 . 1 1 184 184 VAL N N 15 124.65 0.05 . 1 . . . . 451 VAL N . 16279 1 760 . 1 1 185 185 ASP H H 1 8.18 0.02 . 1 . . . . 452 ASP H . 16279 1 761 . 1 1 185 185 ASP C C 13 175.31 0.05 . 1 . . . . 452 ASP C . 16279 1 762 . 1 1 185 185 ASP CA C 13 53.93 0.05 . 1 . . . . 452 ASP CA . 16279 1 763 . 1 1 185 185 ASP CB C 13 41.11 0.05 . 1 . . . . 452 ASP CB . 16279 1 764 . 1 1 185 185 ASP N N 15 117.88 0.05 . 1 . . . . 452 ASP N . 16279 1 765 . 1 1 186 186 GLU H H 1 7.45 0.02 . 1 . . . . 453 GLU H . 16279 1 766 . 1 1 186 186 GLU C C 13 175.53 0.05 . 1 . . . . 453 GLU C . 16279 1 767 . 1 1 186 186 GLU CA C 13 54.09 0.05 . 1 . . . . 453 GLU CA . 16279 1 768 . 1 1 186 186 GLU CB C 13 31.23 0.05 . 1 . . . . 453 GLU CB . 16279 1 769 . 1 1 186 186 GLU N N 15 118.17 0.05 . 1 . . . . 453 GLU N . 16279 1 770 . 1 1 187 187 LEU H H 1 8.58 0.02 . 1 . . . . 454 LEU H . 16279 1 771 . 1 1 187 187 LEU C C 13 176.65 0.05 . 1 . . . . 454 LEU C . 16279 1 772 . 1 1 187 187 LEU CA C 13 54.42 0.05 . 1 . . . . 454 LEU CA . 16279 1 773 . 1 1 187 187 LEU CB C 13 42.09 0.05 . 1 . . . . 454 LEU CB . 16279 1 774 . 1 1 187 187 LEU N N 15 123.32 0.05 . 1 . . . . 454 LEU N . 16279 1 775 . 1 1 188 188 THR H H 1 9.19 0.02 . 1 . . . . 455 THR H . 16279 1 776 . 1 1 188 188 THR C C 13 171.62 0.05 . 1 . . . . 455 THR C . 16279 1 777 . 1 1 188 188 THR CA C 13 58.91 0.05 . 1 . . . . 455 THR CA . 16279 1 778 . 1 1 188 188 THR CB C 13 69.97 0.05 . 1 . . . . 455 THR CB . 16279 1 779 . 1 1 188 188 THR N N 15 117.27 0.05 . 1 . . . . 455 THR N . 16279 1 780 . 1 1 189 189 SER H H 1 8.49 0.02 . 1 . . . . 456 SER H . 16279 1 781 . 1 1 189 189 SER C C 13 174.97 0.05 . 1 . . . . 456 SER C . 16279 1 782 . 1 1 189 189 SER CA C 13 55.09 0.05 . 1 . . . . 456 SER CA . 16279 1 783 . 1 1 189 189 SER CB C 13 66.22 0.05 . 1 . . . . 456 SER CB . 16279 1 784 . 1 1 189 189 SER N N 15 119.19 0.05 . 1 . . . . 456 SER N . 16279 1 785 . 1 1 190 190 LEU H H 1 9.16 0.02 . 1 . . . . 457 LEU H . 16279 1 786 . 1 1 190 190 LEU C C 13 178.25 0.05 . 1 . . . . 457 LEU C . 16279 1 787 . 1 1 190 190 LEU CA C 13 57.72 0.05 . 1 . . . . 457 LEU CA . 16279 1 788 . 1 1 190 190 LEU CB C 13 38.36 0.05 . 1 . . . . 457 LEU CB . 16279 1 789 . 1 1 190 190 LEU N N 15 121.16 0.05 . 1 . . . . 457 LEU N . 16279 1 790 . 1 1 191 191 THR H H 1 7.81 0.02 . 1 . . . . 458 THR H . 16279 1 791 . 1 1 191 191 THR C C 13 176.44 0.05 . 1 . . . . 458 THR C . 16279 1 792 . 1 1 191 191 THR CA C 13 66.83 0.05 . 1 . . . . 458 THR CA . 16279 1 793 . 1 1 191 191 THR CB C 13 68.07 0.05 . 1 . . . . 458 THR CB . 16279 1 794 . 1 1 191 191 THR N N 15 115.58 0.05 . 1 . . . . 458 THR N . 16279 1 795 . 1 1 192 192 ASP H H 1 7.85 0.02 . 1 . . . . 459 ASP H . 16279 1 796 . 1 1 192 192 ASP C C 13 178.27 0.05 . 1 . . . . 459 ASP C . 16279 1 797 . 1 1 192 192 ASP CA C 13 56.74 0.05 . 1 . . . . 459 ASP CA . 16279 1 798 . 1 1 192 192 ASP CB C 13 38.48 0.05 . 1 . . . . 459 ASP CB . 16279 1 799 . 1 1 192 192 ASP N N 15 123.15 0.05 . 1 . . . . 459 ASP N . 16279 1 800 . 1 1 194 194 VAL C C 13 179.38 0.05 . 1 . . . . 461 VAL C . 16279 1 801 . 1 1 194 194 VAL CA C 13 66.14 0.05 . 1 . . . . 461 VAL CA . 16279 1 802 . 1 1 194 194 VAL CB C 13 30.30 0.05 . 1 . . . . 461 VAL CB . 16279 1 803 . 1 1 195 195 THR H H 1 7.96 0.02 . 1 . . . . 462 THR H . 16279 1 804 . 1 1 195 195 THR C C 13 175.36 0.05 . 1 . . . . 462 THR C . 16279 1 805 . 1 1 195 195 THR CA C 13 65.20 0.05 . 1 . . . . 462 THR CA . 16279 1 806 . 1 1 195 195 THR CB C 13 68.38 0.05 . 1 . . . . 462 THR CB . 16279 1 807 . 1 1 195 195 THR N N 15 115.81 0.05 . 1 . . . . 462 THR N . 16279 1 808 . 1 1 196 196 ARG H H 1 7.09 0.02 . 1 . . . . 463 ARG H . 16279 1 809 . 1 1 196 196 ARG C C 13 176.77 0.05 . 1 . . . . 463 ARG C . 16279 1 810 . 1 1 196 196 ARG CA C 13 56.77 0.05 . 1 . . . . 463 ARG CA . 16279 1 811 . 1 1 196 196 ARG CB C 13 31.88 0.05 . 1 . . . . 463 ARG CB . 16279 1 812 . 1 1 196 196 ARG N N 15 118.94 0.05 . 1 . . . . 463 ARG N . 16279 1 813 . 1 1 197 197 MET H H 1 7.38 0.02 . 1 . . . . 464 MET H . 16279 1 814 . 1 1 197 197 MET C C 13 174.52 0.05 . 1 . . . . 464 MET C . 16279 1 815 . 1 1 197 197 MET CA C 13 54.89 0.05 . 1 . . . . 464 MET CA . 16279 1 816 . 1 1 197 197 MET CB C 13 32.67 0.05 . 1 . . . . 464 MET CB . 16279 1 817 . 1 1 197 197 MET N N 15 122.22 0.05 . 1 . . . . 464 MET N . 16279 1 818 . 1 1 198 198 PRO CA C 13 58.76 0.05 . 1 . . . . 465 PRO CA . 16279 1 819 . 1 1 198 198 PRO CB C 13 28.88 0.05 . 1 . . . . 465 PRO CB . 16279 1 820 . 1 1 199 199 GLU H H 1 7.88 0.02 . 1 . . . . 466 GLU H . 16279 1 821 . 1 1 199 199 GLU C C 13 175.00 0.05 . 1 . . . . 466 GLU C . 16279 1 822 . 1 1 199 199 GLU CA C 13 55.55 0.05 . 1 . . . . 466 GLU CA . 16279 1 823 . 1 1 199 199 GLU CB C 13 29.09 0.05 . 1 . . . . 466 GLU CB . 16279 1 824 . 1 1 199 199 GLU N N 15 111.18 0.05 . 1 . . . . 466 GLU N . 16279 1 825 . 1 1 200 200 HIS H H 1 7.42 0.02 . 1 . . . . 467 HIS H . 16279 1 826 . 1 1 200 200 HIS C C 13 168.74 0.05 . 1 . . . . 467 HIS C . 16279 1 827 . 1 1 200 200 HIS CA C 13 55.04 0.05 . 1 . . . . 467 HIS CA . 16279 1 828 . 1 1 200 200 HIS CB C 13 29.14 0.05 . 1 . . . . 467 HIS CB . 16279 1 829 . 1 1 200 200 HIS N N 15 125.12 0.05 . 1 . . . . 467 HIS N . 16279 1 830 . 1 1 207 207 ILE C C 13 171.74 0.05 . 1 . . . . 474 ILE C . 16279 1 831 . 1 1 207 207 ILE CA C 13 58.92 0.05 . 1 . . . . 474 ILE CA . 16279 1 832 . 1 1 207 207 ILE CB C 13 41.21 0.05 . 1 . . . . 474 ILE CB . 16279 1 833 . 1 1 208 208 THR H H 1 8.24 0.02 . 1 . . . . 475 THR H . 16279 1 834 . 1 1 208 208 THR C C 13 174.22 0.05 . 1 . . . . 475 THR C . 16279 1 835 . 1 1 208 208 THR CA C 13 58.61 0.05 . 1 . . . . 475 THR CA . 16279 1 836 . 1 1 208 208 THR CB C 13 69.84 0.05 . 1 . . . . 475 THR CB . 16279 1 837 . 1 1 208 208 THR N N 15 118.34 0.05 . 1 . . . . 475 THR N . 16279 1 838 . 1 1 209 209 GLY H H 1 7.78 0.02 . 1 . . . . 476 GLY H . 16279 1 839 . 1 1 209 209 GLY C C 13 172.63 0.05 . 1 . . . . 476 GLY C . 16279 1 840 . 1 1 209 209 GLY CA C 13 44.69 0.05 . 1 . . . . 476 GLY CA . 16279 1 841 . 1 1 209 209 GLY N N 15 106.51 0.05 . 1 . . . . 476 GLY N . 16279 1 842 . 1 1 210 210 GLU H H 1 8.63 0.02 . 1 . . . . 477 GLU H . 16279 1 843 . 1 1 210 210 GLU C C 13 175.95 0.05 . 1 . . . . 477 GLU C . 16279 1 844 . 1 1 210 210 GLU CA C 13 57.37 0.05 . 1 . . . . 477 GLU CA . 16279 1 845 . 1 1 210 210 GLU CB C 13 29.36 0.05 . 1 . . . . 477 GLU CB . 16279 1 846 . 1 1 210 210 GLU N N 15 116.77 0.05 . 1 . . . . 477 GLU N . 16279 1 847 . 1 1 211 211 SER H H 1 7.30 0.02 . 1 . . . . 478 SER H . 16279 1 848 . 1 1 211 211 SER C C 13 173.60 0.05 . 1 . . . . 478 SER C . 16279 1 849 . 1 1 211 211 SER CA C 13 56.25 0.05 . 1 . . . . 478 SER CA . 16279 1 850 . 1 1 211 211 SER CB C 13 64.22 0.05 . 1 . . . . 478 SER CB . 16279 1 851 . 1 1 211 211 SER N N 15 109.35 0.05 . 1 . . . . 478 SER N . 16279 1 852 . 1 1 212 212 LEU H H 1 8.75 0.02 . 1 . . . . 479 LEU H . 16279 1 853 . 1 1 212 212 LEU C C 13 177.98 0.05 . 1 . . . . 479 LEU C . 16279 1 854 . 1 1 212 212 LEU CA C 13 57.48 0.05 . 1 . . . . 479 LEU CA . 16279 1 855 . 1 1 212 212 LEU CB C 13 39.88 0.05 . 1 . . . . 479 LEU CB . 16279 1 856 . 1 1 212 212 LEU N N 15 123.90 0.05 . 1 . . . . 479 LEU N . 16279 1 857 . 1 1 213 213 LYS H H 1 7.88 0.02 . 1 . . . . 480 LYS H . 16279 1 858 . 1 1 213 213 LYS C C 13 178.46 0.05 . 1 . . . . 480 LYS C . 16279 1 859 . 1 1 213 213 LYS CA C 13 57.64 0.05 . 1 . . . . 480 LYS CA . 16279 1 860 . 1 1 213 213 LYS CB C 13 30.59 0.05 . 1 . . . . 480 LYS CB . 16279 1 861 . 1 1 213 213 LYS N N 15 116.91 0.05 . 1 . . . . 480 LYS N . 16279 1 862 . 1 1 214 214 ALA H H 1 7.44 0.02 . 1 . . . . 481 ALA H . 16279 1 863 . 1 1 214 214 ALA C C 13 180.10 0.05 . 1 . . . . 481 ALA C . 16279 1 864 . 1 1 214 214 ALA CA C 13 53.59 0.05 . 1 . . . . 481 ALA CA . 16279 1 865 . 1 1 214 214 ALA CB C 13 18.26 0.05 . 1 . . . . 481 ALA CB . 16279 1 866 . 1 1 214 214 ALA N N 15 119.22 0.05 . 1 . . . . 481 ALA N . 16279 1 867 . 1 1 215 215 VAL H H 1 7.42 0.02 . 1 . . . . 482 VAL H . 16279 1 868 . 1 1 215 215 VAL C C 13 177.09 0.05 . 1 . . . . 482 VAL C . 16279 1 869 . 1 1 215 215 VAL CA C 13 62.81 0.05 . 1 . . . . 482 VAL CA . 16279 1 870 . 1 1 215 215 VAL CB C 13 31.12 0.05 . 1 . . . . 482 VAL CB . 16279 1 871 . 1 1 215 215 VAL N N 15 112.99 0.05 . 1 . . . . 482 VAL N . 16279 1 872 . 1 1 216 216 GLU H H 1 7.63 0.02 . 1 . . . . 483 GLU H . 16279 1 873 . 1 1 216 216 GLU C C 13 176.54 0.05 . 1 . . . . 483 GLU C . 16279 1 874 . 1 1 216 216 GLU CA C 13 58.09 0.05 . 1 . . . . 483 GLU CA . 16279 1 875 . 1 1 216 216 GLU CB C 13 28.08 0.05 . 1 . . . . 483 GLU CB . 16279 1 876 . 1 1 216 216 GLU N N 15 118.49 0.05 . 1 . . . . 483 GLU N . 16279 1 877 . 1 1 217 217 LYS H H 1 7.27 0.02 . 1 . . . . 484 LYS H . 16279 1 878 . 1 1 217 217 LYS C C 13 176.27 0.05 . 1 . . . . 484 LYS C . 16279 1 879 . 1 1 217 217 LYS CA C 13 53.78 0.05 . 1 . . . . 484 LYS CA . 16279 1 880 . 1 1 217 217 LYS CB C 13 30.95 0.05 . 1 . . . . 484 LYS CB . 16279 1 881 . 1 1 217 217 LYS N N 15 116.07 0.05 . 1 . . . . 484 LYS N . 16279 1 882 . 1 1 218 218 SER H H 1 7.40 0.02 . 1 . . . . 485 SER H . 16279 1 883 . 1 1 218 218 SER C C 13 176.63 0.05 . 1 . . . . 485 SER C . 16279 1 884 . 1 1 218 218 SER CA C 13 56.25 0.05 . 1 . . . . 485 SER CA . 16279 1 885 . 1 1 218 218 SER CB C 13 63.65 0.05 . 1 . . . . 485 SER CB . 16279 1 886 . 1 1 218 218 SER N N 15 116.64 0.05 . 1 . . . . 485 SER N . 16279 1 887 . 1 1 219 219 PRO CA C 13 63.62 0.05 . 1 . . . . 486 PRO CA . 16279 1 888 . 1 1 219 219 PRO CB C 13 30.51 0.05 . 1 . . . . 486 PRO CB . 16279 1 889 . 1 1 220 220 PHE H H 1 7.67 0.02 . 1 . . . . 487 PHE H . 16279 1 890 . 1 1 220 220 PHE C C 13 176.97 0.05 . 1 . . . . 487 PHE C . 16279 1 891 . 1 1 220 220 PHE CA C 13 60.06 0.05 . 1 . . . . 487 PHE CA . 16279 1 892 . 1 1 220 220 PHE CB C 13 38.06 0.05 . 1 . . . . 487 PHE CB . 16279 1 893 . 1 1 220 220 PHE N N 15 116.00 0.05 . 1 . . . . 487 PHE N . 16279 1 894 . 1 1 221 221 LEU H H 1 7.53 0.02 . 1 . . . . 488 LEU H . 16279 1 895 . 1 1 221 221 LEU C C 13 179.26 0.05 . 1 . . . . 488 LEU C . 16279 1 896 . 1 1 221 221 LEU CA C 13 56.12 0.05 . 1 . . . . 488 LEU CA . 16279 1 897 . 1 1 221 221 LEU CB C 13 41.34 0.05 . 1 . . . . 488 LEU CB . 16279 1 898 . 1 1 221 221 LEU N N 15 114.79 0.05 . 1 . . . . 488 LEU N . 16279 1 899 . 1 1 222 222 ASP H H 1 7.49 0.02 . 1 . . . . 489 ASP H . 16279 1 900 . 1 1 222 222 ASP C C 13 178.76 0.05 . 1 . . . . 489 ASP C . 16279 1 901 . 1 1 222 222 ASP CA C 13 58.41 0.05 . 1 . . . . 489 ASP CA . 16279 1 902 . 1 1 222 222 ASP CB C 13 38.83 0.05 . 1 . . . . 489 ASP CB . 16279 1 903 . 1 1 222 222 ASP N N 15 120.63 0.05 . 1 . . . . 489 ASP N . 16279 1 904 . 1 1 223 223 ALA H H 1 8.46 0.02 . 1 . . . . 490 ALA H . 16279 1 905 . 1 1 223 223 ALA C C 13 179.11 0.05 . 1 . . . . 490 ALA C . 16279 1 906 . 1 1 223 223 ALA CA C 13 53.89 0.05 . 1 . . . . 490 ALA CA . 16279 1 907 . 1 1 223 223 ALA CB C 13 16.95 0.05 . 1 . . . . 490 ALA CB . 16279 1 908 . 1 1 223 223 ALA N N 15 121.06 0.05 . 1 . . . . 490 ALA N . 16279 1 909 . 1 1 224 224 LEU H H 1 6.80 0.02 . 1 . . . . 491 LEU H . 16279 1 910 . 1 1 224 224 LEU C C 13 179.15 0.05 . 1 . . . . 491 LEU C . 16279 1 911 . 1 1 224 224 LEU CA C 13 54.91 0.05 . 1 . . . . 491 LEU CA . 16279 1 912 . 1 1 224 224 LEU CB C 13 38.09 0.05 . 1 . . . . 491 LEU CB . 16279 1 913 . 1 1 224 224 LEU N N 15 120.64 0.05 . 1 . . . . 491 LEU N . 16279 1 914 . 1 1 225 225 LYS H H 1 8.29 0.02 . 1 . . . . 492 LYS H . 16279 1 915 . 1 1 225 225 LYS C C 13 180.88 0.05 . 1 . . . . 492 LYS C . 16279 1 916 . 1 1 225 225 LYS CA C 13 59.47 0.05 . 1 . . . . 492 LYS CA . 16279 1 917 . 1 1 225 225 LYS CB C 13 30.87 0.05 . 1 . . . . 492 LYS CB . 16279 1 918 . 1 1 225 225 LYS N N 15 121.34 0.05 . 1 . . . . 492 LYS N . 16279 1 919 . 1 1 226 226 ALA H H 1 7.76 0.02 . 1 . . . . 493 ALA H . 16279 1 920 . 1 1 226 226 ALA C C 13 178.82 0.05 . 1 . . . . 493 ALA C . 16279 1 921 . 1 1 226 226 ALA CA C 13 54.13 0.05 . 1 . . . . 493 ALA CA . 16279 1 922 . 1 1 226 226 ALA CB C 13 16.97 0.05 . 1 . . . . 493 ALA CB . 16279 1 923 . 1 1 226 226 ALA N N 15 121.41 0.05 . 1 . . . . 493 ALA N . 16279 1 924 . 1 1 227 227 LYS H H 1 6.66 0.02 . 1 . . . . 494 LYS H . 16279 1 925 . 1 1 227 227 LYS C C 13 174.63 0.05 . 1 . . . . 494 LYS C . 16279 1 926 . 1 1 227 227 LYS CA C 13 55.25 0.05 . 1 . . . . 494 LYS CA . 16279 1 927 . 1 1 227 227 LYS CB C 13 31.40 0.05 . 1 . . . . 494 LYS CB . 16279 1 928 . 1 1 227 227 LYS N N 15 115.95 0.05 . 1 . . . . 494 LYS N . 16279 1 929 . 1 1 228 228 ASN H H 1 7.76 0.02 . 1 . . . . 495 ASN H . 16279 1 930 . 1 1 228 228 ASN C C 13 174.19 0.05 . 1 . . . . 495 ASN C . 16279 1 931 . 1 1 228 228 ASN CA C 13 53.19 0.05 . 1 . . . . 495 ASN CA . 16279 1 932 . 1 1 228 228 ASN CB C 13 36.57 0.05 . 1 . . . . 495 ASN CB . 16279 1 933 . 1 1 228 228 ASN N N 15 115.06 0.05 . 1 . . . . 495 ASN N . 16279 1 934 . 1 1 229 229 PHE H H 1 7.57 0.02 . 1 . . . . 496 PHE H . 16279 1 935 . 1 1 229 229 PHE C C 13 174.99 0.05 . 1 . . . . 496 PHE C . 16279 1 936 . 1 1 229 229 PHE CA C 13 51.66 0.05 . 1 . . . . 496 PHE CA . 16279 1 937 . 1 1 229 229 PHE CB C 13 37.84 0.05 . 1 . . . . 496 PHE CB . 16279 1 938 . 1 1 229 229 PHE N N 15 116.33 0.05 . 1 . . . . 496 PHE N . 16279 1 939 . 1 1 230 230 GLU H H 1 9.58 0.02 . 1 . . . . 497 GLU H . 16279 1 940 . 1 1 230 230 GLU C C 13 176.11 0.05 . 1 . . . . 497 GLU C . 16279 1 941 . 1 1 230 230 GLU CA C 13 55.37 0.05 . 1 . . . . 497 GLU CA . 16279 1 942 . 1 1 230 230 GLU CB C 13 28.79 0.05 . 1 . . . . 497 GLU CB . 16279 1 943 . 1 1 230 230 GLU N N 15 127.01 0.05 . 1 . . . . 497 GLU N . 16279 1 944 . 1 1 231 231 VAL H H 1 8.26 0.02 . 1 . . . . 498 VAL H . 16279 1 945 . 1 1 231 231 VAL C C 13 175.20 0.05 . 1 . . . . 498 VAL C . 16279 1 946 . 1 1 231 231 VAL CA C 13 60.95 0.05 . 1 . . . . 498 VAL CA . 16279 1 947 . 1 1 231 231 VAL CB C 13 33.76 0.05 . 1 . . . . 498 VAL CB . 16279 1 948 . 1 1 231 231 VAL N N 15 128.35 0.05 . 1 . . . . 498 VAL N . 16279 1 949 . 1 1 234 234 LEU C C 13 177.29 0.05 . 1 . . . . 501 LEU C . 16279 1 950 . 1 1 234 234 LEU CA C 13 54.12 0.05 . 1 . . . . 501 LEU CA . 16279 1 951 . 1 1 234 234 LEU CB C 13 40.68 0.05 . 1 . . . . 501 LEU CB . 16279 1 952 . 1 1 235 235 THR H H 1 7.83 0.02 . 1 . . . . 502 THR H . 16279 1 953 . 1 1 235 235 THR C C 13 172.98 0.05 . 1 . . . . 502 THR C . 16279 1 954 . 1 1 235 235 THR CA C 13 60.23 0.05 . 1 . . . . 502 THR CA . 16279 1 955 . 1 1 235 235 THR CB C 13 68.28 0.05 . 1 . . . . 502 THR CB . 16279 1 956 . 1 1 235 235 THR N N 15 111.18 0.05 . 1 . . . . 502 THR N . 16279 1 957 . 1 1 236 236 ASP H H 1 8.07 0.02 . 1 . . . . 503 ASP H . 16279 1 958 . 1 1 236 236 ASP C C 13 176.03 0.05 . 1 . . . . 503 ASP C . 16279 1 959 . 1 1 236 236 ASP CA C 13 50.79 0.05 . 1 . . . . 503 ASP CA . 16279 1 960 . 1 1 236 236 ASP CB C 13 43.88 0.05 . 1 . . . . 503 ASP CB . 16279 1 961 . 1 1 236 236 ASP N N 15 123.34 0.05 . 1 . . . . 503 ASP N . 16279 1 962 . 1 1 237 237 PRO CA C 13 64.87 0.05 . 1 . . . . 504 PRO CA . 16279 1 963 . 1 1 237 237 PRO CB C 13 31.11 0.05 . 1 . . . . 504 PRO CB . 16279 1 964 . 1 1 238 238 ILE H H 1 8.76 0.02 . 1 . . . . 505 ILE H . 16279 1 965 . 1 1 238 238 ILE C C 13 177.78 0.05 . 1 . . . . 505 ILE C . 16279 1 966 . 1 1 238 238 ILE CA C 13 62.19 0.05 . 1 . . . . 505 ILE CA . 16279 1 967 . 1 1 238 238 ILE CB C 13 36.45 0.05 . 1 . . . . 505 ILE CB . 16279 1 968 . 1 1 238 238 ILE N N 15 116.37 0.05 . 1 . . . . 505 ILE N . 16279 1 969 . 1 1 239 239 ASP H H 1 7.98 0.02 . 1 . . . . 506 ASP H . 16279 1 970 . 1 1 239 239 ASP C C 13 177.54 0.05 . 1 . . . . 506 ASP C . 16279 1 971 . 1 1 239 239 ASP CA C 13 57.80 0.05 . 1 . . . . 506 ASP CA . 16279 1 972 . 1 1 239 239 ASP CB C 13 41.59 0.05 . 1 . . . . 506 ASP CB . 16279 1 973 . 1 1 239 239 ASP N N 15 122.08 0.05 . 1 . . . . 506 ASP N . 16279 1 974 . 1 1 240 240 GLU H H 1 7.33 0.02 . 1 . . . . 507 GLU H . 16279 1 975 . 1 1 240 240 GLU C C 13 178.12 0.05 . 1 . . . . 507 GLU C . 16279 1 976 . 1 1 240 240 GLU CA C 13 59.26 0.05 . 1 . . . . 507 GLU CA . 16279 1 977 . 1 1 240 240 GLU CB C 13 28.11 0.05 . 1 . . . . 507 GLU CB . 16279 1 978 . 1 1 240 240 GLU N N 15 119.15 0.05 . 1 . . . . 507 GLU N . 16279 1 979 . 1 1 241 241 TYR H H 1 7.57 0.02 . 1 . . . . 508 TYR H . 16279 1 980 . 1 1 241 241 TYR C C 13 174.51 0.05 . 1 . . . . 508 TYR C . 16279 1 981 . 1 1 241 241 TYR CA C 13 59.47 0.05 . 1 . . . . 508 TYR CA . 16279 1 982 . 1 1 241 241 TYR CB C 13 36.50 0.05 . 1 . . . . 508 TYR CB . 16279 1 983 . 1 1 241 241 TYR N N 15 119.07 0.05 . 1 . . . . 508 TYR N . 16279 1 984 . 1 1 242 242 ALA C C 13 178.62 0.05 . 1 . . . . 509 ALA C . 16279 1 985 . 1 1 242 242 ALA CA C 13 55.13 0.05 . 1 . . . . 509 ALA CA . 16279 1 986 . 1 1 242 242 ALA CB C 13 15.85 0.05 . 1 . . . . 509 ALA CB . 16279 1 987 . 1 1 243 243 PHE H H 1 8.35 0.02 . 1 . . . . 510 PHE H . 16279 1 988 . 1 1 243 243 PHE C C 13 178.42 0.05 . 1 . . . . 510 PHE C . 16279 1 989 . 1 1 243 243 PHE CA C 13 60.47 0.05 . 1 . . . . 510 PHE CA . 16279 1 990 . 1 1 243 243 PHE CB C 13 36.16 0.05 . 1 . . . . 510 PHE CB . 16279 1 991 . 1 1 243 243 PHE N N 15 118.80 0.05 . 1 . . . . 510 PHE N . 16279 1 992 . 1 1 244 244 THR H H 1 8.12 0.02 . 1 . . . . 511 THR H . 16279 1 993 . 1 1 244 244 THR C C 13 176.00 0.05 . 1 . . . . 511 THR C . 16279 1 994 . 1 1 244 244 THR CA C 13 65.04 0.05 . 1 . . . . 511 THR CA . 16279 1 995 . 1 1 244 244 THR CB C 13 68.31 0.05 . 1 . . . . 511 THR CB . 16279 1 996 . 1 1 244 244 THR N N 15 113.29 0.05 . 1 . . . . 511 THR N . 16279 1 997 . 1 1 245 245 GLN H H 1 7.08 0.02 . 1 . . . . 512 GLN H . 16279 1 998 . 1 1 245 245 GLN C C 13 176.86 0.05 . 1 . . . . 512 GLN C . 16279 1 999 . 1 1 245 245 GLN CA C 13 55.35 0.05 . 1 . . . . 512 GLN CA . 16279 1 1000 . 1 1 245 245 GLN CB C 13 28.24 0.05 . 1 . . . . 512 GLN CB . 16279 1 1001 . 1 1 245 245 GLN N N 15 117.35 0.05 . 1 . . . . 512 GLN N . 16279 1 1002 . 1 1 246 246 LEU H H 1 7.73 0.02 . 1 . . . . 513 LEU H . 16279 1 1003 . 1 1 246 246 LEU C C 13 178.16 0.05 . 1 . . . . 513 LEU C . 16279 1 1004 . 1 1 246 246 LEU CA C 13 56.82 0.05 . 1 . . . . 513 LEU CA . 16279 1 1005 . 1 1 246 246 LEU CB C 13 41.66 0.05 . 1 . . . . 513 LEU CB . 16279 1 1006 . 1 1 246 246 LEU N N 15 120.87 0.05 . 1 . . . . 513 LEU N . 16279 1 1007 . 1 1 247 247 LYS C C 13 177.10 0.05 . 1 . . . . 514 LYS C . 16279 1 1008 . 1 1 247 247 LYS CA C 13 61.30 0.05 . 1 . . . . 514 LYS CA . 16279 1 1009 . 1 1 247 247 LYS CB C 13 30.28 0.05 . 1 . . . . 514 LYS CB . 16279 1 1010 . 1 1 248 248 GLU H H 1 8.88 0.02 . 1 . . . . 515 GLU H . 16279 1 1011 . 1 1 248 248 GLU C C 13 173.21 0.05 . 1 . . . . 515 GLU C . 16279 1 1012 . 1 1 248 248 GLU CA C 13 54.00 0.05 . 1 . . . . 515 GLU CA . 16279 1 1013 . 1 1 248 248 GLU CB C 13 32.39 0.05 . 1 . . . . 515 GLU CB . 16279 1 1014 . 1 1 248 248 GLU N N 15 120.80 0.05 . 1 . . . . 515 GLU N . 16279 1 1015 . 1 1 249 249 PHE H H 1 8.52 0.02 . 1 . . . . 516 PHE H . 16279 1 1016 . 1 1 249 249 PHE C C 13 173.65 0.05 . 1 . . . . 516 PHE C . 16279 1 1017 . 1 1 249 249 PHE CA C 13 57.19 0.05 . 1 . . . . 516 PHE CA . 16279 1 1018 . 1 1 249 249 PHE CB C 13 40.95 0.05 . 1 . . . . 516 PHE CB . 16279 1 1019 . 1 1 249 249 PHE N N 15 120.47 0.05 . 1 . . . . 516 PHE N . 16279 1 1020 . 1 1 250 250 GLU H H 1 8.71 0.02 . 1 . . . . 517 GLU H . 16279 1 1021 . 1 1 250 250 GLU C C 13 176.10 0.05 . 1 . . . . 517 GLU C . 16279 1 1022 . 1 1 250 250 GLU CA C 13 56.22 0.05 . 1 . . . . 517 GLU CA . 16279 1 1023 . 1 1 250 250 GLU CB C 13 25.82 0.05 . 1 . . . . 517 GLU CB . 16279 1 1024 . 1 1 250 250 GLU N N 15 126.20 0.05 . 1 . . . . 517 GLU N . 16279 1 1025 . 1 1 251 251 GLY H H 1 8.29 0.02 . 1 . . . . 518 GLY H . 16279 1 1026 . 1 1 251 251 GLY C C 13 174.04 0.05 . 1 . . . . 518 GLY C . 16279 1 1027 . 1 1 251 251 GLY CA C 13 44.59 0.05 . 1 . . . . 518 GLY CA . 16279 1 1028 . 1 1 251 251 GLY N N 15 103.21 0.05 . 1 . . . . 518 GLY N . 16279 1 1029 . 1 1 252 252 LYS H H 1 7.81 0.02 . 1 . . . . 519 LYS H . 16279 1 1030 . 1 1 252 252 LYS C C 13 175.75 0.05 . 1 . . . . 519 LYS C . 16279 1 1031 . 1 1 252 252 LYS CA C 13 53.09 0.05 . 1 . . . . 519 LYS CA . 16279 1 1032 . 1 1 252 252 LYS CB C 13 31.27 0.05 . 1 . . . . 519 LYS CB . 16279 1 1033 . 1 1 252 252 LYS N N 15 120.94 0.05 . 1 . . . . 519 LYS N . 16279 1 1034 . 1 1 253 253 THR H H 1 8.23 0.02 . 1 . . . . 520 THR H . 16279 1 1035 . 1 1 253 253 THR C C 13 173.71 0.05 . 1 . . . . 520 THR C . 16279 1 1036 . 1 1 253 253 THR CA C 13 63.00 0.05 . 1 . . . . 520 THR CA . 16279 1 1037 . 1 1 253 253 THR CB C 13 68.63 0.05 . 1 . . . . 520 THR CB . 16279 1 1038 . 1 1 253 253 THR N N 15 118.35 0.05 . 1 . . . . 520 THR N . 16279 1 1039 . 1 1 254 254 LEU H H 1 7.66 0.02 . 1 . . . . 521 LEU H . 16279 1 1040 . 1 1 254 254 LEU C C 13 177.22 0.05 . 1 . . . . 521 LEU C . 16279 1 1041 . 1 1 254 254 LEU CA C 13 55.24 0.05 . 1 . . . . 521 LEU CA . 16279 1 1042 . 1 1 254 254 LEU CB C 13 40.37 0.05 . 1 . . . . 521 LEU CB . 16279 1 1043 . 1 1 254 254 LEU N N 15 125.64 0.05 . 1 . . . . 521 LEU N . 16279 1 1044 . 1 1 255 255 VAL H H 1 7.72 0.02 . 1 . . . . 522 VAL H . 16279 1 1045 . 1 1 255 255 VAL C C 13 172.48 0.05 . 1 . . . . 522 VAL C . 16279 1 1046 . 1 1 255 255 VAL CA C 13 61.44 0.05 . 1 . . . . 522 VAL CA . 16279 1 1047 . 1 1 255 255 VAL CB C 13 34.91 0.05 . 1 . . . . 522 VAL CB . 16279 1 1048 . 1 1 255 255 VAL N N 15 113.00 0.05 . 1 . . . . 522 VAL N . 16279 1 1049 . 1 1 256 256 ASP H H 1 8.11 0.02 . 1 . . . . 523 ASP H . 16279 1 1050 . 1 1 256 256 ASP C C 13 178.56 0.05 . 1 . . . . 523 ASP C . 16279 1 1051 . 1 1 256 256 ASP CA C 13 51.16 0.05 . 1 . . . . 523 ASP CA . 16279 1 1052 . 1 1 256 256 ASP CB C 13 39.81 0.05 . 1 . . . . 523 ASP CB . 16279 1 1053 . 1 1 256 256 ASP N N 15 129.58 0.05 . 1 . . . . 523 ASP N . 16279 1 1054 . 1 1 257 257 ILE H H 1 8.06 0.02 . 1 . . . . 524 ILE H . 16279 1 1055 . 1 1 257 257 ILE C C 13 175.72 0.05 . 1 . . . . 524 ILE C . 16279 1 1056 . 1 1 257 257 ILE CA C 13 63.26 0.05 . 1 . . . . 524 ILE CA . 16279 1 1057 . 1 1 257 257 ILE CB C 13 36.22 0.05 . 1 . . . . 524 ILE CB . 16279 1 1058 . 1 1 257 257 ILE N N 15 119.66 0.05 . 1 . . . . 524 ILE N . 16279 1 1059 . 1 1 258 258 THR H H 1 8.72 0.02 . 1 . . . . 525 THR H . 16279 1 1060 . 1 1 258 258 THR C C 13 174.16 0.05 . 1 . . . . 525 THR C . 16279 1 1061 . 1 1 258 258 THR CA C 13 61.76 0.05 . 1 . . . . 525 THR CA . 16279 1 1062 . 1 1 258 258 THR CB C 13 68.50 0.05 . 1 . . . . 525 THR CB . 16279 1 1063 . 1 1 258 258 THR N N 15 113.18 0.05 . 1 . . . . 525 THR N . 16279 1 1064 . 1 1 259 259 LYS H H 1 6.76 0.02 . 1 . . . . 526 LYS H . 16279 1 1065 . 1 1 259 259 LYS C C 13 175.55 0.05 . 1 . . . . 526 LYS C . 16279 1 1066 . 1 1 259 259 LYS CA C 13 54.47 0.05 . 1 . . . . 526 LYS CA . 16279 1 1067 . 1 1 259 259 LYS CB C 13 32.81 0.05 . 1 . . . . 526 LYS CB . 16279 1 1068 . 1 1 259 259 LYS N N 15 121.68 0.05 . 1 . . . . 526 LYS N . 16279 1 1069 . 1 1 260 260 ASP H H 1 8.02 0.02 . 1 . . . . 527 ASP H . 16279 1 1070 . 1 1 260 260 ASP C C 13 181.00 0.05 . 1 . . . . 527 ASP C . 16279 1 1071 . 1 1 260 260 ASP CA C 13 56.11 0.05 . 1 . . . . 527 ASP CA . 16279 1 1072 . 1 1 260 260 ASP CB C 13 41.41 0.05 . 1 . . . . 527 ASP CB . 16279 1 1073 . 1 1 260 260 ASP N N 15 127.40 0.05 . 1 . . . . 527 ASP N . 16279 1 stop_ save_