data_50453 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50453 _Entry.Title ; DegP-PDZ1PDZ2-50C ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-09-02 _Entry.Accession_date 2020-09-02 _Entry.Last_release_date 2020-09-02 _Entry.Original_release_date 2020-09-02 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'PDZ1PDZ2 domains of DegP serine protease' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Darius Sulskis . . . 0000-0002-6925-4469 50453 2 Johannes Thoma . . . 0000-0003-3584-8274 50453 3 Bjorn Burmann . M. . 0000-0002-3135-7964 50453 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Chemistry and Molecular Biology, University of Gothenburg' . 50453 2 . 'Wallenberg Centre for Molecular and Translational Medicine, University of Gothenburg' . 50453 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50453 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 724 50453 '15N chemical shifts' 146 50453 '1H chemical shifts' 1180 50453 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2021-12-09 2020-09-02 update BMRB 'update entry citation' 50453 1 . . 2021-10-15 2020-09-02 original author 'original release' 50453 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50450 'PDZ1 domain of DegP' 50453 BMRB 50451 'PDZ2 domain of DegP' 50453 BMRB 50452 'PDZ1-PDZ2 domains of DegP, 25C' 50453 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50453 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34878848 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural basis of DegP protease temperature-dependent activation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Adv.' _Citation.Journal_name_full 'Science Advances' _Citation.Journal_volume 7 _Citation.Journal_issue 50 _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 eabj1816 _Citation.Page_last eabj1816 _Citation.Year 2021 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Darius Sulskis . . . . 50453 1 2 Johannes Thoma . . . . 50453 1 3 Bjorn Burmann . M. . . 50453 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID DegP 50453 1 'E. coli' 50453 1 HtrA 50453 1 PDZ1PDZ2 50453 1 'serine protease' 50453 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50453 _Assembly.ID 1 _Assembly.Name 'PDZ1-PDZ2 domains of DegP' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 19610 _Assembly.Enzyme_commission_number . _Assembly.Details 'Regulatory PDZ1-PDZ2 domains of DegP serine protease' _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 PDZ1-PDZ2 1 $entity_1 . . yes native no no . 'regulatory domain' . 50453 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1KY9 . . X-ray 2.8 'Structure of full-lenght DegP' . 50453 1 yes PDB 3CS0 . . X-ray 2.0 'Crystal structure DegP 24-mer' . 50453 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'The main biological function of DegP serine protease is a protein control during stress conditions in E. coli.' 50453 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50453 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; KRGELGIMGTELNSELAKAM KVDAQRGAFVSQVLPNSSAA KAGIKAGDVITSLNGKPISS FAALRAQVGTMPVGSKLTLG LLRDGKQVNVNLELQQSSQN QVDSSSIFNGIEGAEMSNKG KDQGVVVNNVKTGTPAAQIG LKKGDVIIGANQQAVKNIAE LRKVLDSKPSVLALNIQRGD STIYLLMQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'PDZ1-PDZ2 domain (261-448 a.a.) of DegP' _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 188 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment PDZ1-PDZ2 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19610 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 UNP P0C0V0 . DegP . . . . . . . . . . . . . . 50453 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Serine protease; heat shock protein' 50453 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 1 261 LYS . 50453 1 2 262 ARG . 50453 1 3 263 GLY . 50453 1 4 264 GLU . 50453 1 5 265 LEU . 50453 1 6 266 GLY . 50453 1 7 267 ILE . 50453 1 8 268 MET . 50453 1 9 269 GLY . 50453 1 10 270 THR . 50453 1 11 271 GLU . 50453 1 12 272 LEU . 50453 1 13 273 ASN . 50453 1 14 274 SER . 50453 1 15 275 GLU . 50453 1 16 276 LEU . 50453 1 17 277 ALA . 50453 1 18 278 LYS . 50453 1 19 279 ALA . 50453 1 20 280 MET . 50453 1 21 281 LYS . 50453 1 22 282 VAL . 50453 1 23 283 ASP . 50453 1 24 284 ALA . 50453 1 25 285 GLN . 50453 1 26 286 ARG . 50453 1 27 287 GLY . 50453 1 28 288 ALA . 50453 1 29 289 PHE . 50453 1 30 290 VAL . 50453 1 31 291 SER . 50453 1 32 292 GLN . 50453 1 33 293 VAL . 50453 1 34 294 LEU . 50453 1 35 295 PRO . 50453 1 36 296 ASN . 50453 1 37 297 SER . 50453 1 38 298 SER . 50453 1 39 299 ALA . 50453 1 40 300 ALA . 50453 1 41 301 LYS . 50453 1 42 302 ALA . 50453 1 43 303 GLY . 50453 1 44 304 ILE . 50453 1 45 305 LYS . 50453 1 46 306 ALA . 50453 1 47 307 GLY . 50453 1 48 308 ASP . 50453 1 49 309 VAL . 50453 1 50 310 ILE . 50453 1 51 311 THR . 50453 1 52 312 SER . 50453 1 53 313 LEU . 50453 1 54 314 ASN . 50453 1 55 315 GLY . 50453 1 56 316 LYS . 50453 1 57 317 PRO . 50453 1 58 318 ILE . 50453 1 59 319 SER . 50453 1 60 320 SER . 50453 1 61 321 PHE . 50453 1 62 322 ALA . 50453 1 63 323 ALA . 50453 1 64 324 LEU . 50453 1 65 325 ARG . 50453 1 66 326 ALA . 50453 1 67 327 GLN . 50453 1 68 328 VAL . 50453 1 69 329 GLY . 50453 1 70 330 THR . 50453 1 71 331 MET . 50453 1 72 332 PRO . 50453 1 73 333 VAL . 50453 1 74 334 GLY . 50453 1 75 335 SER . 50453 1 76 336 LYS . 50453 1 77 337 LEU . 50453 1 78 338 THR . 50453 1 79 339 LEU . 50453 1 80 340 GLY . 50453 1 81 341 LEU . 50453 1 82 342 LEU . 50453 1 83 343 ARG . 50453 1 84 344 ASP . 50453 1 85 345 GLY . 50453 1 86 346 LYS . 50453 1 87 347 GLN . 50453 1 88 348 VAL . 50453 1 89 349 ASN . 50453 1 90 350 VAL . 50453 1 91 351 ASN . 50453 1 92 352 LEU . 50453 1 93 353 GLU . 50453 1 94 354 LEU . 50453 1 95 355 GLN . 50453 1 96 356 GLN . 50453 1 97 357 SER . 50453 1 98 358 SER . 50453 1 99 359 GLN . 50453 1 100 360 ASN . 50453 1 101 361 GLN . 50453 1 102 362 VAL . 50453 1 103 363 ASP . 50453 1 104 364 SER . 50453 1 105 365 SER . 50453 1 106 366 SER . 50453 1 107 367 ILE . 50453 1 108 368 PHE . 50453 1 109 369 ASN . 50453 1 110 370 GLY . 50453 1 111 371 ILE . 50453 1 112 372 GLU . 50453 1 113 373 GLY . 50453 1 114 374 ALA . 50453 1 115 375 GLU . 50453 1 116 376 MET . 50453 1 117 377 SER . 50453 1 118 378 ASN . 50453 1 119 379 LYS . 50453 1 120 380 GLY . 50453 1 121 381 LYS . 50453 1 122 382 ASP . 50453 1 123 383 GLN . 50453 1 124 384 GLY . 50453 1 125 385 VAL . 50453 1 126 386 VAL . 50453 1 127 387 VAL . 50453 1 128 388 ASN . 50453 1 129 389 ASN . 50453 1 130 390 VAL . 50453 1 131 391 LYS . 50453 1 132 392 THR . 50453 1 133 393 GLY . 50453 1 134 394 THR . 50453 1 135 395 PRO . 50453 1 136 396 ALA . 50453 1 137 397 ALA . 50453 1 138 398 GLN . 50453 1 139 399 ILE . 50453 1 140 400 GLY . 50453 1 141 401 LEU . 50453 1 142 402 LYS . 50453 1 143 403 LYS . 50453 1 144 404 GLY . 50453 1 145 405 ASP . 50453 1 146 406 VAL . 50453 1 147 407 ILE . 50453 1 148 408 ILE . 50453 1 149 409 GLY . 50453 1 150 410 ALA . 50453 1 151 411 ASN . 50453 1 152 412 GLN . 50453 1 153 413 GLN . 50453 1 154 414 ALA . 50453 1 155 415 VAL . 50453 1 156 416 LYS . 50453 1 157 417 ASN . 50453 1 158 418 ILE . 50453 1 159 419 ALA . 50453 1 160 420 GLU . 50453 1 161 421 LEU . 50453 1 162 422 ARG . 50453 1 163 423 LYS . 50453 1 164 424 VAL . 50453 1 165 425 LEU . 50453 1 166 426 ASP . 50453 1 167 427 SER . 50453 1 168 428 LYS . 50453 1 169 429 PRO . 50453 1 170 430 SER . 50453 1 171 431 VAL . 50453 1 172 432 LEU . 50453 1 173 433 ALA . 50453 1 174 434 LEU . 50453 1 175 435 ASN . 50453 1 176 436 ILE . 50453 1 177 437 GLN . 50453 1 178 438 ARG . 50453 1 179 439 GLY . 50453 1 180 440 ASP . 50453 1 181 441 SER . 50453 1 182 442 THR . 50453 1 183 443 ILE . 50453 1 184 444 TYR . 50453 1 185 445 LEU . 50453 1 186 446 LEU . 50453 1 187 447 MET . 50453 1 188 448 GLN . 50453 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 . LYS 1 1 50453 1 . ARG 2 2 50453 1 . GLY 3 3 50453 1 . GLU 4 4 50453 1 . LEU 5 5 50453 1 . GLY 6 6 50453 1 . ILE 7 7 50453 1 . MET 8 8 50453 1 . GLY 9 9 50453 1 . THR 10 10 50453 1 . GLU 11 11 50453 1 . LEU 12 12 50453 1 . ASN 13 13 50453 1 . SER 14 14 50453 1 . GLU 15 15 50453 1 . LEU 16 16 50453 1 . ALA 17 17 50453 1 . LYS 18 18 50453 1 . ALA 19 19 50453 1 . MET 20 20 50453 1 . LYS 21 21 50453 1 . VAL 22 22 50453 1 . ASP 23 23 50453 1 . ALA 24 24 50453 1 . GLN 25 25 50453 1 . ARG 26 26 50453 1 . GLY 27 27 50453 1 . ALA 28 28 50453 1 . PHE 29 29 50453 1 . VAL 30 30 50453 1 . SER 31 31 50453 1 . GLN 32 32 50453 1 . VAL 33 33 50453 1 . LEU 34 34 50453 1 . PRO 35 35 50453 1 . ASN 36 36 50453 1 . SER 37 37 50453 1 . SER 38 38 50453 1 . ALA 39 39 50453 1 . ALA 40 40 50453 1 . LYS 41 41 50453 1 . ALA 42 42 50453 1 . GLY 43 43 50453 1 . ILE 44 44 50453 1 . LYS 45 45 50453 1 . ALA 46 46 50453 1 . GLY 47 47 50453 1 . ASP 48 48 50453 1 . VAL 49 49 50453 1 . ILE 50 50 50453 1 . THR 51 51 50453 1 . SER 52 52 50453 1 . LEU 53 53 50453 1 . ASN 54 54 50453 1 . GLY 55 55 50453 1 . LYS 56 56 50453 1 . PRO 57 57 50453 1 . ILE 58 58 50453 1 . SER 59 59 50453 1 . SER 60 60 50453 1 . PHE 61 61 50453 1 . ALA 62 62 50453 1 . ALA 63 63 50453 1 . LEU 64 64 50453 1 . ARG 65 65 50453 1 . ALA 66 66 50453 1 . GLN 67 67 50453 1 . VAL 68 68 50453 1 . GLY 69 69 50453 1 . THR 70 70 50453 1 . MET 71 71 50453 1 . PRO 72 72 50453 1 . VAL 73 73 50453 1 . GLY 74 74 50453 1 . SER 75 75 50453 1 . LYS 76 76 50453 1 . LEU 77 77 50453 1 . THR 78 78 50453 1 . LEU 79 79 50453 1 . GLY 80 80 50453 1 . LEU 81 81 50453 1 . LEU 82 82 50453 1 . ARG 83 83 50453 1 . ASP 84 84 50453 1 . GLY 85 85 50453 1 . LYS 86 86 50453 1 . GLN 87 87 50453 1 . VAL 88 88 50453 1 . ASN 89 89 50453 1 . VAL 90 90 50453 1 . ASN 91 91 50453 1 . LEU 92 92 50453 1 . GLU 93 93 50453 1 . LEU 94 94 50453 1 . GLN 95 95 50453 1 . GLN 96 96 50453 1 . SER 97 97 50453 1 . SER 98 98 50453 1 . GLN 99 99 50453 1 . ASN 100 100 50453 1 . GLN 101 101 50453 1 . VAL 102 102 50453 1 . ASP 103 103 50453 1 . SER 104 104 50453 1 . SER 105 105 50453 1 . SER 106 106 50453 1 . ILE 107 107 50453 1 . PHE 108 108 50453 1 . ASN 109 109 50453 1 . GLY 110 110 50453 1 . ILE 111 111 50453 1 . GLU 112 112 50453 1 . GLY 113 113 50453 1 . ALA 114 114 50453 1 . GLU 115 115 50453 1 . MET 116 116 50453 1 . SER 117 117 50453 1 . ASN 118 118 50453 1 . LYS 119 119 50453 1 . GLY 120 120 50453 1 . LYS 121 121 50453 1 . ASP 122 122 50453 1 . GLN 123 123 50453 1 . GLY 124 124 50453 1 . VAL 125 125 50453 1 . VAL 126 126 50453 1 . VAL 127 127 50453 1 . ASN 128 128 50453 1 . ASN 129 129 50453 1 . VAL 130 130 50453 1 . LYS 131 131 50453 1 . THR 132 132 50453 1 . GLY 133 133 50453 1 . THR 134 134 50453 1 . PRO 135 135 50453 1 . ALA 136 136 50453 1 . ALA 137 137 50453 1 . GLN 138 138 50453 1 . ILE 139 139 50453 1 . GLY 140 140 50453 1 . LEU 141 141 50453 1 . LYS 142 142 50453 1 . LYS 143 143 50453 1 . GLY 144 144 50453 1 . ASP 145 145 50453 1 . VAL 146 146 50453 1 . ILE 147 147 50453 1 . ILE 148 148 50453 1 . GLY 149 149 50453 1 . ALA 150 150 50453 1 . ASN 151 151 50453 1 . GLN 152 152 50453 1 . GLN 153 153 50453 1 . ALA 154 154 50453 1 . VAL 155 155 50453 1 . LYS 156 156 50453 1 . ASN 157 157 50453 1 . ILE 158 158 50453 1 . ALA 159 159 50453 1 . GLU 160 160 50453 1 . LEU 161 161 50453 1 . ARG 162 162 50453 1 . LYS 163 163 50453 1 . VAL 164 164 50453 1 . LEU 165 165 50453 1 . ASP 166 166 50453 1 . SER 167 167 50453 1 . LYS 168 168 50453 1 . PRO 169 169 50453 1 . SER 170 170 50453 1 . VAL 171 171 50453 1 . LEU 172 172 50453 1 . ALA 173 173 50453 1 . LEU 174 174 50453 1 . ASN 175 175 50453 1 . ILE 176 176 50453 1 . GLN 177 177 50453 1 . ARG 178 178 50453 1 . GLY 179 179 50453 1 . ASP 180 180 50453 1 . SER 181 181 50453 1 . THR 182 182 50453 1 . ILE 183 183 50453 1 . TYR 184 184 50453 1 . LEU 185 185 50453 1 . LEU 186 186 50453 1 . MET 187 187 50453 1 . GLN 188 188 50453 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50453 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli K12 . . . . . . . . . . degP . 50453 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50453 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . plasmid . . pET28a(+) . . . 50453 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50453 _Sample.ID 1 _Sample.Name PDZ1-PDZ2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '450uM 15N13C- PDZ1PDZ2 domain 25 mM KPi, 1 mM EDTA, 1 mM TCEP, pH 7.0, 50C' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PDZ1-PDZ2 domains of DegP' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 450 . . uM . . . . 50453 1 2 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 50453 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 50453 1 4 'potassium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 50453 1 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 50453 1 6 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 50453 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 50453 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'High temp conditions' _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' 25 . mM 50453 1 pH 7.0 . pH 50453 1 pressure 1 . atm 50453 1 temperature 323 . K 50453 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50453 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5 _Software.DOI . _Software.Details "Bruker's TopSpin(tm) software package for NMR data analysis and the acquisition and processing of NMR spectra." loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 50453 1 'data analysis' . 50453 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50453 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version 1.9.1.7 _Software.DOI . _Software.Details ; CARA is an application for the analysis of NMR spectra and computer aided resonance assignment developed in the group of Prof. Dr. Kurt Wuthrich at the Institute of Molecular Biology and Biophysics, ETH Zurich. ; loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50453 2 'chemical shift calculation' . 50453 2 'data analysis' . 50453 2 'peak picking' . 50453 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50453 _Software.ID 3 _Software.Type . _Software.Name qMDD _Software.Version 3.2 _Software.DOI . _Software.Details ; qMDD is a Graphical User Interface for MDDNMR software written in Python and uses PySide as a bindings for the Qt cross-platform application and UI framework. ; loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50453 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 50453 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version 9.6 _Software.DOI . _Software.Details ; NMRPipe is an extensive software system for processing, analyzing, and exploiting multidimensional NMR spectroscopic data. ; loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50453 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50453 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 800#2 _NMR_spectrometer.Details 'Oxford 800 magnet, Bruker Avance III HD spectrometer' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 50453 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 700 _NMR_spectrometer.Details 'Bruker 700 pumped magnet, Bruker Avance III spectrometer' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50453 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 2 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 3 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 6 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50453 1 8 '3D H(CC)(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 9 '3D (H)CC(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 10 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50453 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50453 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 50453 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50453 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 50453 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50453 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name PDZ1PDZ2_assign_50C _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N TROSY' . . . 50453 1 2 '3D HNCA' . . . 50453 1 3 '3D HNCO' . . . 50453 1 4 '3D HNCACB' . . . 50453 1 5 '3D CBCA(CO)NH' . . . 50453 1 6 '3D HN(CA)CO' . . . 50453 1 7 '3D HCCH-TOCSY' . . . 50453 1 8 '3D H(CC)(CO)NH' . . . 50453 1 9 '3D (H)CC(CO)NH' . . . 50453 1 10 '2D 1H-13C HSQC' . . . 50453 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'all nitrogens' 15 45 . 50453 1 'TROSY offset' 'all 1H' 1 45 . 50453 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50453 1 2 $software_2 . . 50453 1 3 $software_3 . . 50453 1 4 $software_4 . . 50453 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 LYS HA H 1 3.734 0.020 . 1 . . . . . 1 LYS HA . 50453 1 2 . 1 . 1 1 1 LYS HB2 H 1 1.788 0.020 . 2 . . . . . 1 LYS HB2 . 50453 1 3 . 1 . 1 1 1 LYS HB3 H 1 1.899 0.020 . 2 . . . . . 1 LYS HB3 . 50453 1 4 . 1 . 1 1 1 LYS HG2 H 1 1.575 0.020 . 2 . . . . . 1 LYS HG2 . 50453 1 5 . 1 . 1 1 1 LYS HG3 H 1 1.610 0.020 . 2 . . . . . 1 LYS HG3 . 50453 1 6 . 1 . 1 1 1 LYS HD2 H 1 1.751 0.020 . 1 . . . . . 1 LYS HD2 . 50453 1 7 . 1 . 1 1 1 LYS HD3 H 1 1.751 0.020 . 1 . . . . . 1 LYS HD3 . 50453 1 8 . 1 . 1 1 1 LYS HE2 H 1 2.998 0.020 . 1 . . . . . 1 LYS HE2 . 50453 1 9 . 1 . 1 1 1 LYS HE3 H 1 2.998 0.020 . 1 . . . . . 1 LYS HE3 . 50453 1 10 . 1 . 1 1 1 LYS CA C 13 57.011 0.3 . 1 . . . . . 1 LYS CA . 50453 1 11 . 1 . 1 1 1 LYS CB C 13 36.046 0.3 . 1 . . . . . 1 LYS CB . 50453 1 12 . 1 . 1 1 1 LYS CG C 13 24.576 0.3 . 1 . . . . . 1 LYS CG . 50453 1 13 . 1 . 1 1 1 LYS CD C 13 29.452 0.3 . 1 . . . . . 1 LYS CD . 50453 1 14 . 1 . 1 1 1 LYS CE C 13 42.367 0.3 . 1 . . . . . 1 LYS CE . 50453 1 15 . 1 . 1 2 2 ARG HA H 1 4.194 0.020 . 1 . . . . . 2 ARG HA . 50453 1 16 . 1 . 1 2 2 ARG HB2 H 1 1.830 0.020 . 1 . . . . . 2 ARG HB2 . 50453 1 17 . 1 . 1 2 2 ARG HB3 H 1 1.830 0.020 . 1 . . . . . 2 ARG HB3 . 50453 1 18 . 1 . 1 2 2 ARG HG2 H 1 1.569 0.020 . 1 . . . . . 2 ARG HG2 . 50453 1 19 . 1 . 1 2 2 ARG HG3 H 1 1.569 0.020 . 1 . . . . . 2 ARG HG3 . 50453 1 20 . 1 . 1 2 2 ARG HD2 H 1 3.108 0.020 . 1 . . . . . 2 ARG HD2 . 50453 1 21 . 1 . 1 2 2 ARG HD3 H 1 3.108 0.020 . 1 . . . . . 2 ARG HD3 . 50453 1 22 . 1 . 1 2 2 ARG CA C 13 56.337 0.3 . 1 . . . . . 2 ARG CA . 50453 1 23 . 1 . 1 2 2 ARG CB C 13 30.588 0.3 . 1 . . . . . 2 ARG CB . 50453 1 24 . 1 . 1 2 2 ARG CG C 13 24.468 0.3 . 1 . . . . . 2 ARG CG . 50453 1 25 . 1 . 1 2 2 ARG CD C 13 43.738 0.3 . 1 . . . . . 2 ARG CD . 50453 1 26 . 1 . 1 3 3 GLY HA2 H 1 4.104 0.020 . 1 . . . . . 3 GLY HA2 . 50453 1 27 . 1 . 1 3 3 GLY HA3 H 1 4.104 0.020 . 1 . . . . . 3 GLY HA3 . 50453 1 28 . 1 . 1 3 3 GLY CA C 13 45.557 0.3 . 1 . . . . . 3 GLY CA . 50453 1 29 . 1 . 1 4 4 GLU H H 1 8.541 0.020 . 1 . . . . . 4 GLU H . 50453 1 30 . 1 . 1 4 4 GLU HA H 1 4.744 0.020 . 1 . . . . . 4 GLU HA . 50453 1 31 . 1 . 1 4 4 GLU HB2 H 1 2.045 0.020 . 2 . . . . . 4 GLU HB2 . 50453 1 32 . 1 . 1 4 4 GLU HB3 H 1 2.141 0.020 . 2 . . . . . 4 GLU HB3 . 50453 1 33 . 1 . 1 4 4 GLU HG2 H 1 2.248 0.020 . 2 . . . . . 4 GLU HG2 . 50453 1 34 . 1 . 1 4 4 GLU HG3 H 1 2.431 0.020 . 2 . . . . . 4 GLU HG3 . 50453 1 35 . 1 . 1 4 4 GLU C C 13 176.257 0.3 . 1 . . . . . 4 GLU C . 50453 1 36 . 1 . 1 4 4 GLU CA C 13 55.384 0.3 . 1 . . . . . 4 GLU CA . 50453 1 37 . 1 . 1 4 4 GLU CB C 13 32.104 0.3 . 1 . . . . . 4 GLU CB . 50453 1 38 . 1 . 1 4 4 GLU CG C 13 36.440 0.3 . 1 . . . . . 4 GLU CG . 50453 1 39 . 1 . 1 4 4 GLU N N 15 122.887 0.3 . 1 . . . . . 4 GLU N . 50453 1 40 . 1 . 1 5 5 LEU HA H 1 4.366 0.020 . 1 . . . . . 5 LEU HA . 50453 1 41 . 1 . 1 5 5 LEU HB2 H 1 1.755 0.020 . 2 . . . . . 5 LEU HB2 . 50453 1 42 . 1 . 1 5 5 LEU HB3 H 1 1.922 0.020 . 2 . . . . . 5 LEU HB3 . 50453 1 43 . 1 . 1 5 5 LEU HG H 1 1.654 0.020 . 1 . . . . . 5 LEU HG . 50453 1 44 . 1 . 1 5 5 LEU HD11 H 1 0.981 0.020 . 2 . . . . . 5 LEU HD1 . 50453 1 45 . 1 . 1 5 5 LEU HD12 H 1 0.981 0.020 . 2 . . . . . 5 LEU HD1 . 50453 1 46 . 1 . 1 5 5 LEU HD13 H 1 0.981 0.020 . 2 . . . . . 5 LEU HD1 . 50453 1 47 . 1 . 1 5 5 LEU HD21 H 1 0.885 0.020 . 2 . . . . . 5 LEU HD2 . 50453 1 48 . 1 . 1 5 5 LEU HD22 H 1 0.885 0.020 . 2 . . . . . 5 LEU HD2 . 50453 1 49 . 1 . 1 5 5 LEU HD23 H 1 0.885 0.020 . 2 . . . . . 5 LEU HD2 . 50453 1 50 . 1 . 1 5 5 LEU CA C 13 57.106 0.3 . 1 . . . . . 5 LEU CA . 50453 1 51 . 1 . 1 5 5 LEU CB C 13 43.706 0.3 . 1 . . . . . 5 LEU CB . 50453 1 52 . 1 . 1 5 5 LEU CG C 13 27.196 0.3 . 1 . . . . . 5 LEU CG . 50453 1 53 . 1 . 1 5 5 LEU CD1 C 13 25.095 0.3 . 1 . . . . . 5 LEU CD1 . 50453 1 54 . 1 . 1 5 5 LEU CD2 C 13 25.774 0.3 . 1 . . . . . 5 LEU CD2 . 50453 1 55 . 1 . 1 6 6 GLY HA2 H 1 3.847 0.020 . 2 . . . . . 6 GLY HA2 . 50453 1 56 . 1 . 1 6 6 GLY HA3 H 1 4.717 0.020 . 2 . . . . . 6 GLY HA3 . 50453 1 57 . 1 . 1 6 6 GLY C C 13 173.462 0.3 . 1 . . . . . 6 GLY C . 50453 1 58 . 1 . 1 6 6 GLY CA C 13 45.780 0.3 . 1 . . . . . 6 GLY CA . 50453 1 59 . 1 . 1 7 7 ILE H H 1 7.453 0.020 . 1 . . . . . 7 ILE H . 50453 1 60 . 1 . 1 7 7 ILE HA H 1 4.900 0.020 . 1 . . . . . 7 ILE HA . 50453 1 61 . 1 . 1 7 7 ILE HB H 1 1.943 0.020 . 1 . . . . . 7 ILE HB . 50453 1 62 . 1 . 1 7 7 ILE HG12 H 1 1.643 0.020 . 1 . . . . . 7 ILE HG12 . 50453 1 63 . 1 . 1 7 7 ILE HG13 H 1 1.643 0.020 . 1 . . . . . 7 ILE HG13 . 50453 1 64 . 1 . 1 7 7 ILE HG21 H 1 0.981 0.020 . 1 . . . . . 7 ILE HG2 . 50453 1 65 . 1 . 1 7 7 ILE HG22 H 1 0.981 0.020 . 1 . . . . . 7 ILE HG2 . 50453 1 66 . 1 . 1 7 7 ILE HG23 H 1 0.981 0.020 . 1 . . . . . 7 ILE HG2 . 50453 1 67 . 1 . 1 7 7 ILE HD11 H 1 0.890 0.020 . 1 . . . . . 7 ILE HD1 . 50453 1 68 . 1 . 1 7 7 ILE HD12 H 1 0.890 0.020 . 1 . . . . . 7 ILE HD1 . 50453 1 69 . 1 . 1 7 7 ILE HD13 H 1 0.890 0.020 . 1 . . . . . 7 ILE HD1 . 50453 1 70 . 1 . 1 7 7 ILE C C 13 175.270 0.3 . 1 . . . . . 7 ILE C . 50453 1 71 . 1 . 1 7 7 ILE CA C 13 59.829 0.3 . 1 . . . . . 7 ILE CA . 50453 1 72 . 1 . 1 7 7 ILE CB C 13 41.518 0.3 . 1 . . . . . 7 ILE CB . 50453 1 73 . 1 . 1 7 7 ILE CG1 C 13 26.690 0.3 . 1 . . . . . 7 ILE CG1 . 50453 1 74 . 1 . 1 7 7 ILE CG2 C 13 17.989 0.3 . 1 . . . . . 7 ILE CG2 . 50453 1 75 . 1 . 1 7 7 ILE CD1 C 13 14.219 0.3 . 1 . . . . . 7 ILE CD1 . 50453 1 76 . 1 . 1 7 7 ILE N N 15 114.788 0.3 . 1 . . . . . 7 ILE N . 50453 1 77 . 1 . 1 8 8 MET H H 1 8.760 0.020 . 1 . . . . . 8 MET H . 50453 1 78 . 1 . 1 8 8 MET HA H 1 4.854 0.020 . 1 . . . . . 8 MET HA . 50453 1 79 . 1 . 1 8 8 MET HB2 H 1 2.194 0.020 . 1 . . . . . 8 MET HB2 . 50453 1 80 . 1 . 1 8 8 MET HB3 H 1 2.194 0.020 . 1 . . . . . 8 MET HB3 . 50453 1 81 . 1 . 1 8 8 MET HG2 H 1 2.580 0.020 . 1 . . . . . 8 MET HG2 . 50453 1 82 . 1 . 1 8 8 MET HG3 H 1 2.580 0.020 . 1 . . . . . 8 MET HG3 . 50453 1 83 . 1 . 1 8 8 MET C C 13 175.103 0.3 . 1 . . . . . 8 MET C . 50453 1 84 . 1 . 1 8 8 MET CA C 13 54.292 0.3 . 1 . . . . . 8 MET CA . 50453 1 85 . 1 . 1 8 8 MET CB C 13 33.004 0.3 . 1 . . . . . 8 MET CB . 50453 1 86 . 1 . 1 8 8 MET CG C 13 32.727 0.3 . 1 . . . . . 8 MET CG . 50453 1 87 . 1 . 1 8 8 MET N N 15 126.176 0.3 . 1 . . . . . 8 MET N . 50453 1 88 . 1 . 1 9 9 GLY H H 1 7.710 0.020 . 1 . . . . . 9 GLY H . 50453 1 89 . 1 . 1 9 9 GLY HA2 H 1 3.524 0.020 . 2 . . . . . 9 GLY HA2 . 50453 1 90 . 1 . 1 9 9 GLY HA3 H 1 4.671 0.020 . 2 . . . . . 9 GLY HA3 . 50453 1 91 . 1 . 1 9 9 GLY C C 13 172.051 0.3 . 1 . . . . . 9 GLY C . 50453 1 92 . 1 . 1 9 9 GLY CA C 13 45.077 0.3 . 1 . . . . . 9 GLY CA . 50453 1 93 . 1 . 1 9 9 GLY N N 15 112.790 0.3 . 1 . . . . . 9 GLY N . 50453 1 94 . 1 . 1 10 10 THR H H 1 8.777 0.020 . 1 . . . . . 10 THR H . 50453 1 95 . 1 . 1 10 10 THR HA H 1 4.802 0.020 . 1 . . . . . 10 THR HA . 50453 1 96 . 1 . 1 10 10 THR HB H 1 4.410 0.020 . 1 . . . . . 10 THR HB . 50453 1 97 . 1 . 1 10 10 THR HG21 H 1 0.954 0.020 . 1 . . . . . 10 THR HG2 . 50453 1 98 . 1 . 1 10 10 THR HG22 H 1 0.954 0.020 . 1 . . . . . 10 THR HG2 . 50453 1 99 . 1 . 1 10 10 THR HG23 H 1 0.954 0.020 . 1 . . . . . 10 THR HG2 . 50453 1 100 . 1 . 1 10 10 THR C C 13 173.281 0.3 . 1 . . . . . 10 THR C . 50453 1 101 . 1 . 1 10 10 THR CA C 13 59.975 0.3 . 1 . . . . . 10 THR CA . 50453 1 102 . 1 . 1 10 10 THR CB C 13 71.135 0.3 . 1 . . . . . 10 THR CB . 50453 1 103 . 1 . 1 10 10 THR CG2 C 13 19.259 0.3 . 1 . . . . . 10 THR CG2 . 50453 1 104 . 1 . 1 10 10 THR N N 15 114.636 0.3 . 1 . . . . . 10 THR N . 50453 1 105 . 1 . 1 11 11 GLU HA H 1 5.238 0.020 . 1 . . . . . 11 GLU HA . 50453 1 106 . 1 . 1 11 11 GLU HB2 H 1 2.210 0.020 . 2 . . . . . 11 GLU HB2 . 50453 1 107 . 1 . 1 11 11 GLU HB3 H 1 2.424 0.020 . 2 . . . . . 11 GLU HB3 . 50453 1 108 . 1 . 1 11 11 GLU HG2 H 1 2.729 0.020 . 1 . . . . . 11 GLU HG2 . 50453 1 109 . 1 . 1 11 11 GLU HG3 H 1 2.729 0.020 . 1 . . . . . 11 GLU HG3 . 50453 1 110 . 1 . 1 11 11 GLU CA C 13 55.719 0.3 . 1 . . . . . 11 GLU CA . 50453 1 111 . 1 . 1 11 11 GLU CB C 13 30.148 0.3 . 1 . . . . . 11 GLU CB . 50453 1 112 . 1 . 1 11 11 GLU CG C 13 35.430 0.3 . 1 . . . . . 11 GLU CG . 50453 1 113 . 1 . 1 12 12 LEU H H 1 8.962 0.020 . 1 . . . . . 12 LEU H . 50453 1 114 . 1 . 1 12 12 LEU HA H 1 4.223 0.020 . 1 . . . . . 12 LEU HA . 50453 1 115 . 1 . 1 12 12 LEU HB2 H 1 1.467 0.020 . 2 . . . . . 12 LEU HB2 . 50453 1 116 . 1 . 1 12 12 LEU HB3 H 1 1.674 0.020 . 2 . . . . . 12 LEU HB3 . 50453 1 117 . 1 . 1 12 12 LEU HG H 1 1.550 0.020 . 1 . . . . . 12 LEU HG . 50453 1 118 . 1 . 1 12 12 LEU HD11 H 1 0.781 0.020 . 2 . . . . . 12 LEU HD1 . 50453 1 119 . 1 . 1 12 12 LEU HD12 H 1 0.781 0.020 . 2 . . . . . 12 LEU HD1 . 50453 1 120 . 1 . 1 12 12 LEU HD13 H 1 0.781 0.020 . 2 . . . . . 12 LEU HD1 . 50453 1 121 . 1 . 1 12 12 LEU HD21 H 1 0.753 0.020 . 2 . . . . . 12 LEU HD2 . 50453 1 122 . 1 . 1 12 12 LEU HD22 H 1 0.753 0.020 . 2 . . . . . 12 LEU HD2 . 50453 1 123 . 1 . 1 12 12 LEU HD23 H 1 0.753 0.020 . 2 . . . . . 12 LEU HD2 . 50453 1 124 . 1 . 1 12 12 LEU C C 13 175.437 0.3 . 1 . . . . . 12 LEU C . 50453 1 125 . 1 . 1 12 12 LEU CA C 13 55.710 0.3 . 1 . . . . . 12 LEU CA . 50453 1 126 . 1 . 1 12 12 LEU CB C 13 42.511 0.3 . 1 . . . . . 12 LEU CB . 50453 1 127 . 1 . 1 12 12 LEU CG C 13 27.121 0.3 . 1 . . . . . 12 LEU CG . 50453 1 128 . 1 . 1 12 12 LEU CD1 C 13 24.854 0.3 . 1 . . . . . 12 LEU CD1 . 50453 1 129 . 1 . 1 12 12 LEU CD2 C 13 25.334 0.3 . 1 . . . . . 12 LEU CD2 . 50453 1 130 . 1 . 1 12 12 LEU N N 15 125.738 0.3 . 1 . . . . . 12 LEU N . 50453 1 131 . 1 . 1 13 13 ASN HA H 1 4.506 0.020 . 1 . . . . . 13 ASN HA . 50453 1 132 . 1 . 1 13 13 ASN HB2 H 1 3.084 0.020 . 2 . . . . . 13 ASN HB2 . 50453 1 133 . 1 . 1 13 13 ASN HB3 H 1 3.181 0.020 . 2 . . . . . 13 ASN HB3 . 50453 1 134 . 1 . 1 13 13 ASN CA C 13 54.701 0.3 . 1 . . . . . 13 ASN CA . 50453 1 135 . 1 . 1 13 13 ASN CB C 13 38.224 0.3 . 1 . . . . . 13 ASN CB . 50453 1 136 . 1 . 1 14 14 SER H H 1 7.672 0.020 . 1 . . . . . 14 SER H . 50453 1 137 . 1 . 1 14 14 SER HA H 1 4.755 0.020 . 1 . . . . . 14 SER HA . 50453 1 138 . 1 . 1 14 14 SER HB2 H 1 4.632 0.020 . 1 . . . . . 14 SER HB2 . 50453 1 139 . 1 . 1 14 14 SER HB3 H 1 4.632 0.020 . 1 . . . . . 14 SER HB3 . 50453 1 140 . 1 . 1 14 14 SER C C 13 175.454 0.3 . 1 . . . . . 14 SER C . 50453 1 141 . 1 . 1 14 14 SER CA C 13 57.693 0.3 . 1 . . . . . 14 SER CA . 50453 1 142 . 1 . 1 14 14 SER CB C 13 67.340 0.3 . 1 . . . . . 14 SER CB . 50453 1 143 . 1 . 1 14 14 SER N N 15 114.816 0.3 . 1 . . . . . 14 SER N . 50453 1 144 . 1 . 1 15 15 GLU HA H 1 4.229 0.020 . 1 . . . . . 15 GLU HA . 50453 1 145 . 1 . 1 15 15 GLU HB2 H 1 2.173 0.020 . 1 . . . . . 15 GLU HB2 . 50453 1 146 . 1 . 1 15 15 GLU HB3 H 1 2.173 0.020 . 1 . . . . . 15 GLU HB3 . 50453 1 147 . 1 . 1 15 15 GLU HG2 H 1 2.457 0.020 . 1 . . . . . 15 GLU HG2 . 50453 1 148 . 1 . 1 15 15 GLU HG3 H 1 2.457 0.020 . 1 . . . . . 15 GLU HG3 . 50453 1 149 . 1 . 1 15 15 GLU C C 13 179.277 0.3 . 1 . . . . . 15 GLU C . 50453 1 150 . 1 . 1 15 15 GLU CA C 13 59.605 0.3 . 1 . . . . . 15 GLU CA . 50453 1 151 . 1 . 1 15 15 GLU CB C 13 29.246 0.3 . 1 . . . . . 15 GLU CB . 50453 1 152 . 1 . 1 15 15 GLU CG C 13 36.659 0.3 . 1 . . . . . 15 GLU CG . 50453 1 153 . 1 . 1 16 16 LEU H H 1 8.359 0.020 . 1 . . . . . 16 LEU H . 50453 1 154 . 1 . 1 16 16 LEU HA H 1 4.201 0.020 . 1 . . . . . 16 LEU HA . 50453 1 155 . 1 . 1 16 16 LEU HB2 H 1 1.559 0.020 . 2 . . . . . 16 LEU HB2 . 50453 1 156 . 1 . 1 16 16 LEU HB3 H 1 1.677 0.020 . 2 . . . . . 16 LEU HB3 . 50453 1 157 . 1 . 1 16 16 LEU HG H 1 1.649 0.020 . 1 . . . . . 16 LEU HG . 50453 1 158 . 1 . 1 16 16 LEU HD11 H 1 0.738 0.020 . 2 . . . . . 16 LEU HD1 . 50453 1 159 . 1 . 1 16 16 LEU HD12 H 1 0.738 0.020 . 2 . . . . . 16 LEU HD1 . 50453 1 160 . 1 . 1 16 16 LEU HD13 H 1 0.738 0.020 . 2 . . . . . 16 LEU HD1 . 50453 1 161 . 1 . 1 16 16 LEU HD21 H 1 0.661 0.020 . 2 . . . . . 16 LEU HD2 . 50453 1 162 . 1 . 1 16 16 LEU HD22 H 1 0.661 0.020 . 2 . . . . . 16 LEU HD2 . 50453 1 163 . 1 . 1 16 16 LEU HD23 H 1 0.661 0.020 . 2 . . . . . 16 LEU HD2 . 50453 1 164 . 1 . 1 16 16 LEU C C 13 178.163 0.3 . 1 . . . . . 16 LEU C . 50453 1 165 . 1 . 1 16 16 LEU CA C 13 57.442 0.3 . 1 . . . . . 16 LEU CA . 50453 1 166 . 1 . 1 16 16 LEU CB C 13 42.606 0.3 . 1 . . . . . 16 LEU CB . 50453 1 167 . 1 . 1 16 16 LEU CG C 13 26.723 0.3 . 1 . . . . . 16 LEU CG . 50453 1 168 . 1 . 1 16 16 LEU CD1 C 13 23.849 0.3 . 1 . . . . . 16 LEU CD1 . 50453 1 169 . 1 . 1 16 16 LEU CD2 C 13 24.730 0.3 . 1 . . . . . 16 LEU CD2 . 50453 1 170 . 1 . 1 16 16 LEU N N 15 124.545 0.3 . 1 . . . . . 16 LEU N . 50453 1 171 . 1 . 1 17 17 ALA H H 1 8.266 0.020 . 1 . . . . . 17 ALA H . 50453 1 172 . 1 . 1 17 17 ALA HA H 1 3.815 0.020 . 1 . . . . . 17 ALA HA . 50453 1 173 . 1 . 1 17 17 ALA HB1 H 1 1.462 0.020 . 1 . . . . . 17 ALA HB . 50453 1 174 . 1 . 1 17 17 ALA HB2 H 1 1.462 0.020 . 1 . . . . . 17 ALA HB . 50453 1 175 . 1 . 1 17 17 ALA HB3 H 1 1.462 0.020 . 1 . . . . . 17 ALA HB . 50453 1 176 . 1 . 1 17 17 ALA C C 13 179.818 0.3 . 1 . . . . . 17 ALA C . 50453 1 177 . 1 . 1 17 17 ALA CA C 13 55.336 0.3 . 1 . . . . . 17 ALA CA . 50453 1 178 . 1 . 1 17 17 ALA CB C 13 18.207 0.3 . 1 . . . . . 17 ALA CB . 50453 1 179 . 1 . 1 17 17 ALA N N 15 123.058 0.3 . 1 . . . . . 17 ALA N . 50453 1 180 . 1 . 1 18 18 LYS H H 1 7.899 0.020 . 1 . . . . . 18 LYS H . 50453 1 181 . 1 . 1 18 18 LYS HA H 1 4.234 0.020 . 1 . . . . . 18 LYS HA . 50453 1 182 . 1 . 1 18 18 LYS HB2 H 1 2.035 0.020 . 2 . . . . . 18 LYS HB2 . 50453 1 183 . 1 . 1 18 18 LYS HB3 H 1 2.113 0.020 . 2 . . . . . 18 LYS HB3 . 50453 1 184 . 1 . 1 18 18 LYS HG2 H 1 1.810 0.020 . 2 . . . . . 18 LYS HG2 . 50453 1 185 . 1 . 1 18 18 LYS HG3 H 1 1.880 0.020 . 2 . . . . . 18 LYS HG3 . 50453 1 186 . 1 . 1 18 18 LYS HD2 H 1 1.877 0.020 . 1 . . . . . 18 LYS HD2 . 50453 1 187 . 1 . 1 18 18 LYS HD3 H 1 1.877 0.020 . 1 . . . . . 18 LYS HD3 . 50453 1 188 . 1 . 1 18 18 LYS HE2 H 1 3.127 0.020 . 1 . . . . . 18 LYS HE2 . 50453 1 189 . 1 . 1 18 18 LYS HE3 H 1 3.127 0.020 . 1 . . . . . 18 LYS HE3 . 50453 1 190 . 1 . 1 18 18 LYS C C 13 179.901 0.3 . 1 . . . . . 18 LYS C . 50453 1 191 . 1 . 1 18 18 LYS CA C 13 59.053 0.3 . 1 . . . . . 18 LYS CA . 50453 1 192 . 1 . 1 18 18 LYS CB C 13 32.537 0.3 . 1 . . . . . 18 LYS CB . 50453 1 193 . 1 . 1 18 18 LYS CG C 13 25.122 0.3 . 1 . . . . . 18 LYS CG . 50453 1 194 . 1 . 1 18 18 LYS CD C 13 29.105 0.3 . 1 . . . . . 18 LYS CD . 50453 1 195 . 1 . 1 18 18 LYS CE C 13 41.806 0.3 . 1 . . . . . 18 LYS CE . 50453 1 196 . 1 . 1 18 18 LYS N N 15 119.230 0.3 . 1 . . . . . 18 LYS N . 50453 1 197 . 1 . 1 19 19 ALA H H 1 8.012 0.020 . 1 . . . . . 19 ALA H . 50453 1 198 . 1 . 1 19 19 ALA HA H 1 4.265 0.020 . 1 . . . . . 19 ALA HA . 50453 1 199 . 1 . 1 19 19 ALA HB1 H 1 1.621 0.020 . 1 . . . . . 19 ALA HB . 50453 1 200 . 1 . 1 19 19 ALA HB2 H 1 1.621 0.020 . 1 . . . . . 19 ALA HB . 50453 1 201 . 1 . 1 19 19 ALA HB3 H 1 1.621 0.020 . 1 . . . . . 19 ALA HB . 50453 1 202 . 1 . 1 19 19 ALA C C 13 179.032 0.3 . 1 . . . . . 19 ALA C . 50453 1 203 . 1 . 1 19 19 ALA CA C 13 54.834 0.3 . 1 . . . . . 19 ALA CA . 50453 1 204 . 1 . 1 19 19 ALA CB C 13 18.533 0.3 . 1 . . . . . 19 ALA CB . 50453 1 205 . 1 . 1 19 19 ALA N N 15 125.040 0.3 . 1 . . . . . 19 ALA N . 50453 1 206 . 1 . 1 20 20 MET H H 1 8.005 0.020 . 1 . . . . . 20 MET H . 50453 1 207 . 1 . 1 20 20 MET HA H 1 4.636 0.020 . 1 . . . . . 20 MET HA . 50453 1 208 . 1 . 1 20 20 MET HB2 H 1 2.619 0.020 . 1 . . . . . 20 MET HB2 . 50453 1 209 . 1 . 1 20 20 MET HB3 H 1 2.619 0.020 . 1 . . . . . 20 MET HB3 . 50453 1 210 . 1 . 1 20 20 MET HG2 H 1 2.637 0.020 . 1 . . . . . 20 MET HG2 . 50453 1 211 . 1 . 1 20 20 MET HG3 H 1 2.637 0.020 . 1 . . . . . 20 MET HG3 . 50453 1 212 . 1 . 1 20 20 MET C C 13 175.153 0.3 . 1 . . . . . 20 MET C . 50453 1 213 . 1 . 1 20 20 MET CA C 13 54.823 0.3 . 1 . . . . . 20 MET CA . 50453 1 214 . 1 . 1 20 20 MET CB C 13 33.934 0.3 . 1 . . . . . 20 MET CB . 50453 1 215 . 1 . 1 20 20 MET CG C 13 32.690 0.3 . 1 . . . . . 20 MET CG . 50453 1 216 . 1 . 1 20 20 MET N N 15 116.234 0.3 . 1 . . . . . 20 MET N . 50453 1 217 . 1 . 1 21 21 LYS H H 1 8.067 0.020 . 1 . . . . . 21 LYS H . 50453 1 218 . 1 . 1 21 21 LYS HA H 1 4.081 0.020 . 1 . . . . . 21 LYS HA . 50453 1 219 . 1 . 1 21 21 LYS HB2 H 1 1.514 0.020 . 1 . . . . . 21 LYS HB2 . 50453 1 220 . 1 . 1 21 21 LYS HB3 H 1 1.514 0.020 . 1 . . . . . 21 LYS HB3 . 50453 1 221 . 1 . 1 21 21 LYS HG2 H 1 1.645 0.020 . 1 . . . . . 21 LYS HG2 . 50453 1 222 . 1 . 1 21 21 LYS HG3 H 1 1.645 0.020 . 1 . . . . . 21 LYS HG3 . 50453 1 223 . 1 . 1 21 21 LYS HD2 H 1 2.048 0.020 . 1 . . . . . 21 LYS HD2 . 50453 1 224 . 1 . 1 21 21 LYS HD3 H 1 2.048 0.020 . 1 . . . . . 21 LYS HD3 . 50453 1 225 . 1 . 1 21 21 LYS HE2 H 1 3.058 0.020 . 1 . . . . . 21 LYS HE2 . 50453 1 226 . 1 . 1 21 21 LYS HE3 H 1 3.058 0.020 . 1 . . . . . 21 LYS HE3 . 50453 1 227 . 1 . 1 21 21 LYS C C 13 175.859 0.3 . 1 . . . . . 21 LYS C . 50453 1 228 . 1 . 1 21 21 LYS CA C 13 57.315 0.3 . 1 . . . . . 21 LYS CA . 50453 1 229 . 1 . 1 21 21 LYS CB C 13 29.367 0.3 . 1 . . . . . 21 LYS CB . 50453 1 230 . 1 . 1 21 21 LYS CG C 13 25.356 0.3 . 1 . . . . . 21 LYS CG . 50453 1 231 . 1 . 1 21 21 LYS CD C 13 29.407 0.3 . 1 . . . . . 21 LYS CD . 50453 1 232 . 1 . 1 21 21 LYS CE C 13 42.489 0.3 . 1 . . . . . 21 LYS CE . 50453 1 233 . 1 . 1 21 21 LYS N N 15 119.616 0.3 . 1 . . . . . 21 LYS N . 50453 1 234 . 1 . 1 22 22 VAL H H 1 8.210 0.020 . 1 . . . . . 22 VAL H . 50453 1 235 . 1 . 1 22 22 VAL HA H 1 4.439 0.020 . 1 . . . . . 22 VAL HA . 50453 1 236 . 1 . 1 22 22 VAL HB H 1 2.136 0.020 . 1 . . . . . 22 VAL HB . 50453 1 237 . 1 . 1 22 22 VAL HG11 H 1 1.026 0.020 . 2 . . . . . 22 VAL HG1 . 50453 1 238 . 1 . 1 22 22 VAL HG12 H 1 1.026 0.020 . 2 . . . . . 22 VAL HG1 . 50453 1 239 . 1 . 1 22 22 VAL HG13 H 1 1.026 0.020 . 2 . . . . . 22 VAL HG1 . 50453 1 240 . 1 . 1 22 22 VAL HG21 H 1 1.063 0.020 . 2 . . . . . 22 VAL HG2 . 50453 1 241 . 1 . 1 22 22 VAL HG22 H 1 1.063 0.020 . 2 . . . . . 22 VAL HG2 . 50453 1 242 . 1 . 1 22 22 VAL HG23 H 1 1.063 0.020 . 2 . . . . . 22 VAL HG2 . 50453 1 243 . 1 . 1 22 22 VAL C C 13 175.688 0.3 . 1 . . . . . 22 VAL C . 50453 1 244 . 1 . 1 22 22 VAL CA C 13 61.056 0.3 . 1 . . . . . 22 VAL CA . 50453 1 245 . 1 . 1 22 22 VAL CB C 13 33.695 0.3 . 1 . . . . . 22 VAL CB . 50453 1 246 . 1 . 1 22 22 VAL CG1 C 13 20.884 0.3 . 1 . . . . . 22 VAL CG1 . 50453 1 247 . 1 . 1 22 22 VAL CG2 C 13 22.112 0.3 . 1 . . . . . 22 VAL CG2 . 50453 1 248 . 1 . 1 22 22 VAL N N 15 118.841 0.3 . 1 . . . . . 22 VAL N . 50453 1 249 . 1 . 1 23 23 ASP H H 1 8.700 0.020 . 1 . . . . . 23 ASP H . 50453 1 250 . 1 . 1 23 23 ASP HA H 1 4.743 0.020 . 1 . . . . . 23 ASP HA . 50453 1 251 . 1 . 1 23 23 ASP HB2 H 1 2.673 0.020 . 2 . . . . . 23 ASP HB2 . 50453 1 252 . 1 . 1 23 23 ASP HB3 H 1 2.815 0.020 . 2 . . . . . 23 ASP HB3 . 50453 1 253 . 1 . 1 23 23 ASP C C 13 175.605 0.3 . 1 . . . . . 23 ASP C . 50453 1 254 . 1 . 1 23 23 ASP CA C 13 54.228 0.3 . 1 . . . . . 23 ASP CA . 50453 1 255 . 1 . 1 23 23 ASP CB C 13 40.827 0.3 . 1 . . . . . 23 ASP CB . 50453 1 256 . 1 . 1 23 23 ASP N N 15 127.240 0.3 . 1 . . . . . 23 ASP N . 50453 1 257 . 1 . 1 24 24 ALA H H 1 7.725 0.020 . 1 . . . . . 24 ALA H . 50453 1 258 . 1 . 1 24 24 ALA HA H 1 4.435 0.020 . 1 . . . . . 24 ALA HA . 50453 1 259 . 1 . 1 24 24 ALA HB1 H 1 1.416 0.020 . 1 . . . . . 24 ALA HB . 50453 1 260 . 1 . 1 24 24 ALA HB2 H 1 1.416 0.020 . 1 . . . . . 24 ALA HB . 50453 1 261 . 1 . 1 24 24 ALA HB3 H 1 1.416 0.020 . 1 . . . . . 24 ALA HB . 50453 1 262 . 1 . 1 24 24 ALA C C 13 176.257 0.3 . 1 . . . . . 24 ALA C . 50453 1 263 . 1 . 1 24 24 ALA CA C 13 52.388 0.3 . 1 . . . . . 24 ALA CA . 50453 1 264 . 1 . 1 24 24 ALA CB C 13 20.280 0.3 . 1 . . . . . 24 ALA CB . 50453 1 265 . 1 . 1 24 24 ALA N N 15 124.766 0.3 . 1 . . . . . 24 ALA N . 50453 1 266 . 1 . 1 25 25 GLN HA H 1 4.365 0.020 . 1 . . . . . 25 GLN HA . 50453 1 267 . 1 . 1 25 25 GLN HB2 H 1 2.296 0.020 . 2 . . . . . 25 GLN HB2 . 50453 1 268 . 1 . 1 25 25 GLN HB3 H 1 2.453 0.020 . 2 . . . . . 25 GLN HB3 . 50453 1 269 . 1 . 1 25 25 GLN HG2 H 1 2.498 0.020 . 1 . . . . . 25 GLN HG2 . 50453 1 270 . 1 . 1 25 25 GLN HG3 H 1 2.498 0.020 . 1 . . . . . 25 GLN HG3 . 50453 1 271 . 1 . 1 25 25 GLN C C 13 175.059 0.3 . 1 . . . . . 25 GLN C . 50453 1 272 . 1 . 1 25 25 GLN CA C 13 56.233 0.3 . 1 . . . . . 25 GLN CA . 50453 1 273 . 1 . 1 25 25 GLN CB C 13 30.180 0.3 . 1 . . . . . 25 GLN CB . 50453 1 274 . 1 . 1 25 25 GLN CG C 13 34.466 0.3 . 1 . . . . . 25 GLN CG . 50453 1 275 . 1 . 1 26 26 ARG H H 1 7.770 0.020 . 1 . . . . . 26 ARG H . 50453 1 276 . 1 . 1 26 26 ARG HA H 1 4.806 0.020 . 1 . . . . . 26 ARG HA . 50453 1 277 . 1 . 1 26 26 ARG HB2 H 1 1.958 0.020 . 2 . . . . . 26 ARG HB2 . 50453 1 278 . 1 . 1 26 26 ARG HB3 H 1 2.113 0.020 . 2 . . . . . 26 ARG HB3 . 50453 1 279 . 1 . 1 26 26 ARG HG2 H 1 1.768 0.020 . 1 . . . . . 26 ARG HG2 . 50453 1 280 . 1 . 1 26 26 ARG HG3 H 1 1.768 0.020 . 1 . . . . . 26 ARG HG3 . 50453 1 281 . 1 . 1 26 26 ARG HD2 H 1 3.383 0.020 . 1 . . . . . 26 ARG HD2 . 50453 1 282 . 1 . 1 26 26 ARG HD3 H 1 3.383 0.020 . 1 . . . . . 26 ARG HD3 . 50453 1 283 . 1 . 1 26 26 ARG C C 13 174.267 0.3 . 1 . . . . . 26 ARG C . 50453 1 284 . 1 . 1 26 26 ARG CA C 13 54.794 0.3 . 1 . . . . . 26 ARG CA . 50453 1 285 . 1 . 1 26 26 ARG CB C 13 32.761 0.3 . 1 . . . . . 26 ARG CB . 50453 1 286 . 1 . 1 26 26 ARG CG C 13 26.699 0.3 . 1 . . . . . 26 ARG CG . 50453 1 287 . 1 . 1 26 26 ARG CD C 13 43.645 0.3 . 1 . . . . . 26 ARG CD . 50453 1 288 . 1 . 1 26 26 ARG N N 15 118.878 0.3 . 1 . . . . . 26 ARG N . 50453 1 289 . 1 . 1 27 27 GLY H H 1 7.972 0.020 . 1 . . . . . 27 GLY H . 50453 1 290 . 1 . 1 27 27 GLY HA2 H 1 4.440 0.020 . 2 . . . . . 27 GLY HA2 . 50453 1 291 . 1 . 1 27 27 GLY HA3 H 1 3.941 0.020 . 2 . . . . . 27 GLY HA3 . 50453 1 292 . 1 . 1 27 27 GLY C C 13 171.141 0.3 . 1 . . . . . 27 GLY C . 50453 1 293 . 1 . 1 27 27 GLY CA C 13 44.362 0.3 . 1 . . . . . 27 GLY CA . 50453 1 294 . 1 . 1 27 27 GLY N N 15 109.214 0.3 . 1 . . . . . 27 GLY N . 50453 1 295 . 1 . 1 28 28 ALA H H 1 8.802 0.020 . 1 . . . . . 28 ALA H . 50453 1 296 . 1 . 1 28 28 ALA HA H 1 4.982 0.020 . 1 . . . . . 28 ALA HA . 50453 1 297 . 1 . 1 28 28 ALA HB1 H 1 1.248 0.020 . 1 . . . . . 28 ALA HB . 50453 1 298 . 1 . 1 28 28 ALA HB2 H 1 1.248 0.020 . 1 . . . . . 28 ALA HB . 50453 1 299 . 1 . 1 28 28 ALA HB3 H 1 1.248 0.020 . 1 . . . . . 28 ALA HB . 50453 1 300 . 1 . 1 28 28 ALA C C 13 174.919 0.3 . 1 . . . . . 28 ALA C . 50453 1 301 . 1 . 1 28 28 ALA CA C 13 50.539 0.3 . 1 . . . . . 28 ALA CA . 50453 1 302 . 1 . 1 28 28 ALA CB C 13 21.135 0.3 . 1 . . . . . 28 ALA CB . 50453 1 303 . 1 . 1 28 28 ALA N N 15 123.776 0.3 . 1 . . . . . 28 ALA N . 50453 1 304 . 1 . 1 29 29 PHE H H 1 8.961 0.020 . 1 . . . . . 29 PHE H . 50453 1 305 . 1 . 1 29 29 PHE HA H 1 4.801 0.020 . 1 . . . . . 29 PHE HA . 50453 1 306 . 1 . 1 29 29 PHE HB2 H 1 2.719 0.020 . 2 . . . . . 29 PHE HB2 . 50453 1 307 . 1 . 1 29 29 PHE HB3 H 1 3.118 0.020 . 2 . . . . . 29 PHE HB3 . 50453 1 308 . 1 . 1 29 29 PHE C C 13 173.782 0.3 . 1 . . . . . 29 PHE C . 50453 1 309 . 1 . 1 29 29 PHE CA C 13 58.106 0.3 . 1 . . . . . 29 PHE CA . 50453 1 310 . 1 . 1 29 29 PHE CB C 13 40.482 0.3 . 1 . . . . . 29 PHE CB . 50453 1 311 . 1 . 1 29 29 PHE N N 15 128.072 0.3 . 1 . . . . . 29 PHE N . 50453 1 312 . 1 . 1 30 30 VAL H H 1 8.379 0.020 . 1 . . . . . 30 VAL H . 50453 1 313 . 1 . 1 30 30 VAL HA H 1 3.892 0.020 . 1 . . . . . 30 VAL HA . 50453 1 314 . 1 . 1 30 30 VAL HB H 1 2.223 0.020 . 1 . . . . . 30 VAL HB . 50453 1 315 . 1 . 1 30 30 VAL HG11 H 1 0.673 0.020 . 2 . . . . . 30 VAL HG1 . 50453 1 316 . 1 . 1 30 30 VAL HG12 H 1 0.673 0.020 . 2 . . . . . 30 VAL HG1 . 50453 1 317 . 1 . 1 30 30 VAL HG13 H 1 0.673 0.020 . 2 . . . . . 30 VAL HG1 . 50453 1 318 . 1 . 1 30 30 VAL HG21 H 1 0.823 0.020 . 2 . . . . . 30 VAL HG2 . 50453 1 319 . 1 . 1 30 30 VAL HG22 H 1 0.823 0.020 . 2 . . . . . 30 VAL HG2 . 50453 1 320 . 1 . 1 30 30 VAL HG23 H 1 0.823 0.020 . 2 . . . . . 30 VAL HG2 . 50453 1 321 . 1 . 1 30 30 VAL C C 13 173.883 0.3 . 1 . . . . . 30 VAL C . 50453 1 322 . 1 . 1 30 30 VAL CA C 13 62.907 0.3 . 1 . . . . . 30 VAL CA . 50453 1 323 . 1 . 1 30 30 VAL CB C 13 31.064 0.3 . 1 . . . . . 30 VAL CB . 50453 1 324 . 1 . 1 30 30 VAL CG1 C 13 22.631 0.3 . 1 . . . . . 30 VAL CG1 . 50453 1 325 . 1 . 1 30 30 VAL CG2 C 13 21.295 0.3 . 1 . . . . . 30 VAL CG2 . 50453 1 326 . 1 . 1 30 30 VAL N N 15 130.347 0.3 . 1 . . . . . 30 VAL N . 50453 1 327 . 1 . 1 31 31 SER H H 1 9.083 0.020 . 1 . . . . . 31 SER H . 50453 1 328 . 1 . 1 31 31 SER HA H 1 4.579 0.020 . 1 . . . . . 31 SER HA . 50453 1 329 . 1 . 1 31 31 SER HB2 H 1 4.086 0.020 . 2 . . . . . 31 SER HB2 . 50453 1 330 . 1 . 1 31 31 SER HB3 H 1 3.840 0.020 . 2 . . . . . 31 SER HB3 . 50453 1 331 . 1 . 1 31 31 SER C C 13 174.836 0.3 . 1 . . . . . 31 SER C . 50453 1 332 . 1 . 1 31 31 SER CA C 13 59.526 0.3 . 1 . . . . . 31 SER CA . 50453 1 333 . 1 . 1 31 31 SER CB C 13 64.344 0.3 . 1 . . . . . 31 SER CB . 50453 1 334 . 1 . 1 31 31 SER N N 15 126.739 0.3 . 1 . . . . . 31 SER N . 50453 1 335 . 1 . 1 32 32 GLN H H 1 7.848 0.020 . 1 . . . . . 32 GLN H . 50453 1 336 . 1 . 1 32 32 GLN HA H 1 4.599 0.020 . 1 . . . . . 32 GLN HA . 50453 1 337 . 1 . 1 32 32 GLN HB2 H 1 2.004 0.020 . 2 . . . . . 32 GLN HB2 . 50453 1 338 . 1 . 1 32 32 GLN HB3 H 1 2.128 0.020 . 2 . . . . . 32 GLN HB3 . 50453 1 339 . 1 . 1 32 32 GLN HG2 H 1 2.456 0.020 . 1 . . . . . 32 GLN HG2 . 50453 1 340 . 1 . 1 32 32 GLN HG3 H 1 2.456 0.020 . 1 . . . . . 32 GLN HG3 . 50453 1 341 . 1 . 1 32 32 GLN C C 13 173.013 0.3 . 1 . . . . . 32 GLN C . 50453 1 342 . 1 . 1 32 32 GLN CA C 13 56.002 0.3 . 1 . . . . . 32 GLN CA . 50453 1 343 . 1 . 1 32 32 GLN CB C 13 32.891 0.3 . 1 . . . . . 32 GLN CB . 50453 1 344 . 1 . 1 32 32 GLN CG C 13 34.325 0.3 . 1 . . . . . 32 GLN CG . 50453 1 345 . 1 . 1 32 32 GLN N N 15 120.493 0.3 . 1 . . . . . 32 GLN N . 50453 1 346 . 1 . 1 33 33 VAL H H 1 8.836 0.020 . 1 . . . . . 33 VAL H . 50453 1 347 . 1 . 1 33 33 VAL HA H 1 4.664 0.020 . 1 . . . . . 33 VAL HA . 50453 1 348 . 1 . 1 33 33 VAL HB H 1 1.902 0.020 . 1 . . . . . 33 VAL HB . 50453 1 349 . 1 . 1 33 33 VAL HG11 H 1 0.730 0.020 . 2 . . . . . 33 VAL HG1 . 50453 1 350 . 1 . 1 33 33 VAL HG12 H 1 0.730 0.020 . 2 . . . . . 33 VAL HG1 . 50453 1 351 . 1 . 1 33 33 VAL HG13 H 1 0.730 0.020 . 2 . . . . . 33 VAL HG1 . 50453 1 352 . 1 . 1 33 33 VAL HG21 H 1 0.825 0.020 . 2 . . . . . 33 VAL HG2 . 50453 1 353 . 1 . 1 33 33 VAL HG22 H 1 0.825 0.020 . 2 . . . . . 33 VAL HG2 . 50453 1 354 . 1 . 1 33 33 VAL HG23 H 1 0.825 0.020 . 2 . . . . . 33 VAL HG2 . 50453 1 355 . 1 . 1 33 33 VAL C C 13 175.989 0.3 . 1 . . . . . 33 VAL C . 50453 1 356 . 1 . 1 33 33 VAL CA C 13 60.781 0.3 . 1 . . . . . 33 VAL CA . 50453 1 357 . 1 . 1 33 33 VAL CB C 13 34.039 0.3 . 1 . . . . . 33 VAL CB . 50453 1 358 . 1 . 1 33 33 VAL CG1 C 13 21.501 0.3 . 1 . . . . . 33 VAL CG1 . 50453 1 359 . 1 . 1 33 33 VAL CG2 C 13 21.205 0.3 . 1 . . . . . 33 VAL CG2 . 50453 1 360 . 1 . 1 33 33 VAL N N 15 125.531 0.3 . 1 . . . . . 33 VAL N . 50453 1 361 . 1 . 1 34 34 LEU H H 1 9.079 0.020 . 1 . . . . . 34 LEU H . 50453 1 362 . 1 . 1 34 34 LEU HA H 1 4.639 0.020 . 1 . . . . . 34 LEU HA . 50453 1 363 . 1 . 1 34 34 LEU HB2 H 1 1.746 0.020 . 1 . . . . . 34 LEU HB2 . 50453 1 364 . 1 . 1 34 34 LEU HB3 H 1 1.746 0.020 . 1 . . . . . 34 LEU HB3 . 50453 1 365 . 1 . 1 34 34 LEU HG H 1 1.570 0.020 . 1 . . . . . 34 LEU HG . 50453 1 366 . 1 . 1 34 34 LEU HD11 H 1 0.982 0.020 . 2 . . . . . 34 LEU HD1 . 50453 1 367 . 1 . 1 34 34 LEU HD12 H 1 0.982 0.020 . 2 . . . . . 34 LEU HD1 . 50453 1 368 . 1 . 1 34 34 LEU HD13 H 1 0.982 0.020 . 2 . . . . . 34 LEU HD1 . 50453 1 369 . 1 . 1 34 34 LEU HD21 H 1 1.020 0.020 . 2 . . . . . 34 LEU HD2 . 50453 1 370 . 1 . 1 34 34 LEU HD22 H 1 1.020 0.020 . 2 . . . . . 34 LEU HD2 . 50453 1 371 . 1 . 1 34 34 LEU HD23 H 1 1.020 0.020 . 2 . . . . . 34 LEU HD2 . 50453 1 372 . 1 . 1 34 34 LEU C C 13 175.621 0.3 . 1 . . . . . 34 LEU C . 50453 1 373 . 1 . 1 34 34 LEU CA C 13 53.448 0.3 . 1 . . . . . 34 LEU CA . 50453 1 374 . 1 . 1 34 34 LEU CB C 13 40.651 0.3 . 1 . . . . . 34 LEU CB . 50453 1 375 . 1 . 1 34 34 LEU CG C 13 28.032 0.3 . 1 . . . . . 34 LEU CG . 50453 1 376 . 1 . 1 34 34 LEU CD1 C 13 23.214 0.3 . 1 . . . . . 34 LEU CD1 . 50453 1 377 . 1 . 1 34 34 LEU CD2 C 13 24.911 0.3 . 1 . . . . . 34 LEU CD2 . 50453 1 378 . 1 . 1 34 34 LEU N N 15 132.104 0.3 . 1 . . . . . 34 LEU N . 50453 1 379 . 1 . 1 35 35 PRO HA H 1 4.712 0.020 . 1 . . . . . 35 PRO HA . 50453 1 380 . 1 . 1 35 35 PRO HB2 H 1 2.468 0.020 . 1 . . . . . 35 PRO HB2 . 50453 1 381 . 1 . 1 35 35 PRO HB3 H 1 2.468 0.020 . 1 . . . . . 35 PRO HB3 . 50453 1 382 . 1 . 1 35 35 PRO HG2 H 1 2.129 0.020 . 2 . . . . . 35 PRO HG2 . 50453 1 383 . 1 . 1 35 35 PRO HG3 H 1 2.208 0.020 . 2 . . . . . 35 PRO HG3 . 50453 1 384 . 1 . 1 35 35 PRO HD2 H 1 3.763 0.020 . 2 . . . . . 35 PRO HD2 . 50453 1 385 . 1 . 1 35 35 PRO HD3 H 1 4.066 0.020 . 2 . . . . . 35 PRO HD3 . 50453 1 386 . 1 . 1 35 35 PRO C C 13 176.873 0.3 . 1 . . . . . 35 PRO C . 50453 1 387 . 1 . 1 35 35 PRO CA C 13 63.278 0.3 . 1 . . . . . 35 PRO CA . 50453 1 388 . 1 . 1 35 35 PRO CB C 13 32.500 0.3 . 1 . . . . . 35 PRO CB . 50453 1 389 . 1 . 1 35 35 PRO CG C 13 27.513 0.3 . 1 . . . . . 35 PRO CG . 50453 1 390 . 1 . 1 35 35 PRO CD C 13 50.806 0.3 . 1 . . . . . 35 PRO CD . 50453 1 391 . 1 . 1 36 36 ASN H H 1 7.966 0.020 . 1 . . . . . 36 ASN H . 50453 1 392 . 1 . 1 36 36 ASN HA H 1 4.627 0.020 . 1 . . . . . 36 ASN HA . 50453 1 393 . 1 . 1 36 36 ASN HB2 H 1 3.034 0.020 . 2 . . . . . 36 ASN HB2 . 50453 1 394 . 1 . 1 36 36 ASN HB3 H 1 3.319 0.020 . 2 . . . . . 36 ASN HB3 . 50453 1 395 . 1 . 1 36 36 ASN C C 13 175.889 0.3 . 1 . . . . . 36 ASN C . 50453 1 396 . 1 . 1 36 36 ASN CA C 13 57.682 0.3 . 1 . . . . . 36 ASN CA . 50453 1 397 . 1 . 1 36 36 ASN CB C 13 39.567 0.3 . 1 . . . . . 36 ASN CB . 50453 1 398 . 1 . 1 36 36 ASN N N 15 123.791 0.3 . 1 . . . . . 36 ASN N . 50453 1 399 . 1 . 1 38 38 SER HA H 1 4.221 0.020 . 1 . . . . . 38 SER HA . 50453 1 400 . 1 . 1 38 38 SER HB2 H 1 4.186 0.020 . 1 . . . . . 38 SER HB2 . 50453 1 401 . 1 . 1 38 38 SER HB3 H 1 4.186 0.020 . 1 . . . . . 38 SER HB3 . 50453 1 402 . 1 . 1 38 38 SER C C 13 177.106 0.3 . 1 . . . . . 38 SER C . 50453 1 403 . 1 . 1 38 38 SER CA C 13 63.159 0.3 . 1 . . . . . 38 SER CA . 50453 1 404 . 1 . 1 38 38 SER CB C 13 63.648 0.3 . 1 . . . . . 38 SER CB . 50453 1 405 . 1 . 1 39 39 ALA H H 1 8.396 0.020 . 1 . . . . . 39 ALA H . 50453 1 406 . 1 . 1 39 39 ALA HA H 1 4.045 0.020 . 1 . . . . . 39 ALA HA . 50453 1 407 . 1 . 1 39 39 ALA HB1 H 1 1.390 0.020 . 1 . . . . . 39 ALA HB . 50453 1 408 . 1 . 1 39 39 ALA HB2 H 1 1.390 0.020 . 1 . . . . . 39 ALA HB . 50453 1 409 . 1 . 1 39 39 ALA HB3 H 1 1.390 0.020 . 1 . . . . . 39 ALA HB . 50453 1 410 . 1 . 1 39 39 ALA C C 13 178.096 0.3 . 1 . . . . . 39 ALA C . 50453 1 411 . 1 . 1 39 39 ALA CA C 13 55.404 0.3 . 1 . . . . . 39 ALA CA . 50453 1 412 . 1 . 1 39 39 ALA CB C 13 19.756 0.3 . 1 . . . . . 39 ALA CB . 50453 1 413 . 1 . 1 39 39 ALA N N 15 123.658 0.3 . 1 . . . . . 39 ALA N . 50453 1 414 . 1 . 1 40 40 ALA H H 1 8.027 0.020 . 1 . . . . . 40 ALA H . 50453 1 415 . 1 . 1 40 40 ALA HA H 1 4.200 0.020 . 1 . . . . . 40 ALA HA . 50453 1 416 . 1 . 1 40 40 ALA HB1 H 1 1.739 0.020 . 1 . . . . . 40 ALA HB . 50453 1 417 . 1 . 1 40 40 ALA HB2 H 1 1.739 0.020 . 1 . . . . . 40 ALA HB . 50453 1 418 . 1 . 1 40 40 ALA HB3 H 1 1.739 0.020 . 1 . . . . . 40 ALA HB . 50453 1 419 . 1 . 1 40 40 ALA C C 13 182.309 0.3 . 1 . . . . . 40 ALA C . 50453 1 420 . 1 . 1 40 40 ALA CA C 13 55.305 0.3 . 1 . . . . . 40 ALA CA . 50453 1 421 . 1 . 1 40 40 ALA CB C 13 18.254 0.3 . 1 . . . . . 40 ALA CB . 50453 1 422 . 1 . 1 40 40 ALA N N 15 124.381 0.3 . 1 . . . . . 40 ALA N . 50453 1 423 . 1 . 1 41 41 LYS H H 1 8.462 0.020 . 1 . . . . . 41 LYS H . 50453 1 424 . 1 . 1 41 41 LYS HA H 1 4.174 0.020 . 1 . . . . . 41 LYS HA . 50453 1 425 . 1 . 1 41 41 LYS HB2 H 1 2.110 0.020 . 1 . . . . . 41 LYS HB2 . 50453 1 426 . 1 . 1 41 41 LYS HB3 H 1 2.110 0.020 . 1 . . . . . 41 LYS HB3 . 50453 1 427 . 1 . 1 41 41 LYS HG2 H 1 1.646 0.020 . 2 . . . . . 41 LYS HG2 . 50453 1 428 . 1 . 1 41 41 LYS HG3 H 1 1.714 0.020 . 2 . . . . . 41 LYS HG3 . 50453 1 429 . 1 . 1 41 41 LYS HD2 H 1 1.852 0.020 . 1 . . . . . 41 LYS HD2 . 50453 1 430 . 1 . 1 41 41 LYS HD3 H 1 1.852 0.020 . 1 . . . . . 41 LYS HD3 . 50453 1 431 . 1 . 1 41 41 LYS HE2 H 1 3.106 0.020 . 1 . . . . . 41 LYS HE2 . 50453 1 432 . 1 . 1 41 41 LYS HE3 H 1 3.106 0.020 . 1 . . . . . 41 LYS HE3 . 50453 1 433 . 1 . 1 41 41 LYS C C 13 177.912 0.3 . 1 . . . . . 41 LYS C . 50453 1 434 . 1 . 1 41 41 LYS CA C 13 59.212 0.3 . 1 . . . . . 41 LYS CA . 50453 1 435 . 1 . 1 41 41 LYS CB C 13 32.420 0.3 . 1 . . . . . 41 LYS CB . 50453 1 436 . 1 . 1 41 41 LYS CG C 13 25.793 0.3 . 1 . . . . . 41 LYS CG . 50453 1 437 . 1 . 1 41 41 LYS CD C 13 28.991 0.3 . 1 . . . . . 41 LYS CD . 50453 1 438 . 1 . 1 41 41 LYS CE C 13 42.256 0.3 . 1 . . . . . 41 LYS CE . 50453 1 439 . 1 . 1 41 41 LYS N N 15 121.731 0.3 . 1 . . . . . 41 LYS N . 50453 1 440 . 1 . 1 42 42 ALA H H 1 7.810 0.020 . 1 . . . . . 42 ALA H . 50453 1 441 . 1 . 1 42 42 ALA HA H 1 4.586 0.020 . 1 . . . . . 42 ALA HA . 50453 1 442 . 1 . 1 42 42 ALA HB1 H 1 1.645 0.020 . 1 . . . . . 42 ALA HB . 50453 1 443 . 1 . 1 42 42 ALA HB2 H 1 1.645 0.020 . 1 . . . . . 42 ALA HB . 50453 1 444 . 1 . 1 42 42 ALA HB3 H 1 1.645 0.020 . 1 . . . . . 42 ALA HB . 50453 1 445 . 1 . 1 42 42 ALA C C 13 177.427 0.3 . 1 . . . . . 42 ALA C . 50453 1 446 . 1 . 1 42 42 ALA CA C 13 52.584 0.3 . 1 . . . . . 42 ALA CA . 50453 1 447 . 1 . 1 42 42 ALA CB C 13 20.453 0.3 . 1 . . . . . 42 ALA CB . 50453 1 448 . 1 . 1 42 42 ALA N N 15 121.481 0.3 . 1 . . . . . 42 ALA N . 50453 1 449 . 1 . 1 43 43 GLY H H 1 7.819 0.020 . 1 . . . . . 43 GLY H . 50453 1 450 . 1 . 1 43 43 GLY HA2 H 1 3.851 0.020 . 2 . . . . . 43 GLY HA2 . 50453 1 451 . 1 . 1 43 43 GLY HA3 H 1 4.359 0.020 . 2 . . . . . 43 GLY HA3 . 50453 1 452 . 1 . 1 43 43 GLY C C 13 175.170 0.3 . 1 . . . . . 43 GLY C . 50453 1 453 . 1 . 1 43 43 GLY CA C 13 45.619 0.3 . 1 . . . . . 43 GLY CA . 50453 1 454 . 1 . 1 43 43 GLY N N 15 106.142 0.3 . 1 . . . . . 43 GLY N . 50453 1 455 . 1 . 1 44 44 ILE H H 1 7.820 0.020 . 1 . . . . . 44 ILE H . 50453 1 456 . 1 . 1 44 44 ILE HA H 1 3.758 0.020 . 1 . . . . . 44 ILE HA . 50453 1 457 . 1 . 1 44 44 ILE HB H 1 1.600 0.020 . 1 . . . . . 44 ILE HB . 50453 1 458 . 1 . 1 44 44 ILE HG12 H 1 1.192 0.020 . 2 . . . . . 44 ILE HG12 . 50453 1 459 . 1 . 1 44 44 ILE HG13 H 1 1.663 0.020 . 2 . . . . . 44 ILE HG13 . 50453 1 460 . 1 . 1 44 44 ILE HG21 H 1 1.017 0.020 . 1 . . . . . 44 ILE HG2 . 50453 1 461 . 1 . 1 44 44 ILE HG22 H 1 1.017 0.020 . 1 . . . . . 44 ILE HG2 . 50453 1 462 . 1 . 1 44 44 ILE HG23 H 1 1.017 0.020 . 1 . . . . . 44 ILE HG2 . 50453 1 463 . 1 . 1 44 44 ILE HD11 H 1 0.846 0.020 . 1 . . . . . 44 ILE HD1 . 50453 1 464 . 1 . 1 44 44 ILE HD12 H 1 0.846 0.020 . 1 . . . . . 44 ILE HD1 . 50453 1 465 . 1 . 1 44 44 ILE HD13 H 1 0.846 0.020 . 1 . . . . . 44 ILE HD1 . 50453 1 466 . 1 . 1 44 44 ILE C C 13 173.465 0.3 . 1 . . . . . 44 ILE C . 50453 1 467 . 1 . 1 44 44 ILE CA C 13 62.354 0.3 . 1 . . . . . 44 ILE CA . 50453 1 468 . 1 . 1 44 44 ILE CB C 13 36.983 0.3 . 1 . . . . . 44 ILE CB . 50453 1 469 . 1 . 1 44 44 ILE CG1 C 13 29.059 0.3 . 1 . . . . . 44 ILE CG1 . 50453 1 470 . 1 . 1 44 44 ILE CG2 C 13 17.421 0.3 . 1 . . . . . 44 ILE CG2 . 50453 1 471 . 1 . 1 44 44 ILE CD1 C 13 13.077 0.3 . 1 . . . . . 44 ILE CD1 . 50453 1 472 . 1 . 1 44 44 ILE N N 15 124.036 0.3 . 1 . . . . . 44 ILE N . 50453 1 473 . 1 . 1 45 45 LYS H H 1 9.151 0.020 . 1 . . . . . 45 LYS H . 50453 1 474 . 1 . 1 45 45 LYS HA H 1 4.666 0.020 . 1 . . . . . 45 LYS HA . 50453 1 475 . 1 . 1 45 45 LYS HB2 H 1 1.740 0.020 . 2 . . . . . 45 LYS HB2 . 50453 1 476 . 1 . 1 45 45 LYS HB3 H 1 1.822 0.020 . 2 . . . . . 45 LYS HB3 . 50453 1 477 . 1 . 1 45 45 LYS HG2 H 1 1.460 0.020 . 1 . . . . . 45 LYS HG2 . 50453 1 478 . 1 . 1 45 45 LYS HG3 H 1 1.460 0.020 . 1 . . . . . 45 LYS HG3 . 50453 1 479 . 1 . 1 45 45 LYS HD2 H 1 1.722 0.020 . 1 . . . . . 45 LYS HD2 . 50453 1 480 . 1 . 1 45 45 LYS HD3 H 1 1.722 0.020 . 1 . . . . . 45 LYS HD3 . 50453 1 481 . 1 . 1 45 45 LYS HE2 H 1 3.064 0.020 . 1 . . . . . 45 LYS HE2 . 50453 1 482 . 1 . 1 45 45 LYS HE3 H 1 3.064 0.020 . 1 . . . . . 45 LYS HE3 . 50453 1 483 . 1 . 1 45 45 LYS C C 13 175.086 0.3 . 1 . . . . . 45 LYS C . 50453 1 484 . 1 . 1 45 45 LYS CA C 13 54.499 0.3 . 1 . . . . . 45 LYS CA . 50453 1 485 . 1 . 1 45 45 LYS CB C 13 36.741 0.3 . 1 . . . . . 45 LYS CB . 50453 1 486 . 1 . 1 45 45 LYS CG C 13 24.187 0.3 . 1 . . . . . 45 LYS CG . 50453 1 487 . 1 . 1 45 45 LYS CD C 13 29.481 0.3 . 1 . . . . . 45 LYS CD . 50453 1 488 . 1 . 1 45 45 LYS CE C 13 42.373 0.3 . 1 . . . . . 45 LYS CE . 50453 1 489 . 1 . 1 45 45 LYS N N 15 129.330 0.3 . 1 . . . . . 45 LYS N . 50453 1 490 . 1 . 1 46 46 ALA H H 1 8.466 0.020 . 1 . . . . . 46 ALA H . 50453 1 491 . 1 . 1 46 46 ALA HA H 1 3.809 0.020 . 1 . . . . . 46 ALA HA . 50453 1 492 . 1 . 1 46 46 ALA HB1 H 1 1.389 0.020 . 1 . . . . . 46 ALA HB . 50453 1 493 . 1 . 1 46 46 ALA HB2 H 1 1.389 0.020 . 1 . . . . . 46 ALA HB . 50453 1 494 . 1 . 1 46 46 ALA HB3 H 1 1.389 0.020 . 1 . . . . . 46 ALA HB . 50453 1 495 . 1 . 1 46 46 ALA C C 13 178.932 0.3 . 1 . . . . . 46 ALA C . 50453 1 496 . 1 . 1 46 46 ALA CA C 13 53.208 0.3 . 1 . . . . . 46 ALA CA . 50453 1 497 . 1 . 1 46 46 ALA CB C 13 18.197 0.3 . 1 . . . . . 46 ALA CB . 50453 1 498 . 1 . 1 46 46 ALA N N 15 124.439 0.3 . 1 . . . . . 46 ALA N . 50453 1 499 . 1 . 1 47 47 GLY H H 1 9.270 0.020 . 1 . . . . . 47 GLY H . 50453 1 500 . 1 . 1 47 47 GLY HA2 H 1 3.422 0.020 . 2 . . . . . 47 GLY HA2 . 50453 1 501 . 1 . 1 47 47 GLY HA3 H 1 4.476 0.020 . 2 . . . . . 47 GLY HA3 . 50453 1 502 . 1 . 1 47 47 GLY C C 13 173.732 0.3 . 1 . . . . . 47 GLY C . 50453 1 503 . 1 . 1 47 47 GLY CA C 13 44.908 0.3 . 1 . . . . . 47 GLY CA . 50453 1 504 . 1 . 1 47 47 GLY N N 15 116.185 0.3 . 1 . . . . . 47 GLY N . 50453 1 505 . 1 . 1 48 48 ASP H H 1 7.870 0.020 . 1 . . . . . 48 ASP H . 50453 1 506 . 1 . 1 48 48 ASP HA H 1 4.801 0.020 . 1 . . . . . 48 ASP HA . 50453 1 507 . 1 . 1 48 48 ASP HB2 H 1 2.414 0.020 . 2 . . . . . 48 ASP HB2 . 50453 1 508 . 1 . 1 48 48 ASP HB3 H 1 2.775 0.020 . 2 . . . . . 48 ASP HB3 . 50453 1 509 . 1 . 1 48 48 ASP C C 13 174.769 0.3 . 1 . . . . . 48 ASP C . 50453 1 510 . 1 . 1 48 48 ASP CA C 13 55.546 0.3 . 1 . . . . . 48 ASP CA . 50453 1 511 . 1 . 1 48 48 ASP CB C 13 42.302 0.3 . 1 . . . . . 48 ASP CB . 50453 1 512 . 1 . 1 48 48 ASP N N 15 123.762 0.3 . 1 . . . . . 48 ASP N . 50453 1 513 . 1 . 1 49 49 VAL H H 1 8.071 0.020 . 1 . . . . . 49 VAL H . 50453 1 514 . 1 . 1 49 49 VAL HA H 1 5.007 0.020 . 1 . . . . . 49 VAL HA . 50453 1 515 . 1 . 1 49 49 VAL HB H 1 2.210 0.020 . 1 . . . . . 49 VAL HB . 50453 1 516 . 1 . 1 49 49 VAL HG11 H 1 1.229 0.020 . 2 . . . . . 49 VAL HG1 . 50453 1 517 . 1 . 1 49 49 VAL HG12 H 1 1.229 0.020 . 2 . . . . . 49 VAL HG1 . 50453 1 518 . 1 . 1 49 49 VAL HG13 H 1 1.229 0.020 . 2 . . . . . 49 VAL HG1 . 50453 1 519 . 1 . 1 49 49 VAL HG21 H 1 0.868 0.020 . 2 . . . . . 49 VAL HG2 . 50453 1 520 . 1 . 1 49 49 VAL HG22 H 1 0.868 0.020 . 2 . . . . . 49 VAL HG2 . 50453 1 521 . 1 . 1 49 49 VAL HG23 H 1 0.868 0.020 . 2 . . . . . 49 VAL HG2 . 50453 1 522 . 1 . 1 49 49 VAL C C 13 176.257 0.3 . 1 . . . . . 49 VAL C . 50453 1 523 . 1 . 1 49 49 VAL CA C 13 60.581 0.3 . 1 . . . . . 49 VAL CA . 50453 1 524 . 1 . 1 49 49 VAL CB C 13 34.526 0.3 . 1 . . . . . 49 VAL CB . 50453 1 525 . 1 . 1 49 49 VAL CG1 C 13 22.573 0.3 . 1 . . . . . 49 VAL CG1 . 50453 1 526 . 1 . 1 49 49 VAL CG2 C 13 21.774 0.3 . 1 . . . . . 49 VAL CG2 . 50453 1 527 . 1 . 1 49 49 VAL N N 15 120.067 0.3 . 1 . . . . . 49 VAL N . 50453 1 528 . 1 . 1 50 50 ILE H H 1 9.554 0.020 . 1 . . . . . 50 ILE H . 50453 1 529 . 1 . 1 50 50 ILE HA H 1 4.624 0.020 . 1 . . . . . 50 ILE HA . 50453 1 530 . 1 . 1 50 50 ILE HB H 1 1.777 0.020 . 1 . . . . . 50 ILE HB . 50453 1 531 . 1 . 1 50 50 ILE HG12 H 1 1.283 0.020 . 2 . . . . . 50 ILE HG12 . 50453 1 532 . 1 . 1 50 50 ILE HG13 H 1 1.366 0.020 . 2 . . . . . 50 ILE HG13 . 50453 1 533 . 1 . 1 50 50 ILE HG21 H 1 0.895 0.020 . 1 . . . . . 50 ILE HG2 . 50453 1 534 . 1 . 1 50 50 ILE HG22 H 1 0.895 0.020 . 1 . . . . . 50 ILE HG2 . 50453 1 535 . 1 . 1 50 50 ILE HG23 H 1 0.895 0.020 . 1 . . . . . 50 ILE HG2 . 50453 1 536 . 1 . 1 50 50 ILE HD11 H 1 0.850 0.020 . 1 . . . . . 50 ILE HD1 . 50453 1 537 . 1 . 1 50 50 ILE HD12 H 1 0.850 0.020 . 1 . . . . . 50 ILE HD1 . 50453 1 538 . 1 . 1 50 50 ILE HD13 H 1 0.850 0.020 . 1 . . . . . 50 ILE HD1 . 50453 1 539 . 1 . 1 50 50 ILE C C 13 176.253 0.3 . 1 . . . . . 50 ILE C . 50453 1 540 . 1 . 1 50 50 ILE CA C 13 61.477 0.3 . 1 . . . . . 50 ILE CA . 50453 1 541 . 1 . 1 50 50 ILE CB C 13 39.740 0.3 . 1 . . . . . 50 ILE CB . 50453 1 542 . 1 . 1 50 50 ILE CG1 C 13 26.356 0.3 . 1 . . . . . 50 ILE CG1 . 50453 1 543 . 1 . 1 50 50 ILE CG2 C 13 18.972 0.3 . 1 . . . . . 50 ILE CG2 . 50453 1 544 . 1 . 1 50 50 ILE CD1 C 13 11.534 0.3 . 1 . . . . . 50 ILE CD1 . 50453 1 545 . 1 . 1 50 50 ILE N N 15 129.819 0.3 . 1 . . . . . 50 ILE N . 50453 1 546 . 1 . 1 51 51 THR H H 1 9.438 0.020 . 1 . . . . . 51 THR H . 50453 1 547 . 1 . 1 51 51 THR HA H 1 4.942 0.020 . 1 . . . . . 51 THR HA . 50453 1 548 . 1 . 1 51 51 THR HB H 1 4.514 0.020 . 1 . . . . . 51 THR HB . 50453 1 549 . 1 . 1 51 51 THR HG21 H 1 1.295 0.020 . 1 . . . . . 51 THR HG2 . 50453 1 550 . 1 . 1 51 51 THR HG22 H 1 1.295 0.020 . 1 . . . . . 51 THR HG2 . 50453 1 551 . 1 . 1 51 51 THR HG23 H 1 1.295 0.020 . 1 . . . . . 51 THR HG2 . 50453 1 552 . 1 . 1 51 51 THR C C 13 176.725 0.3 . 1 . . . . . 51 THR C . 50453 1 553 . 1 . 1 51 51 THR CA C 13 61.758 0.3 . 1 . . . . . 51 THR CA . 50453 1 554 . 1 . 1 51 51 THR CB C 13 70.361 0.3 . 1 . . . . . 51 THR CB . 50453 1 555 . 1 . 1 51 51 THR CG2 C 13 22.313 0.3 . 1 . . . . . 51 THR CG2 . 50453 1 556 . 1 . 1 51 51 THR N N 15 118.786 0.3 . 1 . . . . . 51 THR N . 50453 1 557 . 1 . 1 52 52 SER H H 1 8.364 0.020 . 1 . . . . . 52 SER H . 50453 1 558 . 1 . 1 52 52 SER HA H 1 5.296 0.020 . 1 . . . . . 52 SER HA . 50453 1 559 . 1 . 1 52 52 SER HB2 H 1 3.505 0.020 . 2 . . . . . 52 SER HB2 . 50453 1 560 . 1 . 1 52 52 SER HB3 H 1 3.874 0.020 . 2 . . . . . 52 SER HB3 . 50453 1 561 . 1 . 1 52 52 SER C C 13 172.060 0.3 . 1 . . . . . 52 SER C . 50453 1 562 . 1 . 1 52 52 SER CA C 13 58.286 0.3 . 1 . . . . . 52 SER CA . 50453 1 563 . 1 . 1 52 52 SER CB C 13 65.916 0.3 . 1 . . . . . 52 SER CB . 50453 1 564 . 1 . 1 52 52 SER N N 15 119.890 0.3 . 1 . . . . . 52 SER N . 50453 1 565 . 1 . 1 53 53 LEU H H 1 9.067 0.020 . 1 . . . . . 53 LEU H . 50453 1 566 . 1 . 1 53 53 LEU HA H 1 5.140 0.020 . 1 . . . . . 53 LEU HA . 50453 1 567 . 1 . 1 53 53 LEU HB2 H 1 1.291 0.020 . 2 . . . . . 53 LEU HB2 . 50453 1 568 . 1 . 1 53 53 LEU HB3 H 1 1.848 0.020 . 2 . . . . . 53 LEU HB3 . 50453 1 569 . 1 . 1 53 53 LEU HG H 1 1.660 0.020 . 1 . . . . . 53 LEU HG . 50453 1 570 . 1 . 1 53 53 LEU HD11 H 1 0.952 0.020 . 2 . . . . . 53 LEU HD1 . 50453 1 571 . 1 . 1 53 53 LEU HD12 H 1 0.952 0.020 . 2 . . . . . 53 LEU HD1 . 50453 1 572 . 1 . 1 53 53 LEU HD13 H 1 0.952 0.020 . 2 . . . . . 53 LEU HD1 . 50453 1 573 . 1 . 1 53 53 LEU HD21 H 1 0.814 0.020 . 2 . . . . . 53 LEU HD2 . 50453 1 574 . 1 . 1 53 53 LEU HD22 H 1 0.814 0.020 . 2 . . . . . 53 LEU HD2 . 50453 1 575 . 1 . 1 53 53 LEU HD23 H 1 0.814 0.020 . 2 . . . . . 53 LEU HD2 . 50453 1 576 . 1 . 1 53 53 LEU C C 13 175.755 0.3 . 1 . . . . . 53 LEU C . 50453 1 577 . 1 . 1 53 53 LEU CA C 13 54.374 0.3 . 1 . . . . . 53 LEU CA . 50453 1 578 . 1 . 1 53 53 LEU CB C 13 45.218 0.3 . 1 . . . . . 53 LEU CB . 50453 1 579 . 1 . 1 53 53 LEU CG C 13 27.727 0.3 . 1 . . . . . 53 LEU CG . 50453 1 580 . 1 . 1 53 53 LEU CD1 C 13 26.276 0.3 . 1 . . . . . 53 LEU CD1 . 50453 1 581 . 1 . 1 53 53 LEU CD2 C 13 26.628 0.3 . 1 . . . . . 53 LEU CD2 . 50453 1 582 . 1 . 1 53 53 LEU N N 15 124.898 0.3 . 1 . . . . . 53 LEU N . 50453 1 583 . 1 . 1 54 54 ASN H H 1 10.178 0.020 . 1 . . . . . 54 ASN H . 50453 1 584 . 1 . 1 54 54 ASN HA H 1 4.596 0.020 . 1 . . . . . 54 ASN HA . 50453 1 585 . 1 . 1 54 54 ASN HB2 H 1 3.033 0.020 . 2 . . . . . 54 ASN HB2 . 50453 1 586 . 1 . 1 54 54 ASN HB3 H 1 3.314 0.020 . 2 . . . . . 54 ASN HB3 . 50453 1 587 . 1 . 1 54 54 ASN C C 13 175.270 0.3 . 1 . . . . . 54 ASN C . 50453 1 588 . 1 . 1 54 54 ASN CA C 13 54.144 0.3 . 1 . . . . . 54 ASN CA . 50453 1 589 . 1 . 1 54 54 ASN CB C 13 36.602 0.3 . 1 . . . . . 54 ASN CB . 50453 1 590 . 1 . 1 54 54 ASN N N 15 130.823 0.3 . 1 . . . . . 54 ASN N . 50453 1 591 . 1 . 1 55 55 GLY H H 1 9.086 0.020 . 1 . . . . . 55 GLY H . 50453 1 592 . 1 . 1 55 55 GLY HA2 H 1 3.676 0.020 . 2 . . . . . 55 GLY HA2 . 50453 1 593 . 1 . 1 55 55 GLY HA3 H 1 4.296 0.020 . 2 . . . . . 55 GLY HA3 . 50453 1 594 . 1 . 1 55 55 GLY C C 13 173.966 0.3 . 1 . . . . . 55 GLY C . 50453 1 595 . 1 . 1 55 55 GLY CA C 13 45.371 0.3 . 1 . . . . . 55 GLY CA . 50453 1 596 . 1 . 1 55 55 GLY N N 15 105.301 0.3 . 1 . . . . . 55 GLY N . 50453 1 597 . 1 . 1 56 56 LYS H H 1 8.140 0.020 . 1 . . . . . 56 LYS H . 50453 1 598 . 1 . 1 56 56 LYS HA H 1 5.015 0.020 . 1 . . . . . 56 LYS HA . 50453 1 599 . 1 . 1 56 56 LYS HB2 H 1 2.034 0.020 . 1 . . . . . 56 LYS HB2 . 50453 1 600 . 1 . 1 56 56 LYS HB3 H 1 2.034 0.020 . 1 . . . . . 56 LYS HB3 . 50453 1 601 . 1 . 1 56 56 LYS HG2 H 1 1.586 0.020 . 2 . . . . . 56 LYS HG2 . 50453 1 602 . 1 . 1 56 56 LYS HG3 H 1 1.665 0.020 . 2 . . . . . 56 LYS HG3 . 50453 1 603 . 1 . 1 56 56 LYS HD2 H 1 1.597 0.020 . 2 . . . . . 56 LYS HD2 . 50453 1 604 . 1 . 1 56 56 LYS HD3 H 1 1.663 0.020 . 2 . . . . . 56 LYS HD3 . 50453 1 605 . 1 . 1 56 56 LYS HE2 H 1 3.151 0.020 . 2 . . . . . 56 LYS HE2 . 50453 1 606 . 1 . 1 56 56 LYS HE3 H 1 3.188 0.020 . 2 . . . . . 56 LYS HE3 . 50453 1 607 . 1 . 1 56 56 LYS CA C 13 52.936 0.3 . 1 . . . . . 56 LYS CA . 50453 1 608 . 1 . 1 56 56 LYS CB C 13 33.181 0.3 . 1 . . . . . 56 LYS CB . 50453 1 609 . 1 . 1 56 56 LYS CG C 13 24.850 0.3 . 1 . . . . . 56 LYS CG . 50453 1 610 . 1 . 1 56 56 LYS CD C 13 29.054 0.3 . 1 . . . . . 56 LYS CD . 50453 1 611 . 1 . 1 56 56 LYS CE C 13 42.515 0.3 . 1 . . . . . 56 LYS CE . 50453 1 612 . 1 . 1 56 56 LYS N N 15 124.844 0.3 . 1 . . . . . 56 LYS N . 50453 1 613 . 1 . 1 57 57 PRO HA H 1 4.446 0.020 . 1 . . . . . 57 PRO HA . 50453 1 614 . 1 . 1 57 57 PRO HB2 H 1 2.377 0.020 . 1 . . . . . 57 PRO HB2 . 50453 1 615 . 1 . 1 57 57 PRO HB3 H 1 2.377 0.020 . 1 . . . . . 57 PRO HB3 . 50453 1 616 . 1 . 1 57 57 PRO HG2 H 1 1.922 0.020 . 2 . . . . . 57 PRO HG2 . 50453 1 617 . 1 . 1 57 57 PRO HG3 H 1 2.026 0.020 . 2 . . . . . 57 PRO HG3 . 50453 1 618 . 1 . 1 57 57 PRO HD2 H 1 3.689 0.020 . 2 . . . . . 57 PRO HD2 . 50453 1 619 . 1 . 1 57 57 PRO HD3 H 1 4.002 0.020 . 2 . . . . . 57 PRO HD3 . 50453 1 620 . 1 . 1 57 57 PRO CA C 13 63.719 0.3 . 1 . . . . . 57 PRO CA . 50453 1 621 . 1 . 1 57 57 PRO CB C 13 31.415 0.3 . 1 . . . . . 57 PRO CB . 50453 1 622 . 1 . 1 57 57 PRO CG C 13 27.356 0.3 . 1 . . . . . 57 PRO CG . 50453 1 623 . 1 . 1 57 57 PRO CD C 13 50.402 0.3 . 1 . . . . . 57 PRO CD . 50453 1 624 . 1 . 1 58 58 ILE HA H 1 4.304 0.020 . 1 . . . . . 58 ILE HA . 50453 1 625 . 1 . 1 58 58 ILE HB H 1 1.931 0.020 . 1 . . . . . 58 ILE HB . 50453 1 626 . 1 . 1 58 58 ILE HG12 H 1 1.115 0.020 . 2 . . . . . 58 ILE HG12 . 50453 1 627 . 1 . 1 58 58 ILE HG13 H 1 1.592 0.020 . 2 . . . . . 58 ILE HG13 . 50453 1 628 . 1 . 1 58 58 ILE HG21 H 1 1.144 0.020 . 1 . . . . . 58 ILE HG2 . 50453 1 629 . 1 . 1 58 58 ILE HG22 H 1 1.144 0.020 . 1 . . . . . 58 ILE HG2 . 50453 1 630 . 1 . 1 58 58 ILE HG23 H 1 1.144 0.020 . 1 . . . . . 58 ILE HG2 . 50453 1 631 . 1 . 1 58 58 ILE HD11 H 1 0.884 0.020 . 1 . . . . . 58 ILE HD1 . 50453 1 632 . 1 . 1 58 58 ILE HD12 H 1 0.884 0.020 . 1 . . . . . 58 ILE HD1 . 50453 1 633 . 1 . 1 58 58 ILE HD13 H 1 0.884 0.020 . 1 . . . . . 58 ILE HD1 . 50453 1 634 . 1 . 1 58 58 ILE CA C 13 61.581 0.3 . 1 . . . . . 58 ILE CA . 50453 1 635 . 1 . 1 58 58 ILE CB C 13 39.273 0.3 . 1 . . . . . 58 ILE CB . 50453 1 636 . 1 . 1 58 58 ILE CG1 C 13 27.841 0.3 . 1 . . . . . 58 ILE CG1 . 50453 1 637 . 1 . 1 58 58 ILE CG2 C 13 18.604 0.3 . 1 . . . . . 58 ILE CG2 . 50453 1 638 . 1 . 1 58 58 ILE CD1 C 13 13.392 0.3 . 1 . . . . . 58 ILE CD1 . 50453 1 639 . 1 . 1 61 61 PHE HA H 1 4.389 0.020 . 1 . . . . . 61 PHE HA . 50453 1 640 . 1 . 1 61 61 PHE HB2 H 1 3.063 0.020 . 2 . . . . . 61 PHE HB2 . 50453 1 641 . 1 . 1 61 61 PHE HB3 H 1 3.184 0.020 . 2 . . . . . 61 PHE HB3 . 50453 1 642 . 1 . 1 61 61 PHE CA C 13 60.930 0.3 . 1 . . . . . 61 PHE CA . 50453 1 643 . 1 . 1 61 61 PHE CB C 13 37.874 0.3 . 1 . . . . . 61 PHE CB . 50453 1 644 . 1 . 1 62 62 ALA HA H 1 3.987 0.020 . 1 . . . . . 62 ALA HA . 50453 1 645 . 1 . 1 62 62 ALA HB1 H 1 1.596 0.020 . 1 . . . . . 62 ALA HB . 50453 1 646 . 1 . 1 62 62 ALA HB2 H 1 1.596 0.020 . 1 . . . . . 62 ALA HB . 50453 1 647 . 1 . 1 62 62 ALA HB3 H 1 1.596 0.020 . 1 . . . . . 62 ALA HB . 50453 1 648 . 1 . 1 62 62 ALA C C 13 180.610 0.3 . 1 . . . . . 62 ALA C . 50453 1 649 . 1 . 1 62 62 ALA CA C 13 55.703 0.3 . 1 . . . . . 62 ALA CA . 50453 1 650 . 1 . 1 62 62 ALA CB C 13 18.011 0.3 . 1 . . . . . 62 ALA CB . 50453 1 651 . 1 . 1 63 63 ALA H H 1 8.458 0.020 . 1 . . . . . 63 ALA H . 50453 1 652 . 1 . 1 63 63 ALA HA H 1 4.276 0.020 . 1 . . . . . 63 ALA HA . 50453 1 653 . 1 . 1 63 63 ALA HB1 H 1 1.638 0.020 . 1 . . . . . 63 ALA HB . 50453 1 654 . 1 . 1 63 63 ALA HB2 H 1 1.638 0.020 . 1 . . . . . 63 ALA HB . 50453 1 655 . 1 . 1 63 63 ALA HB3 H 1 1.638 0.020 . 1 . . . . . 63 ALA HB . 50453 1 656 . 1 . 1 63 63 ALA C C 13 180.152 0.3 . 1 . . . . . 63 ALA C . 50453 1 657 . 1 . 1 63 63 ALA CA C 13 54.857 0.3 . 1 . . . . . 63 ALA CA . 50453 1 658 . 1 . 1 63 63 ALA CB C 13 18.824 0.3 . 1 . . . . . 63 ALA CB . 50453 1 659 . 1 . 1 63 63 ALA N N 15 123.310 0.3 . 1 . . . . . 63 ALA N . 50453 1 660 . 1 . 1 64 64 LEU H H 1 7.678 0.020 . 1 . . . . . 64 LEU H . 50453 1 661 . 1 . 1 64 64 LEU HA H 1 4.060 0.020 . 1 . . . . . 64 LEU HA . 50453 1 662 . 1 . 1 64 64 LEU HB2 H 1 1.619 0.020 . 2 . . . . . 64 LEU HB2 . 50453 1 663 . 1 . 1 64 64 LEU HB3 H 1 2.178 0.020 . 2 . . . . . 64 LEU HB3 . 50453 1 664 . 1 . 1 64 64 LEU HG H 1 1.591 0.020 . 1 . . . . . 64 LEU HG . 50453 1 665 . 1 . 1 64 64 LEU HD11 H 1 0.963 0.020 . 2 . . . . . 64 LEU HD1 . 50453 1 666 . 1 . 1 64 64 LEU HD12 H 1 0.963 0.020 . 2 . . . . . 64 LEU HD1 . 50453 1 667 . 1 . 1 64 64 LEU HD13 H 1 0.963 0.020 . 2 . . . . . 64 LEU HD1 . 50453 1 668 . 1 . 1 64 64 LEU HD21 H 1 0.890 0.020 . 2 . . . . . 64 LEU HD2 . 50453 1 669 . 1 . 1 64 64 LEU HD22 H 1 0.890 0.020 . 2 . . . . . 64 LEU HD2 . 50453 1 670 . 1 . 1 64 64 LEU HD23 H 1 0.890 0.020 . 2 . . . . . 64 LEU HD2 . 50453 1 671 . 1 . 1 64 64 LEU C C 13 177.778 0.3 . 1 . . . . . 64 LEU C . 50453 1 672 . 1 . 1 64 64 LEU CA C 13 58.621 0.3 . 1 . . . . . 64 LEU CA . 50453 1 673 . 1 . 1 64 64 LEU CB C 13 41.623 0.3 . 1 . . . . . 64 LEU CB . 50453 1 674 . 1 . 1 64 64 LEU CG C 13 27.035 0.3 . 1 . . . . . 64 LEU CG . 50453 1 675 . 1 . 1 64 64 LEU CD1 C 13 24.734 0.3 . 1 . . . . . 64 LEU CD1 . 50453 1 676 . 1 . 1 64 64 LEU CD2 C 13 26.540 0.3 . 1 . . . . . 64 LEU CD2 . 50453 1 677 . 1 . 1 64 64 LEU N N 15 122.573 0.3 . 1 . . . . . 64 LEU N . 50453 1 678 . 1 . 1 65 65 ARG H H 1 8.528 0.020 . 1 . . . . . 65 ARG H . 50453 1 679 . 1 . 1 65 65 ARG HA H 1 3.828 0.020 . 1 . . . . . 65 ARG HA . 50453 1 680 . 1 . 1 65 65 ARG HB2 H 1 1.657 0.020 . 2 . . . . . 65 ARG HB2 . 50453 1 681 . 1 . 1 65 65 ARG HB3 H 1 1.808 0.020 . 2 . . . . . 65 ARG HB3 . 50453 1 682 . 1 . 1 65 65 ARG HG2 H 1 1.501 0.020 . 2 . . . . . 65 ARG HG2 . 50453 1 683 . 1 . 1 65 65 ARG HG3 H 1 1.602 0.020 . 2 . . . . . 65 ARG HG3 . 50453 1 684 . 1 . 1 65 65 ARG HD2 H 1 3.170 0.020 . 2 . . . . . 65 ARG HD2 . 50453 1 685 . 1 . 1 65 65 ARG HD3 H 1 3.239 0.020 . 2 . . . . . 65 ARG HD3 . 50453 1 686 . 1 . 1 65 65 ARG C C 13 179.467 0.3 . 1 . . . . . 65 ARG C . 50453 1 687 . 1 . 1 65 65 ARG CA C 13 59.759 0.3 . 1 . . . . . 65 ARG CA . 50453 1 688 . 1 . 1 65 65 ARG CB C 13 30.110 0.3 . 1 . . . . . 65 ARG CB . 50453 1 689 . 1 . 1 65 65 ARG CG C 13 27.424 0.3 . 1 . . . . . 65 ARG CG . 50453 1 690 . 1 . 1 65 65 ARG CD C 13 43.759 0.3 . 1 . . . . . 65 ARG CD . 50453 1 691 . 1 . 1 65 65 ARG N N 15 120.027 0.3 . 1 . . . . . 65 ARG N . 50453 1 692 . 1 . 1 66 66 ALA H H 1 8.096 0.020 . 1 . . . . . 66 ALA H . 50453 1 693 . 1 . 1 66 66 ALA HA H 1 4.250 0.020 . 1 . . . . . 66 ALA HA . 50453 1 694 . 1 . 1 66 66 ALA HB1 H 1 1.622 0.020 . 1 . . . . . 66 ALA HB . 50453 1 695 . 1 . 1 66 66 ALA HB2 H 1 1.622 0.020 . 1 . . . . . 66 ALA HB . 50453 1 696 . 1 . 1 66 66 ALA HB3 H 1 1.622 0.020 . 1 . . . . . 66 ALA HB . 50453 1 697 . 1 . 1 66 66 ALA C C 13 180.303 0.3 . 1 . . . . . 66 ALA C . 50453 1 698 . 1 . 1 66 66 ALA CA C 13 54.847 0.3 . 1 . . . . . 66 ALA CA . 50453 1 699 . 1 . 1 66 66 ALA CB C 13 18.387 0.3 . 1 . . . . . 66 ALA CB . 50453 1 700 . 1 . 1 66 66 ALA N N 15 123.768 0.3 . 1 . . . . . 66 ALA N . 50453 1 701 . 1 . 1 67 67 GLN H H 1 8.184 0.020 . 1 . . . . . 67 GLN H . 50453 1 702 . 1 . 1 67 67 GLN HA H 1 4.234 0.020 . 1 . . . . . 67 GLN HA . 50453 1 703 . 1 . 1 67 67 GLN HB2 H 1 2.185 0.020 . 1 . . . . . 67 GLN HB2 . 50453 1 704 . 1 . 1 67 67 GLN HB3 H 1 2.185 0.020 . 1 . . . . . 67 GLN HB3 . 50453 1 705 . 1 . 1 67 67 GLN HG2 H 1 2.591 0.020 . 1 . . . . . 67 GLN HG2 . 50453 1 706 . 1 . 1 67 67 GLN HG3 H 1 2.591 0.020 . 1 . . . . . 67 GLN HG3 . 50453 1 707 . 1 . 1 67 67 GLN C C 13 179.617 0.3 . 1 . . . . . 67 GLN C . 50453 1 708 . 1 . 1 67 67 GLN CA C 13 58.952 0.3 . 1 . . . . . 67 GLN CA . 50453 1 709 . 1 . 1 67 67 GLN CB C 13 29.141 0.3 . 1 . . . . . 67 GLN CB . 50453 1 710 . 1 . 1 67 67 GLN CG C 13 34.498 0.3 . 1 . . . . . 67 GLN CG . 50453 1 711 . 1 . 1 67 67 GLN N N 15 119.357 0.3 . 1 . . . . . 67 GLN N . 50453 1 712 . 1 . 1 68 68 VAL H H 1 8.654 0.020 . 1 . . . . . 68 VAL H . 50453 1 713 . 1 . 1 68 68 VAL HA H 1 3.998 0.020 . 1 . . . . . 68 VAL HA . 50453 1 714 . 1 . 1 68 68 VAL HB H 1 2.231 0.020 . 1 . . . . . 68 VAL HB . 50453 1 715 . 1 . 1 68 68 VAL HG11 H 1 1.071 0.020 . 2 . . . . . 68 VAL HG1 . 50453 1 716 . 1 . 1 68 68 VAL HG12 H 1 1.071 0.020 . 2 . . . . . 68 VAL HG1 . 50453 1 717 . 1 . 1 68 68 VAL HG13 H 1 1.071 0.020 . 2 . . . . . 68 VAL HG1 . 50453 1 718 . 1 . 1 68 68 VAL HG21 H 1 1.121 0.020 . 2 . . . . . 68 VAL HG2 . 50453 1 719 . 1 . 1 68 68 VAL HG22 H 1 1.121 0.020 . 2 . . . . . 68 VAL HG2 . 50453 1 720 . 1 . 1 68 68 VAL HG23 H 1 1.121 0.020 . 2 . . . . . 68 VAL HG2 . 50453 1 721 . 1 . 1 68 68 VAL C C 13 178.196 0.3 . 1 . . . . . 68 VAL C . 50453 1 722 . 1 . 1 68 68 VAL CA C 13 65.730 0.3 . 1 . . . . . 68 VAL CA . 50453 1 723 . 1 . 1 68 68 VAL CB C 13 31.691 0.3 . 1 . . . . . 68 VAL CB . 50453 1 724 . 1 . 1 68 68 VAL CG1 C 13 22.513 0.3 . 1 . . . . . 68 VAL CG1 . 50453 1 725 . 1 . 1 68 68 VAL CG2 C 13 23.109 0.3 . 1 . . . . . 68 VAL CG2 . 50453 1 726 . 1 . 1 68 68 VAL N N 15 120.700 0.3 . 1 . . . . . 68 VAL N . 50453 1 727 . 1 . 1 69 69 GLY H H 1 8.019 0.020 . 1 . . . . . 69 GLY H . 50453 1 728 . 1 . 1 69 69 GLY HA2 H 1 4.082 0.020 . 2 . . . . . 69 GLY HA2 . 50453 1 729 . 1 . 1 69 69 GLY HA3 H 1 4.255 0.020 . 2 . . . . . 69 GLY HA3 . 50453 1 730 . 1 . 1 69 69 GLY C C 13 174.602 0.3 . 1 . . . . . 69 GLY C . 50453 1 731 . 1 . 1 69 69 GLY CA C 13 46.735 0.3 . 1 . . . . . 69 GLY CA . 50453 1 732 . 1 . 1 69 69 GLY N N 15 107.868 0.3 . 1 . . . . . 69 GLY N . 50453 1 733 . 1 . 1 70 70 THR H H 1 7.500 0.020 . 1 . . . . . 70 THR H . 50453 1 734 . 1 . 1 70 70 THR HA H 1 4.638 0.020 . 1 . . . . . 70 THR HA . 50453 1 735 . 1 . 1 70 70 THR HB H 1 4.599 0.020 . 1 . . . . . 70 THR HB . 50453 1 736 . 1 . 1 70 70 THR HG21 H 1 1.435 0.020 . 1 . . . . . 70 THR HG2 . 50453 1 737 . 1 . 1 70 70 THR HG22 H 1 1.435 0.020 . 1 . . . . . 70 THR HG2 . 50453 1 738 . 1 . 1 70 70 THR HG23 H 1 1.435 0.020 . 1 . . . . . 70 THR HG2 . 50453 1 739 . 1 . 1 70 70 THR C C 13 175.031 0.3 . 1 . . . . . 70 THR C . 50453 1 740 . 1 . 1 70 70 THR CA C 13 61.831 0.3 . 1 . . . . . 70 THR CA . 50453 1 741 . 1 . 1 70 70 THR CB C 13 70.091 0.3 . 1 . . . . . 70 THR CB . 50453 1 742 . 1 . 1 70 70 THR CG2 C 13 21.672 0.3 . 1 . . . . . 70 THR CG2 . 50453 1 743 . 1 . 1 70 70 THR N N 15 110.591 0.3 . 1 . . . . . 70 THR N . 50453 1 744 . 1 . 1 71 71 MET H H 1 7.780 0.020 . 1 . . . . . 71 MET H . 50453 1 745 . 1 . 1 71 71 MET HA H 1 4.908 0.020 . 1 . . . . . 71 MET HA . 50453 1 746 . 1 . 1 71 71 MET HB2 H 1 2.261 0.020 . 1 . . . . . 71 MET HB2 . 50453 1 747 . 1 . 1 71 71 MET HB3 H 1 2.261 0.020 . 1 . . . . . 71 MET HB3 . 50453 1 748 . 1 . 1 71 71 MET HG2 H 1 2.567 0.020 . 1 . . . . . 71 MET HG2 . 50453 1 749 . 1 . 1 71 71 MET HG3 H 1 2.567 0.020 . 1 . . . . . 71 MET HG3 . 50453 1 750 . 1 . 1 71 71 MET C C 13 174.114 0.3 . 1 . . . . . 71 MET C . 50453 1 751 . 1 . 1 71 71 MET CA C 13 54.298 0.3 . 1 . . . . . 71 MET CA . 50453 1 752 . 1 . 1 71 71 MET CB C 13 31.303 0.3 . 1 . . . . . 71 MET CB . 50453 1 753 . 1 . 1 71 71 MET CG C 13 32.425 0.3 . 1 . . . . . 71 MET CG . 50453 1 754 . 1 . 1 71 71 MET N N 15 126.068 0.3 . 1 . . . . . 71 MET N . 50453 1 755 . 1 . 1 72 72 PRO HA H 1 4.730 0.020 . 1 . . . . . 72 PRO HA . 50453 1 756 . 1 . 1 72 72 PRO HB2 H 1 2.453 0.020 . 1 . . . . . 72 PRO HB2 . 50453 1 757 . 1 . 1 72 72 PRO HB3 H 1 2.453 0.020 . 1 . . . . . 72 PRO HB3 . 50453 1 758 . 1 . 1 72 72 PRO HG2 H 1 2.163 0.020 . 2 . . . . . 72 PRO HG2 . 50453 1 759 . 1 . 1 72 72 PRO HG3 H 1 2.245 0.020 . 2 . . . . . 72 PRO HG3 . 50453 1 760 . 1 . 1 72 72 PRO HD2 H 1 3.809 0.020 . 2 . . . . . 72 PRO HD2 . 50453 1 761 . 1 . 1 72 72 PRO HD3 H 1 4.044 0.020 . 2 . . . . . 72 PRO HD3 . 50453 1 762 . 1 . 1 72 72 PRO CA C 13 62.930 0.3 . 1 . . . . . 72 PRO CA . 50453 1 763 . 1 . 1 72 72 PRO CB C 13 32.049 0.3 . 1 . . . . . 72 PRO CB . 50453 1 764 . 1 . 1 72 72 PRO CG C 13 27.702 0.3 . 1 . . . . . 72 PRO CG . 50453 1 765 . 1 . 1 72 72 PRO CD C 13 50.960 0.3 . 1 . . . . . 72 PRO CD . 50453 1 766 . 1 . 1 73 73 VAL HA H 1 3.633 0.020 . 1 . . . . . 73 VAL HA . 50453 1 767 . 1 . 1 73 73 VAL HB H 1 2.092 0.020 . 1 . . . . . 73 VAL HB . 50453 1 768 . 1 . 1 73 73 VAL HG11 H 1 1.069 0.020 . 2 . . . . . 73 VAL HG1 . 50453 1 769 . 1 . 1 73 73 VAL HG12 H 1 1.069 0.020 . 2 . . . . . 73 VAL HG1 . 50453 1 770 . 1 . 1 73 73 VAL HG13 H 1 1.069 0.020 . 2 . . . . . 73 VAL HG1 . 50453 1 771 . 1 . 1 73 73 VAL HG21 H 1 1.095 0.020 . 2 . . . . . 73 VAL HG2 . 50453 1 772 . 1 . 1 73 73 VAL HG22 H 1 1.095 0.020 . 2 . . . . . 73 VAL HG2 . 50453 1 773 . 1 . 1 73 73 VAL HG23 H 1 1.095 0.020 . 2 . . . . . 73 VAL HG2 . 50453 1 774 . 1 . 1 73 73 VAL C C 13 176.424 0.3 . 1 . . . . . 73 VAL C . 50453 1 775 . 1 . 1 73 73 VAL CA C 13 65.303 0.3 . 1 . . . . . 73 VAL CA . 50453 1 776 . 1 . 1 73 73 VAL CB C 13 31.623 0.3 . 1 . . . . . 73 VAL CB . 50453 1 777 . 1 . 1 73 73 VAL CG1 C 13 22.293 0.3 . 1 . . . . . 73 VAL CG1 . 50453 1 778 . 1 . 1 73 73 VAL CG2 C 13 21.477 0.3 . 1 . . . . . 73 VAL CG2 . 50453 1 779 . 1 . 1 74 74 GLY H H 1 9.047 0.020 . 1 . . . . . 74 GLY H . 50453 1 780 . 1 . 1 74 74 GLY HA2 H 1 3.850 0.020 . 2 . . . . . 74 GLY HA2 . 50453 1 781 . 1 . 1 74 74 GLY HA3 H 1 4.508 0.020 . 2 . . . . . 74 GLY HA3 . 50453 1 782 . 1 . 1 74 74 GLY C C 13 174.602 0.3 . 1 . . . . . 74 GLY C . 50453 1 783 . 1 . 1 74 74 GLY CA C 13 44.834 0.3 . 1 . . . . . 74 GLY CA . 50453 1 784 . 1 . 1 74 74 GLY N N 15 117.694 0.3 . 1 . . . . . 74 GLY N . 50453 1 785 . 1 . 1 75 75 SER H H 1 7.895 0.020 . 1 . . . . . 75 SER H . 50453 1 786 . 1 . 1 75 75 SER HA H 1 4.469 0.020 . 1 . . . . . 75 SER HA . 50453 1 787 . 1 . 1 75 75 SER HB2 H 1 4.261 0.020 . 2 . . . . . 75 SER HB2 . 50453 1 788 . 1 . 1 75 75 SER HB3 H 1 4.723 0.020 . 2 . . . . . 75 SER HB3 . 50453 1 789 . 1 . 1 75 75 SER C C 13 172.495 0.3 . 1 . . . . . 75 SER C . 50453 1 790 . 1 . 1 75 75 SER CA C 13 60.576 0.3 . 1 . . . . . 75 SER CA . 50453 1 791 . 1 . 1 75 75 SER CB C 13 65.026 0.3 . 1 . . . . . 75 SER CB . 50453 1 792 . 1 . 1 75 75 SER N N 15 117.944 0.3 . 1 . . . . . 75 SER N . 50453 1 793 . 1 . 1 76 76 LYS H H 1 8.688 0.020 . 1 . . . . . 76 LYS H . 50453 1 794 . 1 . 1 76 76 LYS HA H 1 5.008 0.020 . 1 . . . . . 76 LYS HA . 50453 1 795 . 1 . 1 76 76 LYS HB2 H 1 1.893 0.020 . 2 . . . . . 76 LYS HB2 . 50453 1 796 . 1 . 1 76 76 LYS HB3 H 1 1.966 0.020 . 2 . . . . . 76 LYS HB3 . 50453 1 797 . 1 . 1 76 76 LYS HG2 H 1 1.504 0.020 . 2 . . . . . 76 LYS HG2 . 50453 1 798 . 1 . 1 76 76 LYS HG3 H 1 1.647 0.020 . 2 . . . . . 76 LYS HG3 . 50453 1 799 . 1 . 1 76 76 LYS HD2 H 1 1.657 0.020 . 2 . . . . . 76 LYS HD2 . 50453 1 800 . 1 . 1 76 76 LYS HD3 H 1 1.712 0.020 . 2 . . . . . 76 LYS HD3 . 50453 1 801 . 1 . 1 76 76 LYS HE2 H 1 3.069 0.020 . 1 . . . . . 76 LYS HE2 . 50453 1 802 . 1 . 1 76 76 LYS HE3 H 1 3.069 0.020 . 1 . . . . . 76 LYS HE3 . 50453 1 803 . 1 . 1 76 76 LYS C C 13 175.989 0.3 . 1 . . . . . 76 LYS C . 50453 1 804 . 1 . 1 76 76 LYS CA C 13 55.748 0.3 . 1 . . . . . 76 LYS CA . 50453 1 805 . 1 . 1 76 76 LYS CB C 13 33.179 0.3 . 1 . . . . . 76 LYS CB . 50453 1 806 . 1 . 1 76 76 LYS CG C 13 25.249 0.3 . 1 . . . . . 76 LYS CG . 50453 1 807 . 1 . 1 76 76 LYS CD C 13 29.447 0.3 . 1 . . . . . 76 LYS CD . 50453 1 808 . 1 . 1 76 76 LYS CE C 13 42.225 0.3 . 1 . . . . . 76 LYS CE . 50453 1 809 . 1 . 1 76 76 LYS N N 15 125.772 0.3 . 1 . . . . . 76 LYS N . 50453 1 810 . 1 . 1 77 77 LEU H H 1 9.259 0.020 . 1 . . . . . 77 LEU H . 50453 1 811 . 1 . 1 77 77 LEU HA H 1 5.125 0.020 . 1 . . . . . 77 LEU HA . 50453 1 812 . 1 . 1 77 77 LEU HB2 H 1 1.605 0.020 . 2 . . . . . 77 LEU HB2 . 50453 1 813 . 1 . 1 77 77 LEU HB3 H 1 1.729 0.020 . 2 . . . . . 77 LEU HB3 . 50453 1 814 . 1 . 1 77 77 LEU HG H 1 1.487 0.020 . 1 . . . . . 77 LEU HG . 50453 1 815 . 1 . 1 77 77 LEU HD11 H 1 0.919 0.020 . 2 . . . . . 77 LEU HD1 . 50453 1 816 . 1 . 1 77 77 LEU HD12 H 1 0.919 0.020 . 2 . . . . . 77 LEU HD1 . 50453 1 817 . 1 . 1 77 77 LEU HD13 H 1 0.919 0.020 . 2 . . . . . 77 LEU HD1 . 50453 1 818 . 1 . 1 77 77 LEU HD21 H 1 0.978 0.020 . 2 . . . . . 77 LEU HD2 . 50453 1 819 . 1 . 1 77 77 LEU HD22 H 1 0.978 0.020 . 2 . . . . . 77 LEU HD2 . 50453 1 820 . 1 . 1 77 77 LEU HD23 H 1 0.978 0.020 . 2 . . . . . 77 LEU HD2 . 50453 1 821 . 1 . 1 77 77 LEU C C 13 175.822 0.3 . 1 . . . . . 77 LEU C . 50453 1 822 . 1 . 1 77 77 LEU CA C 13 54.239 0.3 . 1 . . . . . 77 LEU CA . 50453 1 823 . 1 . 1 77 77 LEU CB C 13 44.501 0.3 . 1 . . . . . 77 LEU CB . 50453 1 824 . 1 . 1 77 77 LEU CG C 13 27.154 0.3 . 1 . . . . . 77 LEU CG . 50453 1 825 . 1 . 1 77 77 LEU CD1 C 13 26.505 0.3 . 1 . . . . . 77 LEU CD1 . 50453 1 826 . 1 . 1 77 77 LEU CD2 C 13 26.342 0.3 . 1 . . . . . 77 LEU CD2 . 50453 1 827 . 1 . 1 77 77 LEU N N 15 126.386 0.3 . 1 . . . . . 77 LEU N . 50453 1 828 . 1 . 1 78 78 THR H H 1 8.847 0.020 . 1 . . . . . 78 THR H . 50453 1 829 . 1 . 1 78 78 THR HA H 1 5.347 0.020 . 1 . . . . . 78 THR HA . 50453 1 830 . 1 . 1 78 78 THR HB H 1 4.087 0.020 . 1 . . . . . 78 THR HB . 50453 1 831 . 1 . 1 78 78 THR HG21 H 1 1.236 0.020 . 1 . . . . . 78 THR HG2 . 50453 1 832 . 1 . 1 78 78 THR HG22 H 1 1.236 0.020 . 1 . . . . . 78 THR HG2 . 50453 1 833 . 1 . 1 78 78 THR HG23 H 1 1.236 0.020 . 1 . . . . . 78 THR HG2 . 50453 1 834 . 1 . 1 78 78 THR C C 13 174.752 0.3 . 1 . . . . . 78 THR C . 50453 1 835 . 1 . 1 78 78 THR CA C 13 61.314 0.3 . 1 . . . . . 78 THR CA . 50453 1 836 . 1 . 1 78 78 THR CB C 13 70.519 0.3 . 1 . . . . . 78 THR CB . 50453 1 837 . 1 . 1 78 78 THR CG2 C 13 21.559 0.3 . 1 . . . . . 78 THR CG2 . 50453 1 838 . 1 . 1 78 78 THR N N 15 119.827 0.3 . 1 . . . . . 78 THR N . 50453 1 839 . 1 . 1 79 79 LEU H H 1 9.499 0.020 . 1 . . . . . 79 LEU H . 50453 1 840 . 1 . 1 79 79 LEU HA H 1 5.284 0.020 . 1 . . . . . 79 LEU HA . 50453 1 841 . 1 . 1 79 79 LEU HB2 H 1 1.541 0.020 . 2 . . . . . 79 LEU HB2 . 50453 1 842 . 1 . 1 79 79 LEU HB3 H 1 1.741 0.020 . 2 . . . . . 79 LEU HB3 . 50453 1 843 . 1 . 1 79 79 LEU HG H 1 1.519 0.020 . 1 . . . . . 79 LEU HG . 50453 1 844 . 1 . 1 79 79 LEU HD11 H 1 1.029 0.020 . 2 . . . . . 79 LEU HD1 . 50453 1 845 . 1 . 1 79 79 LEU HD12 H 1 1.029 0.020 . 2 . . . . . 79 LEU HD1 . 50453 1 846 . 1 . 1 79 79 LEU HD13 H 1 1.029 0.020 . 2 . . . . . 79 LEU HD1 . 50453 1 847 . 1 . 1 79 79 LEU HD21 H 1 0.948 0.020 . 2 . . . . . 79 LEU HD2 . 50453 1 848 . 1 . 1 79 79 LEU HD22 H 1 0.948 0.020 . 2 . . . . . 79 LEU HD2 . 50453 1 849 . 1 . 1 79 79 LEU HD23 H 1 0.948 0.020 . 2 . . . . . 79 LEU HD2 . 50453 1 850 . 1 . 1 79 79 LEU C C 13 175.153 0.3 . 1 . . . . . 79 LEU C . 50453 1 851 . 1 . 1 79 79 LEU CA C 13 53.772 0.3 . 1 . . . . . 79 LEU CA . 50453 1 852 . 1 . 1 79 79 LEU CB C 13 44.257 0.3 . 1 . . . . . 79 LEU CB . 50453 1 853 . 1 . 1 79 79 LEU CG C 13 27.115 0.3 . 1 . . . . . 79 LEU CG . 50453 1 854 . 1 . 1 79 79 LEU CD1 C 13 25.312 0.3 . 1 . . . . . 79 LEU CD1 . 50453 1 855 . 1 . 1 79 79 LEU CD2 C 13 24.953 0.3 . 1 . . . . . 79 LEU CD2 . 50453 1 856 . 1 . 1 79 79 LEU N N 15 131.528 0.3 . 1 . . . . . 79 LEU N . 50453 1 857 . 1 . 1 80 80 GLY H H 1 8.614 0.020 . 1 . . . . . 80 GLY H . 50453 1 858 . 1 . 1 80 80 GLY HA2 H 1 3.573 0.020 . 2 . . . . . 80 GLY HA2 . 50453 1 859 . 1 . 1 80 80 GLY HA3 H 1 5.070 0.020 . 2 . . . . . 80 GLY HA3 . 50453 1 860 . 1 . 1 80 80 GLY C C 13 173.114 0.3 . 1 . . . . . 80 GLY C . 50453 1 861 . 1 . 1 80 80 GLY CA C 13 44.819 0.3 . 1 . . . . . 80 GLY CA . 50453 1 862 . 1 . 1 80 80 GLY N N 15 114.495 0.3 . 1 . . . . . 80 GLY N . 50453 1 863 . 1 . 1 81 81 LEU H H 1 9.502 0.020 . 1 . . . . . 81 LEU H . 50453 1 864 . 1 . 1 81 81 LEU HA H 1 5.706 0.020 . 1 . . . . . 81 LEU HA . 50453 1 865 . 1 . 1 81 81 LEU HB2 H 1 1.573 0.020 . 2 . . . . . 81 LEU HB2 . 50453 1 866 . 1 . 1 81 81 LEU HB3 H 1 1.677 0.020 . 2 . . . . . 81 LEU HB3 . 50453 1 867 . 1 . 1 81 81 LEU HG H 1 1.840 0.020 . 1 . . . . . 81 LEU HG . 50453 1 868 . 1 . 1 81 81 LEU HD11 H 1 0.819 0.020 . 2 . . . . . 81 LEU HD1 . 50453 1 869 . 1 . 1 81 81 LEU HD12 H 1 0.819 0.020 . 2 . . . . . 81 LEU HD1 . 50453 1 870 . 1 . 1 81 81 LEU HD13 H 1 0.819 0.020 . 2 . . . . . 81 LEU HD1 . 50453 1 871 . 1 . 1 81 81 LEU HD21 H 1 0.823 0.020 . 2 . . . . . 81 LEU HD2 . 50453 1 872 . 1 . 1 81 81 LEU HD22 H 1 0.823 0.020 . 2 . . . . . 81 LEU HD2 . 50453 1 873 . 1 . 1 81 81 LEU HD23 H 1 0.823 0.020 . 2 . . . . . 81 LEU HD2 . 50453 1 874 . 1 . 1 81 81 LEU C C 13 175.705 0.3 . 1 . . . . . 81 LEU C . 50453 1 875 . 1 . 1 81 81 LEU CA C 13 53.171 0.3 . 1 . . . . . 81 LEU CA . 50453 1 876 . 1 . 1 81 81 LEU CB C 13 46.318 0.3 . 1 . . . . . 81 LEU CB . 50453 1 877 . 1 . 1 81 81 LEU CG C 13 26.343 0.3 . 1 . . . . . 81 LEU CG . 50453 1 878 . 1 . 1 81 81 LEU CD1 C 13 26.610 0.3 . 1 . . . . . 81 LEU CD1 . 50453 1 879 . 1 . 1 81 81 LEU CD2 C 13 27.190 0.3 . 1 . . . . . 81 LEU CD2 . 50453 1 880 . 1 . 1 81 81 LEU N N 15 126.755 0.3 . 1 . . . . . 81 LEU N . 50453 1 881 . 1 . 1 82 82 LEU H H 1 9.475 0.020 . 1 . . . . . 82 LEU H . 50453 1 882 . 1 . 1 82 82 LEU HA H 1 5.181 0.020 . 1 . . . . . 82 LEU HA . 50453 1 883 . 1 . 1 82 82 LEU HB2 H 1 1.639 0.020 . 1 . . . . . 82 LEU HB2 . 50453 1 884 . 1 . 1 82 82 LEU HB3 H 1 1.639 0.020 . 1 . . . . . 82 LEU HB3 . 50453 1 885 . 1 . 1 82 82 LEU HG H 1 1.661 0.020 . 1 . . . . . 82 LEU HG . 50453 1 886 . 1 . 1 82 82 LEU HD11 H 1 0.909 0.020 . 2 . . . . . 82 LEU HD1 . 50453 1 887 . 1 . 1 82 82 LEU HD12 H 1 0.909 0.020 . 2 . . . . . 82 LEU HD1 . 50453 1 888 . 1 . 1 82 82 LEU HD13 H 1 0.909 0.020 . 2 . . . . . 82 LEU HD1 . 50453 1 889 . 1 . 1 82 82 LEU HD21 H 1 0.921 0.020 . 2 . . . . . 82 LEU HD2 . 50453 1 890 . 1 . 1 82 82 LEU HD22 H 1 0.921 0.020 . 2 . . . . . 82 LEU HD2 . 50453 1 891 . 1 . 1 82 82 LEU HD23 H 1 0.921 0.020 . 2 . . . . . 82 LEU HD2 . 50453 1 892 . 1 . 1 82 82 LEU C C 13 176.558 0.3 . 1 . . . . . 82 LEU C . 50453 1 893 . 1 . 1 82 82 LEU CA C 13 53.795 0.3 . 1 . . . . . 82 LEU CA . 50453 1 894 . 1 . 1 82 82 LEU CB C 13 44.826 0.3 . 1 . . . . . 82 LEU CB . 50453 1 895 . 1 . 1 82 82 LEU CG C 13 27.180 0.3 . 1 . . . . . 82 LEU CG . 50453 1 896 . 1 . 1 82 82 LEU CD1 C 13 24.299 0.3 . 1 . . . . . 82 LEU CD1 . 50453 1 897 . 1 . 1 82 82 LEU CD2 C 13 25.024 0.3 . 1 . . . . . 82 LEU CD2 . 50453 1 898 . 1 . 1 82 82 LEU N N 15 124.971 0.3 . 1 . . . . . 82 LEU N . 50453 1 899 . 1 . 1 83 83 ARG H H 1 9.305 0.020 . 1 . . . . . 83 ARG H . 50453 1 900 . 1 . 1 83 83 ARG HA H 1 4.761 0.020 . 1 . . . . . 83 ARG HA . 50453 1 901 . 1 . 1 83 83 ARG HB2 H 1 1.623 0.020 . 2 . . . . . 83 ARG HB2 . 50453 1 902 . 1 . 1 83 83 ARG HB3 H 1 1.883 0.020 . 2 . . . . . 83 ARG HB3 . 50453 1 903 . 1 . 1 83 83 ARG HG2 H 1 1.758 0.020 . 1 . . . . . 83 ARG HG2 . 50453 1 904 . 1 . 1 83 83 ARG HG3 H 1 1.758 0.020 . 1 . . . . . 83 ARG HG3 . 50453 1 905 . 1 . 1 83 83 ARG HD2 H 1 3.075 0.020 . 2 . . . . . 83 ARG HD2 . 50453 1 906 . 1 . 1 83 83 ARG HD3 H 1 3.374 0.020 . 2 . . . . . 83 ARG HD3 . 50453 1 907 . 1 . 1 83 83 ARG C C 13 175.872 0.3 . 1 . . . . . 83 ARG C . 50453 1 908 . 1 . 1 83 83 ARG CA C 13 55.318 0.3 . 1 . . . . . 83 ARG CA . 50453 1 909 . 1 . 1 83 83 ARG CB C 13 33.543 0.3 . 1 . . . . . 83 ARG CB . 50453 1 910 . 1 . 1 83 83 ARG CG C 13 25.672 0.3 . 1 . . . . . 83 ARG CG . 50453 1 911 . 1 . 1 83 83 ARG CD C 13 44.072 0.3 . 1 . . . . . 83 ARG CD . 50453 1 912 . 1 . 1 83 83 ARG N N 15 129.521 0.3 . 1 . . . . . 83 ARG N . 50453 1 913 . 1 . 1 84 84 ASP H H 1 9.686 0.020 . 1 . . . . . 84 ASP H . 50453 1 914 . 1 . 1 84 84 ASP HA H 1 4.493 0.020 . 1 . . . . . 84 ASP HA . 50453 1 915 . 1 . 1 84 84 ASP HB2 H 1 2.744 0.020 . 2 . . . . . 84 ASP HB2 . 50453 1 916 . 1 . 1 84 84 ASP HB3 H 1 3.111 0.020 . 2 . . . . . 84 ASP HB3 . 50453 1 917 . 1 . 1 84 84 ASP C C 13 176.156 0.3 . 1 . . . . . 84 ASP C . 50453 1 918 . 1 . 1 84 84 ASP CA C 13 55.782 0.3 . 1 . . . . . 84 ASP CA . 50453 1 919 . 1 . 1 84 84 ASP CB C 13 40.170 0.3 . 1 . . . . . 84 ASP CB . 50453 1 920 . 1 . 1 84 84 ASP N N 15 132.321 0.3 . 1 . . . . . 84 ASP N . 50453 1 921 . 1 . 1 85 85 GLY H H 1 8.805 0.020 . 1 . . . . . 85 GLY H . 50453 1 922 . 1 . 1 85 85 GLY HA2 H 1 3.765 0.020 . 2 . . . . . 85 GLY HA2 . 50453 1 923 . 1 . 1 85 85 GLY HA3 H 1 4.347 0.020 . 2 . . . . . 85 GLY HA3 . 50453 1 924 . 1 . 1 85 85 GLY C C 13 173.849 0.3 . 1 . . . . . 85 GLY C . 50453 1 925 . 1 . 1 85 85 GLY CA C 13 45.833 0.3 . 1 . . . . . 85 GLY CA . 50453 1 926 . 1 . 1 85 85 GLY N N 15 105.174 0.3 . 1 . . . . . 85 GLY N . 50453 1 927 . 1 . 1 86 86 LYS H H 1 8.176 0.020 . 1 . . . . . 86 LYS H . 50453 1 928 . 1 . 1 86 86 LYS HA H 1 4.781 0.020 . 1 . . . . . 86 LYS HA . 50453 1 929 . 1 . 1 86 86 LYS HB2 H 1 1.939 0.020 . 1 . . . . . 86 LYS HB2 . 50453 1 930 . 1 . 1 86 86 LYS HB3 H 1 1.939 0.020 . 1 . . . . . 86 LYS HB3 . 50453 1 931 . 1 . 1 86 86 LYS HG2 H 1 1.585 0.020 . 1 . . . . . 86 LYS HG2 . 50453 1 932 . 1 . 1 86 86 LYS HG3 H 1 1.585 0.020 . 1 . . . . . 86 LYS HG3 . 50453 1 933 . 1 . 1 86 86 LYS HD2 H 1 1.797 0.020 . 1 . . . . . 86 LYS HD2 . 50453 1 934 . 1 . 1 86 86 LYS HD3 H 1 1.797 0.020 . 1 . . . . . 86 LYS HD3 . 50453 1 935 . 1 . 1 86 86 LYS HE2 H 1 2.829 0.020 . 2 . . . . . 86 LYS HE2 . 50453 1 936 . 1 . 1 86 86 LYS HE3 H 1 2.937 0.020 . 2 . . . . . 86 LYS HE3 . 50453 1 937 . 1 . 1 86 86 LYS C C 13 174.969 0.3 . 1 . . . . . 86 LYS C . 50453 1 938 . 1 . 1 86 86 LYS CA C 13 54.667 0.3 . 1 . . . . . 86 LYS CA . 50453 1 939 . 1 . 1 86 86 LYS CB C 13 34.883 0.3 . 1 . . . . . 86 LYS CB . 50453 1 940 . 1 . 1 86 86 LYS CG C 13 24.553 0.3 . 1 . . . . . 86 LYS CG . 50453 1 941 . 1 . 1 86 86 LYS CD C 13 29.277 0.3 . 1 . . . . . 86 LYS CD . 50453 1 942 . 1 . 1 86 86 LYS CE C 13 42.369 0.3 . 1 . . . . . 86 LYS CE . 50453 1 943 . 1 . 1 86 86 LYS N N 15 123.616 0.3 . 1 . . . . . 86 LYS N . 50453 1 944 . 1 . 1 87 87 GLN H H 1 8.587 0.020 . 1 . . . . . 87 GLN H . 50453 1 945 . 1 . 1 87 87 GLN HA H 1 5.121 0.020 . 1 . . . . . 87 GLN HA . 50453 1 946 . 1 . 1 87 87 GLN HB2 H 1 2.075 0.020 . 2 . . . . . 87 GLN HB2 . 50453 1 947 . 1 . 1 87 87 GLN HB3 H 1 2.152 0.020 . 2 . . . . . 87 GLN HB3 . 50453 1 948 . 1 . 1 87 87 GLN HG2 H 1 2.387 0.020 . 1 . . . . . 87 GLN HG2 . 50453 1 949 . 1 . 1 87 87 GLN HG3 H 1 2.387 0.020 . 1 . . . . . 87 GLN HG3 . 50453 1 950 . 1 . 1 87 87 GLN C C 13 176.156 0.3 . 1 . . . . . 87 GLN C . 50453 1 951 . 1 . 1 87 87 GLN CA C 13 55.875 0.3 . 1 . . . . . 87 GLN CA . 50453 1 952 . 1 . 1 87 87 GLN CB C 13 29.477 0.3 . 1 . . . . . 87 GLN CB . 50453 1 953 . 1 . 1 87 87 GLN CG C 13 34.215 0.3 . 1 . . . . . 87 GLN CG . 50453 1 954 . 1 . 1 87 87 GLN N N 15 124.272 0.3 . 1 . . . . . 87 GLN N . 50453 1 955 . 1 . 1 88 88 VAL H H 1 9.314 0.020 . 1 . . . . . 88 VAL H . 50453 1 956 . 1 . 1 88 88 VAL HA H 1 4.446 0.020 . 1 . . . . . 88 VAL HA . 50453 1 957 . 1 . 1 88 88 VAL HB H 1 1.999 0.020 . 1 . . . . . 88 VAL HB . 50453 1 958 . 1 . 1 88 88 VAL HG11 H 1 0.975 0.020 . 2 . . . . . 88 VAL HG1 . 50453 1 959 . 1 . 1 88 88 VAL HG12 H 1 0.975 0.020 . 2 . . . . . 88 VAL HG1 . 50453 1 960 . 1 . 1 88 88 VAL HG13 H 1 0.975 0.020 . 2 . . . . . 88 VAL HG1 . 50453 1 961 . 1 . 1 88 88 VAL HG21 H 1 0.918 0.020 . 2 . . . . . 88 VAL HG2 . 50453 1 962 . 1 . 1 88 88 VAL HG22 H 1 0.918 0.020 . 2 . . . . . 88 VAL HG2 . 50453 1 963 . 1 . 1 88 88 VAL HG23 H 1 0.918 0.020 . 2 . . . . . 88 VAL HG2 . 50453 1 964 . 1 . 1 88 88 VAL C C 13 173.866 0.3 . 1 . . . . . 88 VAL C . 50453 1 965 . 1 . 1 88 88 VAL CA C 13 61.167 0.3 . 1 . . . . . 88 VAL CA . 50453 1 966 . 1 . 1 88 88 VAL CB C 13 35.793 0.3 . 1 . . . . . 88 VAL CB . 50453 1 967 . 1 . 1 88 88 VAL CG1 C 13 21.158 0.3 . 1 . . . . . 88 VAL CG1 . 50453 1 968 . 1 . 1 88 88 VAL CG2 C 13 21.174 0.3 . 1 . . . . . 88 VAL CG2 . 50453 1 969 . 1 . 1 88 88 VAL N N 15 128.987 0.3 . 1 . . . . . 88 VAL N . 50453 1 970 . 1 . 1 89 89 ASN H H 1 8.683 0.020 . 1 . . . . . 89 ASN H . 50453 1 971 . 1 . 1 89 89 ASN HA H 1 5.939 0.020 . 1 . . . . . 89 ASN HA . 50453 1 972 . 1 . 1 89 89 ASN HB2 H 1 2.508 0.020 . 2 . . . . . 89 ASN HB2 . 50453 1 973 . 1 . 1 89 89 ASN HB3 H 1 2.759 0.020 . 2 . . . . . 89 ASN HB3 . 50453 1 974 . 1 . 1 89 89 ASN C C 13 175.304 0.3 . 1 . . . . . 89 ASN C . 50453 1 975 . 1 . 1 89 89 ASN CA C 13 52.196 0.3 . 1 . . . . . 89 ASN CA . 50453 1 976 . 1 . 1 89 89 ASN CB C 13 41.145 0.3 . 1 . . . . . 89 ASN CB . 50453 1 977 . 1 . 1 89 89 ASN N N 15 125.946 0.3 . 1 . . . . . 89 ASN N . 50453 1 978 . 1 . 1 90 90 VAL H H 1 9.241 0.020 . 1 . . . . . 90 VAL H . 50453 1 979 . 1 . 1 90 90 VAL HA H 1 4.747 0.020 . 1 . . . . . 90 VAL HA . 50453 1 980 . 1 . 1 90 90 VAL HB H 1 2.174 0.020 . 1 . . . . . 90 VAL HB . 50453 1 981 . 1 . 1 90 90 VAL HG11 H 1 0.972 0.020 . 2 . . . . . 90 VAL HG1 . 50453 1 982 . 1 . 1 90 90 VAL HG12 H 1 0.972 0.020 . 2 . . . . . 90 VAL HG1 . 50453 1 983 . 1 . 1 90 90 VAL HG13 H 1 0.972 0.020 . 2 . . . . . 90 VAL HG1 . 50453 1 984 . 1 . 1 90 90 VAL HG21 H 1 0.931 0.020 . 2 . . . . . 90 VAL HG2 . 50453 1 985 . 1 . 1 90 90 VAL HG22 H 1 0.931 0.020 . 2 . . . . . 90 VAL HG2 . 50453 1 986 . 1 . 1 90 90 VAL HG23 H 1 0.931 0.020 . 2 . . . . . 90 VAL HG2 . 50453 1 987 . 1 . 1 90 90 VAL C C 13 173.849 0.3 . 1 . . . . . 90 VAL C . 50453 1 988 . 1 . 1 90 90 VAL CA C 13 60.237 0.3 . 1 . . . . . 90 VAL CA . 50453 1 989 . 1 . 1 90 90 VAL CB C 13 35.432 0.3 . 1 . . . . . 90 VAL CB . 50453 1 990 . 1 . 1 90 90 VAL CG1 C 13 22.000 0.3 . 1 . . . . . 90 VAL CG1 . 50453 1 991 . 1 . 1 90 90 VAL CG2 C 13 20.382 0.3 . 1 . . . . . 90 VAL CG2 . 50453 1 992 . 1 . 1 90 90 VAL N N 15 121.188 0.3 . 1 . . . . . 90 VAL N . 50453 1 993 . 1 . 1 91 91 ASN H H 1 8.845 0.020 . 1 . . . . . 91 ASN H . 50453 1 994 . 1 . 1 91 91 ASN HA H 1 5.693 0.020 . 1 . . . . . 91 ASN HA . 50453 1 995 . 1 . 1 91 91 ASN HB2 H 1 2.831 0.020 . 1 . . . . . 91 ASN HB2 . 50453 1 996 . 1 . 1 91 91 ASN HB3 H 1 2.831 0.020 . 1 . . . . . 91 ASN HB3 . 50453 1 997 . 1 . 1 91 91 ASN C C 13 173.933 0.3 . 1 . . . . . 91 ASN C . 50453 1 998 . 1 . 1 91 91 ASN CA C 13 52.438 0.3 . 1 . . . . . 91 ASN CA . 50453 1 999 . 1 . 1 91 91 ASN CB C 13 40.558 0.3 . 1 . . . . . 91 ASN CB . 50453 1 1000 . 1 . 1 91 91 ASN N N 15 125.645 0.3 . 1 . . . . . 91 ASN N . 50453 1 1001 . 1 . 1 92 92 LEU H H 1 9.216 0.020 . 1 . . . . . 92 LEU H . 50453 1 1002 . 1 . 1 92 92 LEU HA H 1 4.833 0.020 . 1 . . . . . 92 LEU HA . 50453 1 1003 . 1 . 1 92 92 LEU HB2 H 1 1.588 0.020 . 2 . . . . . 92 LEU HB2 . 50453 1 1004 . 1 . 1 92 92 LEU HB3 H 1 1.742 0.020 . 2 . . . . . 92 LEU HB3 . 50453 1 1005 . 1 . 1 92 92 LEU HG H 1 1.828 0.020 . 1 . . . . . 92 LEU HG . 50453 1 1006 . 1 . 1 92 92 LEU HD11 H 1 0.828 0.020 . 2 . . . . . 92 LEU HD1 . 50453 1 1007 . 1 . 1 92 92 LEU HD12 H 1 0.828 0.020 . 2 . . . . . 92 LEU HD1 . 50453 1 1008 . 1 . 1 92 92 LEU HD13 H 1 0.828 0.020 . 2 . . . . . 92 LEU HD1 . 50453 1 1009 . 1 . 1 92 92 LEU HD21 H 1 0.812 0.020 . 2 . . . . . 92 LEU HD2 . 50453 1 1010 . 1 . 1 92 92 LEU HD22 H 1 0.812 0.020 . 2 . . . . . 92 LEU HD2 . 50453 1 1011 . 1 . 1 92 92 LEU HD23 H 1 0.812 0.020 . 2 . . . . . 92 LEU HD2 . 50453 1 1012 . 1 . 1 92 92 LEU C C 13 174.234 0.3 . 1 . . . . . 92 LEU C . 50453 1 1013 . 1 . 1 92 92 LEU CA C 13 54.790 0.3 . 1 . . . . . 92 LEU CA . 50453 1 1014 . 1 . 1 92 92 LEU CB C 13 45.394 0.3 . 1 . . . . . 92 LEU CB . 50453 1 1015 . 1 . 1 92 92 LEU CG C 13 27.057 0.3 . 1 . . . . . 92 LEU CG . 50453 1 1016 . 1 . 1 92 92 LEU CD1 C 13 26.612 0.3 . 1 . . . . . 92 LEU CD1 . 50453 1 1017 . 1 . 1 92 92 LEU CD2 C 13 26.064 0.3 . 1 . . . . . 92 LEU CD2 . 50453 1 1018 . 1 . 1 92 92 LEU N N 15 125.161 0.3 . 1 . . . . . 92 LEU N . 50453 1 1019 . 1 . 1 93 93 GLU H H 1 8.566 0.020 . 1 . . . . . 93 GLU H . 50453 1 1020 . 1 . 1 93 93 GLU HA H 1 5.153 0.020 . 1 . . . . . 93 GLU HA . 50453 1 1021 . 1 . 1 93 93 GLU HB2 H 1 1.986 0.020 . 2 . . . . . 93 GLU HB2 . 50453 1 1022 . 1 . 1 93 93 GLU HB3 H 1 2.109 0.020 . 2 . . . . . 93 GLU HB3 . 50453 1 1023 . 1 . 1 93 93 GLU HG2 H 1 2.092 0.020 . 2 . . . . . 93 GLU HG2 . 50453 1 1024 . 1 . 1 93 93 GLU HG3 H 1 2.191 0.020 . 2 . . . . . 93 GLU HG3 . 50453 1 1025 . 1 . 1 93 93 GLU C C 13 176.307 0.3 . 1 . . . . . 93 GLU C . 50453 1 1026 . 1 . 1 93 93 GLU CA C 13 54.560 0.3 . 1 . . . . . 93 GLU CA . 50453 1 1027 . 1 . 1 93 93 GLU CB C 13 32.333 0.3 . 1 . . . . . 93 GLU CB . 50453 1 1028 . 1 . 1 93 93 GLU CG C 13 36.725 0.3 . 1 . . . . . 93 GLU CG . 50453 1 1029 . 1 . 1 93 93 GLU N N 15 125.376 0.3 . 1 . . . . . 93 GLU N . 50453 1 1030 . 1 . 1 94 94 LEU H H 1 8.864 0.020 . 1 . . . . . 94 LEU H . 50453 1 1031 . 1 . 1 94 94 LEU HA H 1 4.389 0.020 . 1 . . . . . 94 LEU HA . 50453 1 1032 . 1 . 1 94 94 LEU HB2 H 1 1.598 0.020 . 2 . . . . . 94 LEU HB2 . 50453 1 1033 . 1 . 1 94 94 LEU HB3 H 1 1.853 0.020 . 2 . . . . . 94 LEU HB3 . 50453 1 1034 . 1 . 1 94 94 LEU HG H 1 1.597 0.020 . 1 . . . . . 94 LEU HG . 50453 1 1035 . 1 . 1 94 94 LEU HD11 H 1 0.926 0.020 . 2 . . . . . 94 LEU HD1 . 50453 1 1036 . 1 . 1 94 94 LEU HD12 H 1 0.926 0.020 . 2 . . . . . 94 LEU HD1 . 50453 1 1037 . 1 . 1 94 94 LEU HD13 H 1 0.926 0.020 . 2 . . . . . 94 LEU HD1 . 50453 1 1038 . 1 . 1 94 94 LEU HD21 H 1 0.900 0.020 . 2 . . . . . 94 LEU HD2 . 50453 1 1039 . 1 . 1 94 94 LEU HD22 H 1 0.900 0.020 . 2 . . . . . 94 LEU HD2 . 50453 1 1040 . 1 . 1 94 94 LEU HD23 H 1 0.900 0.020 . 2 . . . . . 94 LEU HD2 . 50453 1 1041 . 1 . 1 94 94 LEU C C 13 176.390 0.3 . 1 . . . . . 94 LEU C . 50453 1 1042 . 1 . 1 94 94 LEU CA C 13 55.420 0.3 . 1 . . . . . 94 LEU CA . 50453 1 1043 . 1 . 1 94 94 LEU CB C 13 42.619 0.3 . 1 . . . . . 94 LEU CB . 50453 1 1044 . 1 . 1 94 94 LEU CG C 13 26.998 0.3 . 1 . . . . . 94 LEU CG . 50453 1 1045 . 1 . 1 94 94 LEU CD1 C 13 25.212 0.3 . 1 . . . . . 94 LEU CD1 . 50453 1 1046 . 1 . 1 94 94 LEU CD2 C 13 25.039 0.3 . 1 . . . . . 94 LEU CD2 . 50453 1 1047 . 1 . 1 94 94 LEU N N 15 129.236 0.3 . 1 . . . . . 94 LEU N . 50453 1 1048 . 1 . 1 95 95 GLN H H 1 8.449 0.020 . 1 . . . . . 95 GLN H . 50453 1 1049 . 1 . 1 95 95 GLN HA H 1 4.603 0.020 . 1 . . . . . 95 GLN HA . 50453 1 1050 . 1 . 1 95 95 GLN HB2 H 1 1.963 0.020 . 2 . . . . . 95 GLN HB2 . 50453 1 1051 . 1 . 1 95 95 GLN HB3 H 1 2.058 0.020 . 2 . . . . . 95 GLN HB3 . 50453 1 1052 . 1 . 1 95 95 GLN HG2 H 1 2.591 0.020 . 1 . . . . . 95 GLN HG2 . 50453 1 1053 . 1 . 1 95 95 GLN HG3 H 1 2.591 0.020 . 1 . . . . . 95 GLN HG3 . 50453 1 1054 . 1 . 1 95 95 GLN C C 13 175.320 0.3 . 1 . . . . . 95 GLN C . 50453 1 1055 . 1 . 1 95 95 GLN CA C 13 55.147 0.3 . 1 . . . . . 95 GLN CA . 50453 1 1056 . 1 . 1 95 95 GLN CB C 13 31.703 0.3 . 1 . . . . . 95 GLN CB . 50453 1 1057 . 1 . 1 95 95 GLN CG C 13 33.818 0.3 . 1 . . . . . 95 GLN CG . 50453 1 1058 . 1 . 1 95 95 GLN N N 15 128.053 0.3 . 1 . . . . . 95 GLN N . 50453 1 1059 . 1 . 1 96 96 GLN HA H 1 4.604 0.020 . 1 . . . . . 96 GLN HA . 50453 1 1060 . 1 . 1 96 96 GLN HB2 H 1 2.495 0.020 . 1 . . . . . 96 GLN HB2 . 50453 1 1061 . 1 . 1 96 96 GLN HB3 H 1 2.495 0.020 . 1 . . . . . 96 GLN HB3 . 50453 1 1062 . 1 . 1 96 96 GLN HG2 H 1 2.582 0.020 . 1 . . . . . 96 GLN HG2 . 50453 1 1063 . 1 . 1 96 96 GLN HG3 H 1 2.582 0.020 . 1 . . . . . 96 GLN HG3 . 50453 1 1064 . 1 . 1 96 96 GLN CA C 13 55.846 0.3 . 1 . . . . . 96 GLN CA . 50453 1 1065 . 1 . 1 96 96 GLN CB C 13 29.617 0.3 . 1 . . . . . 96 GLN CB . 50453 1 1066 . 1 . 1 96 96 GLN CG C 13 33.835 0.3 . 1 . . . . . 96 GLN CG . 50453 1 1067 . 1 . 1 100 100 ASN HA H 1 4.960 0.020 . 1 . . . . . 100 ASN HA . 50453 1 1068 . 1 . 1 100 100 ASN HB2 H 1 3.070 0.020 . 1 . . . . . 100 ASN HB2 . 50453 1 1069 . 1 . 1 100 100 ASN HB3 H 1 3.070 0.020 . 1 . . . . . 100 ASN HB3 . 50453 1 1070 . 1 . 1 100 100 ASN CA C 13 57.255 0.3 . 1 . . . . . 100 ASN CA . 50453 1 1071 . 1 . 1 100 100 ASN CB C 13 40.154 0.3 . 1 . . . . . 100 ASN CB . 50453 1 1072 . 1 . 1 102 102 VAL HA H 1 4.249 0.020 . 1 . . . . . 102 VAL HA . 50453 1 1073 . 1 . 1 102 102 VAL HB H 1 2.224 0.020 . 1 . . . . . 102 VAL HB . 50453 1 1074 . 1 . 1 102 102 VAL HG11 H 1 1.065 0.020 . 2 . . . . . 102 VAL HG1 . 50453 1 1075 . 1 . 1 102 102 VAL HG12 H 1 1.065 0.020 . 2 . . . . . 102 VAL HG1 . 50453 1 1076 . 1 . 1 102 102 VAL HG13 H 1 1.065 0.020 . 2 . . . . . 102 VAL HG1 . 50453 1 1077 . 1 . 1 102 102 VAL HG21 H 1 1.057 0.020 . 2 . . . . . 102 VAL HG2 . 50453 1 1078 . 1 . 1 102 102 VAL HG22 H 1 1.057 0.020 . 2 . . . . . 102 VAL HG2 . 50453 1 1079 . 1 . 1 102 102 VAL HG23 H 1 1.057 0.020 . 2 . . . . . 102 VAL HG2 . 50453 1 1080 . 1 . 1 102 102 VAL CA C 13 63.153 0.3 . 1 . . . . . 102 VAL CA . 50453 1 1081 . 1 . 1 102 102 VAL CB C 13 33.113 0.3 . 1 . . . . . 102 VAL CB . 50453 1 1082 . 1 . 1 102 102 VAL CG1 C 13 20.610 0.3 . 1 . . . . . 102 VAL CG1 . 50453 1 1083 . 1 . 1 102 102 VAL CG2 C 13 21.247 0.3 . 1 . . . . . 102 VAL CG2 . 50453 1 1084 . 1 . 1 103 103 ASP HA H 1 4.826 0.020 . 1 . . . . . 103 ASP HA . 50453 1 1085 . 1 . 1 103 103 ASP HB2 H 1 2.827 0.020 . 2 . . . . . 103 ASP HB2 . 50453 1 1086 . 1 . 1 103 103 ASP HB3 H 1 2.904 0.020 . 2 . . . . . 103 ASP HB3 . 50453 1 1087 . 1 . 1 103 103 ASP CA C 13 54.519 0.3 . 1 . . . . . 103 ASP CA . 50453 1 1088 . 1 . 1 103 103 ASP CB C 13 41.680 0.3 . 1 . . . . . 103 ASP CB . 50453 1 1089 . 1 . 1 106 106 SER HA H 1 4.604 0.020 . 1 . . . . . 106 SER HA . 50453 1 1090 . 1 . 1 106 106 SER HB2 H 1 4.040 0.020 . 1 . . . . . 106 SER HB2 . 50453 1 1091 . 1 . 1 106 106 SER HB3 H 1 4.040 0.020 . 1 . . . . . 106 SER HB3 . 50453 1 1092 . 1 . 1 106 106 SER C C 13 173.896 0.3 . 1 . . . . . 106 SER C . 50453 1 1093 . 1 . 1 106 106 SER CA C 13 59.098 0.3 . 1 . . . . . 106 SER CA . 50453 1 1094 . 1 . 1 106 106 SER CB C 13 64.249 0.3 . 1 . . . . . 106 SER CB . 50453 1 1095 . 1 . 1 107 107 ILE H H 1 8.026 0.020 . 1 . . . . . 107 ILE H . 50453 1 1096 . 1 . 1 107 107 ILE HA H 1 4.633 0.020 . 1 . . . . . 107 ILE HA . 50453 1 1097 . 1 . 1 107 107 ILE HB H 1 1.953 0.020 . 1 . . . . . 107 ILE HB . 50453 1 1098 . 1 . 1 107 107 ILE HG12 H 1 1.274 0.020 . 2 . . . . . 107 ILE HG12 . 50453 1 1099 . 1 . 1 107 107 ILE HG13 H 1 1.552 0.020 . 2 . . . . . 107 ILE HG13 . 50453 1 1100 . 1 . 1 107 107 ILE HG21 H 1 0.979 0.020 . 1 . . . . . 107 ILE HG2 . 50453 1 1101 . 1 . 1 107 107 ILE HG22 H 1 0.979 0.020 . 1 . . . . . 107 ILE HG2 . 50453 1 1102 . 1 . 1 107 107 ILE HG23 H 1 0.979 0.020 . 1 . . . . . 107 ILE HG2 . 50453 1 1103 . 1 . 1 107 107 ILE HD11 H 1 0.948 0.020 . 1 . . . . . 107 ILE HD1 . 50453 1 1104 . 1 . 1 107 107 ILE HD12 H 1 0.948 0.020 . 1 . . . . . 107 ILE HD1 . 50453 1 1105 . 1 . 1 107 107 ILE HD13 H 1 0.948 0.020 . 1 . . . . . 107 ILE HD1 . 50453 1 1106 . 1 . 1 107 107 ILE C C 13 175.371 0.3 . 1 . . . . . 107 ILE C . 50453 1 1107 . 1 . 1 107 107 ILE CA C 13 60.543 0.3 . 1 . . . . . 107 ILE CA . 50453 1 1108 . 1 . 1 107 107 ILE CB C 13 39.874 0.3 . 1 . . . . . 107 ILE CB . 50453 1 1109 . 1 . 1 107 107 ILE CG1 C 13 27.326 0.3 . 1 . . . . . 107 ILE CG1 . 50453 1 1110 . 1 . 1 107 107 ILE CG2 C 13 17.824 0.3 . 1 . . . . . 107 ILE CG2 . 50453 1 1111 . 1 . 1 107 107 ILE CD1 C 13 13.105 0.3 . 1 . . . . . 107 ILE CD1 . 50453 1 1112 . 1 . 1 107 107 ILE N N 15 123.377 0.3 . 1 . . . . . 107 ILE N . 50453 1 1113 . 1 . 1 108 108 PHE H H 1 8.986 0.020 . 1 . . . . . 108 PHE H . 50453 1 1114 . 1 . 1 108 108 PHE HA H 1 5.020 0.020 . 1 . . . . . 108 PHE HA . 50453 1 1115 . 1 . 1 108 108 PHE HB2 H 1 2.995 0.020 . 2 . . . . . 108 PHE HB2 . 50453 1 1116 . 1 . 1 108 108 PHE HB3 H 1 3.224 0.020 . 2 . . . . . 108 PHE HB3 . 50453 1 1117 . 1 . 1 108 108 PHE C C 13 175.070 0.3 . 1 . . . . . 108 PHE C . 50453 1 1118 . 1 . 1 108 108 PHE CA C 13 57.091 0.3 . 1 . . . . . 108 PHE CA . 50453 1 1119 . 1 . 1 108 108 PHE CB C 13 41.374 0.3 . 1 . . . . . 108 PHE CB . 50453 1 1120 . 1 . 1 108 108 PHE N N 15 127.061 0.3 . 1 . . . . . 108 PHE N . 50453 1 1121 . 1 . 1 109 109 ASN HA H 1 5.114 0.020 . 1 . . . . . 109 ASN HA . 50453 1 1122 . 1 . 1 109 109 ASN HB2 H 1 2.886 0.020 . 2 . . . . . 109 ASN HB2 . 50453 1 1123 . 1 . 1 109 109 ASN HB3 H 1 2.961 0.020 . 2 . . . . . 109 ASN HB3 . 50453 1 1124 . 1 . 1 109 109 ASN C C 13 175.571 0.3 . 1 . . . . . 109 ASN C . 50453 1 1125 . 1 . 1 109 109 ASN CA C 13 52.912 0.3 . 1 . . . . . 109 ASN CA . 50453 1 1126 . 1 . 1 109 109 ASN CB C 13 39.189 0.3 . 1 . . . . . 109 ASN CB . 50453 1 1127 . 1 . 1 110 110 GLY H H 1 6.290 0.020 . 1 . . . . . 110 GLY H . 50453 1 1128 . 1 . 1 110 110 GLY HA2 H 1 3.562 0.020 . 2 . . . . . 110 GLY HA2 . 50453 1 1129 . 1 . 1 110 110 GLY HA3 H 1 3.721 0.020 . 2 . . . . . 110 GLY HA3 . 50453 1 1130 . 1 . 1 110 110 GLY C C 13 173.414 0.3 . 1 . . . . . 110 GLY C . 50453 1 1131 . 1 . 1 110 110 GLY CA C 13 47.016 0.3 . 1 . . . . . 110 GLY CA . 50453 1 1132 . 1 . 1 110 110 GLY N N 15 106.843 0.3 . 1 . . . . . 110 GLY N . 50453 1 1133 . 1 . 1 111 111 ILE H H 1 7.692 0.020 . 1 . . . . . 111 ILE H . 50453 1 1134 . 1 . 1 111 111 ILE HA H 1 4.238 0.020 . 1 . . . . . 111 ILE HA . 50453 1 1135 . 1 . 1 111 111 ILE HB H 1 1.782 0.020 . 1 . . . . . 111 ILE HB . 50453 1 1136 . 1 . 1 111 111 ILE HG12 H 1 1.119 0.020 . 2 . . . . . 111 ILE HG12 . 50453 1 1137 . 1 . 1 111 111 ILE HG13 H 1 1.548 0.020 . 2 . . . . . 111 ILE HG13 . 50453 1 1138 . 1 . 1 111 111 ILE HG21 H 1 0.830 0.020 . 1 . . . . . 111 ILE HG2 . 50453 1 1139 . 1 . 1 111 111 ILE HG22 H 1 0.830 0.020 . 1 . . . . . 111 ILE HG2 . 50453 1 1140 . 1 . 1 111 111 ILE HG23 H 1 0.830 0.020 . 1 . . . . . 111 ILE HG2 . 50453 1 1141 . 1 . 1 111 111 ILE HD11 H 1 0.893 0.020 . 1 . . . . . 111 ILE HD1 . 50453 1 1142 . 1 . 1 111 111 ILE HD12 H 1 0.893 0.020 . 1 . . . . . 111 ILE HD1 . 50453 1 1143 . 1 . 1 111 111 ILE HD13 H 1 0.893 0.020 . 1 . . . . . 111 ILE HD1 . 50453 1 1144 . 1 . 1 111 111 ILE C C 13 174.902 0.3 . 1 . . . . . 111 ILE C . 50453 1 1145 . 1 . 1 111 111 ILE CA C 13 60.848 0.3 . 1 . . . . . 111 ILE CA . 50453 1 1146 . 1 . 1 111 111 ILE CB C 13 37.910 0.3 . 1 . . . . . 111 ILE CB . 50453 1 1147 . 1 . 1 111 111 ILE CG1 C 13 27.537 0.3 . 1 . . . . . 111 ILE CG1 . 50453 1 1148 . 1 . 1 111 111 ILE CG2 C 13 16.990 0.3 . 1 . . . . . 111 ILE CG2 . 50453 1 1149 . 1 . 1 111 111 ILE CD1 C 13 13.342 0.3 . 1 . . . . . 111 ILE CD1 . 50453 1 1150 . 1 . 1 111 111 ILE N N 15 121.756 0.3 . 1 . . . . . 111 ILE N . 50453 1 1151 . 1 . 1 112 112 GLU H H 1 8.678 0.020 . 1 . . . . . 112 GLU H . 50453 1 1152 . 1 . 1 112 112 GLU HA H 1 4.102 0.020 . 1 . . . . . 112 GLU HA . 50453 1 1153 . 1 . 1 112 112 GLU HB2 H 1 2.131 0.020 . 2 . . . . . 112 GLU HB2 . 50453 1 1154 . 1 . 1 112 112 GLU HB3 H 1 2.259 0.020 . 2 . . . . . 112 GLU HB3 . 50453 1 1155 . 1 . 1 112 112 GLU HG2 H 1 2.346 0.020 . 2 . . . . . 112 GLU HG2 . 50453 1 1156 . 1 . 1 112 112 GLU HG3 H 1 2.416 0.020 . 2 . . . . . 112 GLU HG3 . 50453 1 1157 . 1 . 1 112 112 GLU C C 13 175.672 0.3 . 1 . . . . . 112 GLU C . 50453 1 1158 . 1 . 1 112 112 GLU CA C 13 59.115 0.3 . 1 . . . . . 112 GLU CA . 50453 1 1159 . 1 . 1 112 112 GLU CB C 13 29.705 0.3 . 1 . . . . . 112 GLU CB . 50453 1 1160 . 1 . 1 112 112 GLU CG C 13 36.120 0.3 . 1 . . . . . 112 GLU CG . 50453 1 1161 . 1 . 1 112 112 GLU N N 15 130.257 0.3 . 1 . . . . . 112 GLU N . 50453 1 1162 . 1 . 1 113 113 GLY H H 1 8.792 0.020 . 1 . . . . . 113 GLY H . 50453 1 1163 . 1 . 1 113 113 GLY HA2 H 1 3.750 0.020 . 2 . . . . . 113 GLY HA2 . 50453 1 1164 . 1 . 1 113 113 GLY HA3 H 1 5.334 0.020 . 2 . . . . . 113 GLY HA3 . 50453 1 1165 . 1 . 1 113 113 GLY C C 13 174.167 0.3 . 1 . . . . . 113 GLY C . 50453 1 1166 . 1 . 1 113 113 GLY CA C 13 45.086 0.3 . 1 . . . . . 113 GLY CA . 50453 1 1167 . 1 . 1 113 113 GLY N N 15 115.779 0.3 . 1 . . . . . 113 GLY N . 50453 1 1168 . 1 . 1 114 114 ALA H H 1 8.457 0.020 . 1 . . . . . 114 ALA H . 50453 1 1169 . 1 . 1 114 114 ALA HA H 1 5.466 0.020 . 1 . . . . . 114 ALA HA . 50453 1 1170 . 1 . 1 114 114 ALA HB1 H 1 1.340 0.020 . 1 . . . . . 114 ALA HB . 50453 1 1171 . 1 . 1 114 114 ALA HB2 H 1 1.340 0.020 . 1 . . . . . 114 ALA HB . 50453 1 1172 . 1 . 1 114 114 ALA HB3 H 1 1.340 0.020 . 1 . . . . . 114 ALA HB . 50453 1 1173 . 1 . 1 114 114 ALA C C 13 176.207 0.3 . 1 . . . . . 114 ALA C . 50453 1 1174 . 1 . 1 114 114 ALA CA C 13 49.791 0.3 . 1 . . . . . 114 ALA CA . 50453 1 1175 . 1 . 1 114 114 ALA CB C 13 21.399 0.3 . 1 . . . . . 114 ALA CB . 50453 1 1176 . 1 . 1 114 114 ALA N N 15 124.988 0.3 . 1 . . . . . 114 ALA N . 50453 1 1177 . 1 . 1 115 115 GLU H H 1 8.341 0.020 . 1 . . . . . 115 GLU H . 50453 1 1178 . 1 . 1 115 115 GLU HA H 1 4.824 0.020 . 1 . . . . . 115 GLU HA . 50453 1 1179 . 1 . 1 115 115 GLU HB2 H 1 2.032 0.020 . 2 . . . . . 115 GLU HB2 . 50453 1 1180 . 1 . 1 115 115 GLU HB3 H 1 2.143 0.020 . 2 . . . . . 115 GLU HB3 . 50453 1 1181 . 1 . 1 115 115 GLU HG2 H 1 2.273 0.020 . 2 . . . . . 115 GLU HG2 . 50453 1 1182 . 1 . 1 115 115 GLU HG3 H 1 2.393 0.020 . 2 . . . . . 115 GLU HG3 . 50453 1 1183 . 1 . 1 115 115 GLU C C 13 176.123 0.3 . 1 . . . . . 115 GLU C . 50453 1 1184 . 1 . 1 115 115 GLU CA C 13 55.678 0.3 . 1 . . . . . 115 GLU CA . 50453 1 1185 . 1 . 1 115 115 GLU CB C 13 32.038 0.3 . 1 . . . . . 115 GLU CB . 50453 1 1186 . 1 . 1 115 115 GLU CG C 13 36.679 0.3 . 1 . . . . . 115 GLU CG . 50453 1 1187 . 1 . 1 115 115 GLU N N 15 124.787 0.3 . 1 . . . . . 115 GLU N . 50453 1 1188 . 1 . 1 116 116 MET H H 1 8.864 0.020 . 1 . . . . . 116 MET H . 50453 1 1189 . 1 . 1 116 116 MET HA H 1 5.771 0.020 . 1 . . . . . 116 MET HA . 50453 1 1190 . 1 . 1 116 116 MET HB2 H 1 2.099 0.020 . 1 . . . . . 116 MET HB2 . 50453 1 1191 . 1 . 1 116 116 MET HB3 H 1 2.099 0.020 . 1 . . . . . 116 MET HB3 . 50453 1 1192 . 1 . 1 116 116 MET HG2 H 1 2.510 0.020 . 2 . . . . . 116 MET HG2 . 50453 1 1193 . 1 . 1 116 116 MET HG3 H 1 2.537 0.020 . 2 . . . . . 116 MET HG3 . 50453 1 1194 . 1 . 1 116 116 MET C C 13 174.602 0.3 . 1 . . . . . 116 MET C . 50453 1 1195 . 1 . 1 116 116 MET CA C 13 54.842 0.3 . 1 . . . . . 116 MET CA . 50453 1 1196 . 1 . 1 116 116 MET CB C 13 37.237 0.3 . 1 . . . . . 116 MET CB . 50453 1 1197 . 1 . 1 116 116 MET CG C 13 33.043 0.3 . 1 . . . . . 116 MET CG . 50453 1 1198 . 1 . 1 116 116 MET N N 15 126.004 0.3 . 1 . . . . . 116 MET N . 50453 1 1199 . 1 . 1 117 117 SER H H 1 9.200 0.020 . 1 . . . . . 117 SER H . 50453 1 1200 . 1 . 1 117 117 SER HA H 1 4.998 0.020 . 1 . . . . . 117 SER HA . 50453 1 1201 . 1 . 1 117 117 SER HB2 H 1 4.032 0.020 . 1 . . . . . 117 SER HB2 . 50453 1 1202 . 1 . 1 117 117 SER HB3 H 1 4.032 0.020 . 1 . . . . . 117 SER HB3 . 50453 1 1203 . 1 . 1 117 117 SER C C 13 173.097 0.3 . 1 . . . . . 117 SER C . 50453 1 1204 . 1 . 1 117 117 SER CA C 13 57.509 0.3 . 1 . . . . . 117 SER CA . 50453 1 1205 . 1 . 1 117 117 SER CB C 13 66.433 0.3 . 1 . . . . . 117 SER CB . 50453 1 1206 . 1 . 1 117 117 SER N N 15 116.487 0.3 . 1 . . . . . 117 SER N . 50453 1 1207 . 1 . 1 118 118 ASN HA H 1 5.130 0.020 . 1 . . . . . 118 ASN HA . 50453 1 1208 . 1 . 1 118 118 ASN HB2 H 1 2.944 0.020 . 2 . . . . . 118 ASN HB2 . 50453 1 1209 . 1 . 1 118 118 ASN HB3 H 1 3.199 0.020 . 2 . . . . . 118 ASN HB3 . 50453 1 1210 . 1 . 1 118 118 ASN C C 13 176.424 0.3 . 1 . . . . . 118 ASN C . 50453 1 1211 . 1 . 1 118 118 ASN CA C 13 54.610 0.3 . 1 . . . . . 118 ASN CA . 50453 1 1212 . 1 . 1 118 118 ASN CB C 13 38.226 0.3 . 1 . . . . . 118 ASN CB . 50453 1 1213 . 1 . 1 119 119 LYS H H 1 8.970 0.020 . 1 . . . . . 119 LYS H . 50453 1 1214 . 1 . 1 119 119 LYS HA H 1 4.310 0.020 . 1 . . . . . 119 LYS HA . 50453 1 1215 . 1 . 1 119 119 LYS HB2 H 1 1.475 0.020 . 2 . . . . . 119 LYS HB2 . 50453 1 1216 . 1 . 1 119 119 LYS HB3 H 1 1.647 0.020 . 2 . . . . . 119 LYS HB3 . 50453 1 1217 . 1 . 1 119 119 LYS HG2 H 1 1.455 0.020 . 1 . . . . . 119 LYS HG2 . 50453 1 1218 . 1 . 1 119 119 LYS HG3 H 1 1.455 0.020 . 1 . . . . . 119 LYS HG3 . 50453 1 1219 . 1 . 1 119 119 LYS HD2 H 1 1.819 0.020 . 2 . . . . . 119 LYS HD2 . 50453 1 1220 . 1 . 1 119 119 LYS HD3 H 1 1.874 0.020 . 2 . . . . . 119 LYS HD3 . 50453 1 1221 . 1 . 1 119 119 LYS HE2 H 1 3.100 0.020 . 2 . . . . . 119 LYS HE2 . 50453 1 1222 . 1 . 1 119 119 LYS HE3 H 1 3.145 0.020 . 2 . . . . . 119 LYS HE3 . 50453 1 1223 . 1 . 1 119 119 LYS C C 13 176.574 0.3 . 1 . . . . . 119 LYS C . 50453 1 1224 . 1 . 1 119 119 LYS CA C 13 57.386 0.3 . 1 . . . . . 119 LYS CA . 50453 1 1225 . 1 . 1 119 119 LYS CB C 13 33.186 0.3 . 1 . . . . . 119 LYS CB . 50453 1 1226 . 1 . 1 119 119 LYS CG C 13 25.439 0.3 . 1 . . . . . 119 LYS CG . 50453 1 1227 . 1 . 1 119 119 LYS CD C 13 29.394 0.3 . 1 . . . . . 119 LYS CD . 50453 1 1228 . 1 . 1 119 119 LYS CE C 13 42.342 0.3 . 1 . . . . . 119 LYS CE . 50453 1 1229 . 1 . 1 119 119 LYS N N 15 128.221 0.3 . 1 . . . . . 119 LYS N . 50453 1 1230 . 1 . 1 120 120 GLY H H 1 9.043 0.020 . 1 . . . . . 120 GLY H . 50453 1 1231 . 1 . 1 120 120 GLY HA2 H 1 3.851 0.020 . 2 . . . . . 120 GLY HA2 . 50453 1 1232 . 1 . 1 120 120 GLY HA3 H 1 4.270 0.020 . 2 . . . . . 120 GLY HA3 . 50453 1 1233 . 1 . 1 120 120 GLY CA C 13 45.207 0.3 . 1 . . . . . 120 GLY CA . 50453 1 1234 . 1 . 1 120 120 GLY N N 15 113.308 0.3 . 1 . . . . . 120 GLY N . 50453 1 1235 . 1 . 1 121 121 LYS HA H 1 4.392 0.020 . 1 . . . . . 121 LYS HA . 50453 1 1236 . 1 . 1 121 121 LYS HB2 H 1 1.883 0.020 . 2 . . . . . 121 LYS HB2 . 50453 1 1237 . 1 . 1 121 121 LYS HB3 H 1 2.062 0.020 . 2 . . . . . 121 LYS HB3 . 50453 1 1238 . 1 . 1 121 121 LYS HG2 H 1 1.508 0.020 . 2 . . . . . 121 LYS HG2 . 50453 1 1239 . 1 . 1 121 121 LYS HG3 H 1 1.838 0.020 . 2 . . . . . 121 LYS HG3 . 50453 1 1240 . 1 . 1 121 121 LYS HD2 H 1 1.822 0.020 . 2 . . . . . 121 LYS HD2 . 50453 1 1241 . 1 . 1 121 121 LYS HD3 H 1 1.850 0.020 . 2 . . . . . 121 LYS HD3 . 50453 1 1242 . 1 . 1 121 121 LYS HE2 H 1 3.148 0.020 . 1 . . . . . 121 LYS HE2 . 50453 1 1243 . 1 . 1 121 121 LYS HE3 H 1 3.148 0.020 . 1 . . . . . 121 LYS HE3 . 50453 1 1244 . 1 . 1 121 121 LYS C C 13 175.028 0.3 . 1 . . . . . 121 LYS C . 50453 1 1245 . 1 . 1 121 121 LYS CA C 13 56.085 0.3 . 1 . . . . . 121 LYS CA . 50453 1 1246 . 1 . 1 121 121 LYS CB C 13 30.748 0.3 . 1 . . . . . 121 LYS CB . 50453 1 1247 . 1 . 1 121 121 LYS CG C 13 25.139 0.3 . 1 . . . . . 121 LYS CG . 50453 1 1248 . 1 . 1 121 121 LYS CD C 13 29.626 0.3 . 1 . . . . . 121 LYS CD . 50453 1 1249 . 1 . 1 121 121 LYS CE C 13 42.389 0.3 . 1 . . . . . 121 LYS CE . 50453 1 1250 . 1 . 1 122 122 ASP H H 1 8.768 0.020 . 1 . . . . . 122 ASP H . 50453 1 1251 . 1 . 1 122 122 ASP HA H 1 4.886 0.020 . 1 . . . . . 122 ASP HA . 50453 1 1252 . 1 . 1 122 122 ASP HB2 H 1 3.074 0.020 . 1 . . . . . 122 ASP HB2 . 50453 1 1253 . 1 . 1 122 122 ASP HB3 H 1 3.074 0.020 . 1 . . . . . 122 ASP HB3 . 50453 1 1254 . 1 . 1 122 122 ASP C C 13 176.240 0.3 . 1 . . . . . 122 ASP C . 50453 1 1255 . 1 . 1 122 122 ASP CA C 13 55.666 0.3 . 1 . . . . . 122 ASP CA . 50453 1 1256 . 1 . 1 122 122 ASP CB C 13 39.176 0.3 . 1 . . . . . 122 ASP CB . 50453 1 1257 . 1 . 1 122 122 ASP N N 15 121.029 0.3 . 1 . . . . . 122 ASP N . 50453 1 1258 . 1 . 1 123 123 GLN H H 1 7.729 0.020 . 1 . . . . . 123 GLN H . 50453 1 1259 . 1 . 1 123 123 GLN HA H 1 4.672 0.020 . 1 . . . . . 123 GLN HA . 50453 1 1260 . 1 . 1 123 123 GLN HB2 H 1 2.544 0.020 . 1 . . . . . 123 GLN HB2 . 50453 1 1261 . 1 . 1 123 123 GLN HB3 H 1 2.544 0.020 . 1 . . . . . 123 GLN HB3 . 50453 1 1262 . 1 . 1 123 123 GLN HG2 H 1 2.459 0.020 . 1 . . . . . 123 GLN HG2 . 50453 1 1263 . 1 . 1 123 123 GLN HG3 H 1 2.459 0.020 . 1 . . . . . 123 GLN HG3 . 50453 1 1264 . 1 . 1 123 123 GLN C C 13 174.904 0.3 . 1 . . . . . 123 GLN C . 50453 1 1265 . 1 . 1 123 123 GLN CA C 13 55.550 0.3 . 1 . . . . . 123 GLN CA . 50453 1 1266 . 1 . 1 123 123 GLN CB C 13 29.973 0.3 . 1 . . . . . 123 GLN CB . 50453 1 1267 . 1 . 1 123 123 GLN CG C 13 34.704 0.3 . 1 . . . . . 123 GLN CG . 50453 1 1268 . 1 . 1 123 123 GLN N N 15 116.470 0.3 . 1 . . . . . 123 GLN N . 50453 1 1269 . 1 . 1 124 124 GLY H H 1 8.283 0.020 . 1 . . . . . 124 GLY H . 50453 1 1270 . 1 . 1 124 124 GLY HA2 H 1 3.893 0.020 . 2 . . . . . 124 GLY HA2 . 50453 1 1271 . 1 . 1 124 124 GLY HA3 H 1 4.747 0.020 . 2 . . . . . 124 GLY HA3 . 50453 1 1272 . 1 . 1 124 124 GLY C C 13 173.130 0.3 . 1 . . . . . 124 GLY C . 50453 1 1273 . 1 . 1 124 124 GLY CA C 13 43.483 0.3 . 1 . . . . . 124 GLY CA . 50453 1 1274 . 1 . 1 124 124 GLY N N 15 108.643 0.3 . 1 . . . . . 124 GLY N . 50453 1 1275 . 1 . 1 125 125 VAL H H 1 8.430 0.020 . 1 . . . . . 125 VAL H . 50453 1 1276 . 1 . 1 125 125 VAL HA H 1 4.635 0.020 . 1 . . . . . 125 VAL HA . 50453 1 1277 . 1 . 1 125 125 VAL HB H 1 2.008 0.020 . 1 . . . . . 125 VAL HB . 50453 1 1278 . 1 . 1 125 125 VAL HG11 H 1 0.720 0.020 . 2 . . . . . 125 VAL HG1 . 50453 1 1279 . 1 . 1 125 125 VAL HG12 H 1 0.720 0.020 . 2 . . . . . 125 VAL HG1 . 50453 1 1280 . 1 . 1 125 125 VAL HG13 H 1 0.720 0.020 . 2 . . . . . 125 VAL HG1 . 50453 1 1281 . 1 . 1 125 125 VAL HG21 H 1 0.973 0.020 . 2 . . . . . 125 VAL HG2 . 50453 1 1282 . 1 . 1 125 125 VAL HG22 H 1 0.973 0.020 . 2 . . . . . 125 VAL HG2 . 50453 1 1283 . 1 . 1 125 125 VAL HG23 H 1 0.973 0.020 . 2 . . . . . 125 VAL HG2 . 50453 1 1284 . 1 . 1 125 125 VAL C C 13 174.351 0.3 . 1 . . . . . 125 VAL C . 50453 1 1285 . 1 . 1 125 125 VAL CA C 13 61.592 0.3 . 1 . . . . . 125 VAL CA . 50453 1 1286 . 1 . 1 125 125 VAL CB C 13 35.149 0.3 . 1 . . . . . 125 VAL CB . 50453 1 1287 . 1 . 1 125 125 VAL CG1 C 13 21.281 0.3 . 1 . . . . . 125 VAL CG1 . 50453 1 1288 . 1 . 1 125 125 VAL CG2 C 13 22.936 0.3 . 1 . . . . . 125 VAL CG2 . 50453 1 1289 . 1 . 1 125 125 VAL N N 15 122.785 0.3 . 1 . . . . . 125 VAL N . 50453 1 1290 . 1 . 1 126 126 VAL H H 1 9.521 0.020 . 1 . . . . . 126 VAL H . 50453 1 1291 . 1 . 1 126 126 VAL HA H 1 5.132 0.020 . 1 . . . . . 126 VAL HA . 50453 1 1292 . 1 . 1 126 126 VAL HB H 1 1.947 0.020 . 1 . . . . . 126 VAL HB . 50453 1 1293 . 1 . 1 126 126 VAL HG11 H 1 1.036 0.020 . 2 . . . . . 126 VAL HG1 . 50453 1 1294 . 1 . 1 126 126 VAL HG12 H 1 1.036 0.020 . 2 . . . . . 126 VAL HG1 . 50453 1 1295 . 1 . 1 126 126 VAL HG13 H 1 1.036 0.020 . 2 . . . . . 126 VAL HG1 . 50453 1 1296 . 1 . 1 126 126 VAL HG21 H 1 0.980 0.020 . 2 . . . . . 126 VAL HG2 . 50453 1 1297 . 1 . 1 126 126 VAL HG22 H 1 0.980 0.020 . 2 . . . . . 126 VAL HG2 . 50453 1 1298 . 1 . 1 126 126 VAL HG23 H 1 0.980 0.020 . 2 . . . . . 126 VAL HG2 . 50453 1 1299 . 1 . 1 126 126 VAL C C 13 173.732 0.3 . 1 . . . . . 126 VAL C . 50453 1 1300 . 1 . 1 126 126 VAL CA C 13 60.018 0.3 . 1 . . . . . 126 VAL CA . 50453 1 1301 . 1 . 1 126 126 VAL CB C 13 34.843 0.3 . 1 . . . . . 126 VAL CB . 50453 1 1302 . 1 . 1 126 126 VAL CG1 C 13 21.951 0.3 . 1 . . . . . 126 VAL CG1 . 50453 1 1303 . 1 . 1 126 126 VAL CG2 C 13 19.590 0.3 . 1 . . . . . 126 VAL CG2 . 50453 1 1304 . 1 . 1 126 126 VAL N N 15 129.951 0.3 . 1 . . . . . 126 VAL N . 50453 1 1305 . 1 . 1 127 127 VAL H H 1 9.025 0.020 . 1 . . . . . 127 VAL H . 50453 1 1306 . 1 . 1 127 127 VAL HA H 1 4.278 0.020 . 1 . . . . . 127 VAL HA . 50453 1 1307 . 1 . 1 127 127 VAL HB H 1 2.499 0.020 . 1 . . . . . 127 VAL HB . 50453 1 1308 . 1 . 1 127 127 VAL HG11 H 1 0.787 0.020 . 2 . . . . . 127 VAL HG1 . 50453 1 1309 . 1 . 1 127 127 VAL HG12 H 1 0.787 0.020 . 2 . . . . . 127 VAL HG1 . 50453 1 1310 . 1 . 1 127 127 VAL HG13 H 1 0.787 0.020 . 2 . . . . . 127 VAL HG1 . 50453 1 1311 . 1 . 1 127 127 VAL HG21 H 1 1.060 0.020 . 2 . . . . . 127 VAL HG2 . 50453 1 1312 . 1 . 1 127 127 VAL HG22 H 1 1.060 0.020 . 2 . . . . . 127 VAL HG2 . 50453 1 1313 . 1 . 1 127 127 VAL HG23 H 1 1.060 0.020 . 2 . . . . . 127 VAL HG2 . 50453 1 1314 . 1 . 1 127 127 VAL C C 13 175.705 0.3 . 1 . . . . . 127 VAL C . 50453 1 1315 . 1 . 1 127 127 VAL CA C 13 62.429 0.3 . 1 . . . . . 127 VAL CA . 50453 1 1316 . 1 . 1 127 127 VAL CB C 13 31.155 0.3 . 1 . . . . . 127 VAL CB . 50453 1 1317 . 1 . 1 127 127 VAL CG1 C 13 23.615 0.3 . 1 . . . . . 127 VAL CG1 . 50453 1 1318 . 1 . 1 127 127 VAL CG2 C 13 21.667 0.3 . 1 . . . . . 127 VAL CG2 . 50453 1 1319 . 1 . 1 127 127 VAL N N 15 128.743 0.3 . 1 . . . . . 127 VAL N . 50453 1 1320 . 1 . 1 128 128 ASN H H 1 9.471 0.020 . 1 . . . . . 128 ASN H . 50453 1 1321 . 1 . 1 128 128 ASN HA H 1 4.866 0.020 . 1 . . . . . 128 ASN HA . 50453 1 1322 . 1 . 1 128 128 ASN HB2 H 1 2.585 0.020 . 2 . . . . . 128 ASN HB2 . 50453 1 1323 . 1 . 1 128 128 ASN HB3 H 1 2.954 0.020 . 2 . . . . . 128 ASN HB3 . 50453 1 1324 . 1 . 1 128 128 ASN C C 13 175.220 0.3 . 1 . . . . . 128 ASN C . 50453 1 1325 . 1 . 1 128 128 ASN CA C 13 55.181 0.3 . 1 . . . . . 128 ASN CA . 50453 1 1326 . 1 . 1 128 128 ASN CB C 13 40.164 0.3 . 1 . . . . . 128 ASN CB . 50453 1 1327 . 1 . 1 128 128 ASN N N 15 130.662 0.3 . 1 . . . . . 128 ASN N . 50453 1 1328 . 1 . 1 129 129 ASN H H 1 7.827 0.020 . 1 . . . . . 129 ASN H . 50453 1 1329 . 1 . 1 129 129 ASN HA H 1 4.788 0.020 . 1 . . . . . 129 ASN HA . 50453 1 1330 . 1 . 1 129 129 ASN HB2 H 1 2.728 0.020 . 2 . . . . . 129 ASN HB2 . 50453 1 1331 . 1 . 1 129 129 ASN HB3 H 1 2.908 0.020 . 2 . . . . . 129 ASN HB3 . 50453 1 1332 . 1 . 1 129 129 ASN C C 13 172.930 0.3 . 1 . . . . . 129 ASN C . 50453 1 1333 . 1 . 1 129 129 ASN CA C 13 53.769 0.3 . 1 . . . . . 129 ASN CA . 50453 1 1334 . 1 . 1 129 129 ASN CB C 13 42.198 0.3 . 1 . . . . . 129 ASN CB . 50453 1 1335 . 1 . 1 129 129 ASN N N 15 115.563 0.3 . 1 . . . . . 129 ASN N . 50453 1 1336 . 1 . 1 130 130 VAL H H 1 8.396 0.020 . 1 . . . . . 130 VAL H . 50453 1 1337 . 1 . 1 130 130 VAL HA H 1 4.657 0.020 . 1 . . . . . 130 VAL HA . 50453 1 1338 . 1 . 1 130 130 VAL HB H 1 1.848 0.020 . 1 . . . . . 130 VAL HB . 50453 1 1339 . 1 . 1 130 130 VAL HG11 H 1 0.635 0.020 . 2 . . . . . 130 VAL HG1 . 50453 1 1340 . 1 . 1 130 130 VAL HG12 H 1 0.635 0.020 . 2 . . . . . 130 VAL HG1 . 50453 1 1341 . 1 . 1 130 130 VAL HG13 H 1 0.635 0.020 . 2 . . . . . 130 VAL HG1 . 50453 1 1342 . 1 . 1 130 130 VAL HG21 H 1 0.726 0.020 . 2 . . . . . 130 VAL HG2 . 50453 1 1343 . 1 . 1 130 130 VAL HG22 H 1 0.726 0.020 . 2 . . . . . 130 VAL HG2 . 50453 1 1344 . 1 . 1 130 130 VAL HG23 H 1 0.726 0.020 . 2 . . . . . 130 VAL HG2 . 50453 1 1345 . 1 . 1 130 130 VAL C C 13 175.086 0.3 . 1 . . . . . 130 VAL C . 50453 1 1346 . 1 . 1 130 130 VAL CA C 13 61.812 0.3 . 1 . . . . . 130 VAL CA . 50453 1 1347 . 1 . 1 130 130 VAL CB C 13 35.153 0.3 . 1 . . . . . 130 VAL CB . 50453 1 1348 . 1 . 1 130 130 VAL CG1 C 13 22.199 0.3 . 1 . . . . . 130 VAL CG1 . 50453 1 1349 . 1 . 1 130 130 VAL CG2 C 13 20.613 0.3 . 1 . . . . . 130 VAL CG2 . 50453 1 1350 . 1 . 1 130 130 VAL N N 15 124.640 0.3 . 1 . . . . . 130 VAL N . 50453 1 1351 . 1 . 1 131 131 LYS H H 1 8.935 0.020 . 1 . . . . . 131 LYS H . 50453 1 1352 . 1 . 1 131 131 LYS HA H 1 4.601 0.020 . 1 . . . . . 131 LYS HA . 50453 1 1353 . 1 . 1 131 131 LYS HB2 H 1 1.902 0.020 . 2 . . . . . 131 LYS HB2 . 50453 1 1354 . 1 . 1 131 131 LYS HB3 H 1 2.004 0.020 . 2 . . . . . 131 LYS HB3 . 50453 1 1355 . 1 . 1 131 131 LYS HG2 H 1 1.540 0.020 . 1 . . . . . 131 LYS HG2 . 50453 1 1356 . 1 . 1 131 131 LYS HG3 H 1 1.540 0.020 . 1 . . . . . 131 LYS HG3 . 50453 1 1357 . 1 . 1 131 131 LYS HD2 H 1 1.837 0.020 . 1 . . . . . 131 LYS HD2 . 50453 1 1358 . 1 . 1 131 131 LYS HD3 H 1 1.837 0.020 . 1 . . . . . 131 LYS HD3 . 50453 1 1359 . 1 . 1 131 131 LYS HE2 H 1 3.097 0.020 . 1 . . . . . 131 LYS HE2 . 50453 1 1360 . 1 . 1 131 131 LYS HE3 H 1 3.097 0.020 . 1 . . . . . 131 LYS HE3 . 50453 1 1361 . 1 . 1 131 131 LYS C C 13 176.541 0.3 . 1 . . . . . 131 LYS C . 50453 1 1362 . 1 . 1 131 131 LYS CA C 13 56.142 0.3 . 1 . . . . . 131 LYS CA . 50453 1 1363 . 1 . 1 131 131 LYS CB C 13 33.734 0.3 . 1 . . . . . 131 LYS CB . 50453 1 1364 . 1 . 1 131 131 LYS CG C 13 25.636 0.3 . 1 . . . . . 131 LYS CG . 50453 1 1365 . 1 . 1 131 131 LYS CD C 13 29.538 0.3 . 1 . . . . . 131 LYS CD . 50453 1 1366 . 1 . 1 131 131 LYS N N 15 131.858 0.3 . 1 . . . . . 131 LYS N . 50453 1 1367 . 1 . 1 132 132 THR HA H 1 4.042 0.020 . 1 . . . . . 132 THR HA . 50453 1 1368 . 1 . 1 132 132 THR HB H 1 4.272 0.020 . 1 . . . . . 132 THR HB . 50453 1 1369 . 1 . 1 132 132 THR HG21 H 1 1.423 0.020 . 1 . . . . . 132 THR HG2 . 50453 1 1370 . 1 . 1 132 132 THR HG22 H 1 1.423 0.020 . 1 . . . . . 132 THR HG2 . 50453 1 1371 . 1 . 1 132 132 THR HG23 H 1 1.423 0.020 . 1 . . . . . 132 THR HG2 . 50453 1 1372 . 1 . 1 132 132 THR CA C 13 63.927 0.3 . 1 . . . . . 132 THR CA . 50453 1 1373 . 1 . 1 132 132 THR CB C 13 69.224 0.3 . 1 . . . . . 132 THR CB . 50453 1 1374 . 1 . 1 132 132 THR CG2 C 13 21.839 0.3 . 1 . . . . . 132 THR CG2 . 50453 1 1375 . 1 . 1 133 133 GLY HA2 H 1 3.943 0.020 . 2 . . . . . 133 GLY HA2 . 50453 1 1376 . 1 . 1 133 133 GLY HA3 H 1 4.222 0.020 . 2 . . . . . 133 GLY HA3 . 50453 1 1377 . 1 . 1 133 133 GLY C C 13 174.299 0.3 . 1 . . . . . 133 GLY C . 50453 1 1378 . 1 . 1 133 133 GLY CA C 13 46.303 0.3 . 1 . . . . . 133 GLY CA . 50453 1 1379 . 1 . 1 134 134 THR H H 1 7.296 0.020 . 1 . . . . . 134 THR H . 50453 1 1380 . 1 . 1 134 134 THR HA H 1 4.984 0.020 . 1 . . . . . 134 THR HA . 50453 1 1381 . 1 . 1 134 134 THR HB H 1 4.603 0.020 . 1 . . . . . 134 THR HB . 50453 1 1382 . 1 . 1 134 134 THR HG21 H 1 1.364 0.020 . 1 . . . . . 134 THR HG2 . 50453 1 1383 . 1 . 1 134 134 THR HG22 H 1 1.364 0.020 . 1 . . . . . 134 THR HG2 . 50453 1 1384 . 1 . 1 134 134 THR HG23 H 1 1.364 0.020 . 1 . . . . . 134 THR HG2 . 50453 1 1385 . 1 . 1 134 134 THR C C 13 174.117 0.3 . 1 . . . . . 134 THR C . 50453 1 1386 . 1 . 1 134 134 THR CA C 13 59.977 0.3 . 1 . . . . . 134 THR CA . 50453 1 1387 . 1 . 1 134 134 THR CB C 13 69.928 0.3 . 1 . . . . . 134 THR CB . 50453 1 1388 . 1 . 1 134 134 THR CG2 C 13 21.860 0.3 . 1 . . . . . 134 THR CG2 . 50453 1 1389 . 1 . 1 134 134 THR N N 15 110.811 0.3 . 1 . . . . . 134 THR N . 50453 1 1390 . 1 . 1 135 135 PRO HA H 1 4.430 0.020 . 1 . . . . . 135 PRO HA . 50453 1 1391 . 1 . 1 135 135 PRO HB2 H 1 2.300 0.020 . 2 . . . . . 135 PRO HB2 . 50453 1 1392 . 1 . 1 135 135 PRO HB3 H 1 2.595 0.020 . 2 . . . . . 135 PRO HB3 . 50453 1 1393 . 1 . 1 135 135 PRO HG2 H 1 2.159 0.020 . 2 . . . . . 135 PRO HG2 . 50453 1 1394 . 1 . 1 135 135 PRO HG3 H 1 2.393 0.020 . 2 . . . . . 135 PRO HG3 . 50453 1 1395 . 1 . 1 135 135 PRO HD2 H 1 3.698 0.020 . 2 . . . . . 135 PRO HD2 . 50453 1 1396 . 1 . 1 135 135 PRO HD3 H 1 4.047 0.020 . 2 . . . . . 135 PRO HD3 . 50453 1 1397 . 1 . 1 135 135 PRO C C 13 177.990 0.3 . 1 . . . . . 135 PRO C . 50453 1 1398 . 1 . 1 135 135 PRO CA C 13 66.322 0.3 . 1 . . . . . 135 PRO CA . 50453 1 1399 . 1 . 1 135 135 PRO CB C 13 31.955 0.3 . 1 . . . . . 135 PRO CB . 50453 1 1400 . 1 . 1 135 135 PRO CG C 13 28.525 0.3 . 1 . . . . . 135 PRO CG . 50453 1 1401 . 1 . 1 135 135 PRO CD C 13 50.842 0.3 . 1 . . . . . 135 PRO CD . 50453 1 1402 . 1 . 1 136 136 ALA H H 1 8.511 0.020 . 1 . . . . . 136 ALA H . 50453 1 1403 . 1 . 1 136 136 ALA HA H 1 3.916 0.020 . 1 . . . . . 136 ALA HA . 50453 1 1404 . 1 . 1 136 136 ALA HB1 H 1 1.296 0.020 . 1 . . . . . 136 ALA HB . 50453 1 1405 . 1 . 1 136 136 ALA HB2 H 1 1.296 0.020 . 1 . . . . . 136 ALA HB . 50453 1 1406 . 1 . 1 136 136 ALA HB3 H 1 1.296 0.020 . 1 . . . . . 136 ALA HB . 50453 1 1407 . 1 . 1 136 136 ALA C C 13 177.954 0.3 . 1 . . . . . 136 ALA C . 50453 1 1408 . 1 . 1 136 136 ALA CA C 13 55.308 0.3 . 1 . . . . . 136 ALA CA . 50453 1 1409 . 1 . 1 136 136 ALA CB C 13 20.085 0.3 . 1 . . . . . 136 ALA CB . 50453 1 1410 . 1 . 1 136 136 ALA N N 15 118.300 0.3 . 1 . . . . . 136 ALA N . 50453 1 1411 . 1 . 1 137 137 ALA H H 1 7.440 0.020 . 1 . . . . . 137 ALA H . 50453 1 1412 . 1 . 1 137 137 ALA HA H 1 4.201 0.020 . 1 . . . . . 137 ALA HA . 50453 1 1413 . 1 . 1 137 137 ALA HB1 H 1 1.746 0.020 . 1 . . . . . 137 ALA HB . 50453 1 1414 . 1 . 1 137 137 ALA HB2 H 1 1.746 0.020 . 1 . . . . . 137 ALA HB . 50453 1 1415 . 1 . 1 137 137 ALA HB3 H 1 1.746 0.020 . 1 . . . . . 137 ALA HB . 50453 1 1416 . 1 . 1 137 137 ALA C C 13 181.857 0.3 . 1 . . . . . 137 ALA C . 50453 1 1417 . 1 . 1 137 137 ALA CA C 13 54.436 0.3 . 1 . . . . . 137 ALA CA . 50453 1 1418 . 1 . 1 137 137 ALA CB C 13 18.780 0.3 . 1 . . . . . 137 ALA CB . 50453 1 1419 . 1 . 1 137 137 ALA N N 15 120.797 0.3 . 1 . . . . . 137 ALA N . 50453 1 1420 . 1 . 1 138 138 GLN H H 1 8.658 0.020 . 1 . . . . . 138 GLN H . 50453 1 1421 . 1 . 1 138 138 GLN HA H 1 4.165 0.020 . 1 . . . . . 138 GLN HA . 50453 1 1422 . 1 . 1 138 138 GLN HB2 H 1 2.362 0.020 . 1 . . . . . 138 GLN HB2 . 50453 1 1423 . 1 . 1 138 138 GLN HB3 H 1 2.362 0.020 . 1 . . . . . 138 GLN HB3 . 50453 1 1424 . 1 . 1 138 138 GLN HG2 H 1 2.571 0.020 . 1 . . . . . 138 GLN HG2 . 50453 1 1425 . 1 . 1 138 138 GLN HG3 H 1 2.571 0.020 . 1 . . . . . 138 GLN HG3 . 50453 1 1426 . 1 . 1 138 138 GLN C C 13 178.748 0.3 . 1 . . . . . 138 GLN C . 50453 1 1427 . 1 . 1 138 138 GLN CA C 13 58.905 0.3 . 1 . . . . . 138 GLN CA . 50453 1 1428 . 1 . 1 138 138 GLN CB C 13 28.653 0.3 . 1 . . . . . 138 GLN CB . 50453 1 1429 . 1 . 1 138 138 GLN CG C 13 33.924 0.3 . 1 . . . . . 138 GLN CG . 50453 1 1430 . 1 . 1 138 138 GLN N N 15 122.884 0.3 . 1 . . . . . 138 GLN N . 50453 1 1431 . 1 . 1 139 139 ILE H H 1 8.332 0.020 . 1 . . . . . 139 ILE H . 50453 1 1432 . 1 . 1 139 139 ILE HA H 1 4.349 0.020 . 1 . . . . . 139 ILE HA . 50453 1 1433 . 1 . 1 139 139 ILE HB H 1 2.178 0.020 . 1 . . . . . 139 ILE HB . 50453 1 1434 . 1 . 1 139 139 ILE HG12 H 1 1.128 0.020 . 2 . . . . . 139 ILE HG12 . 50453 1 1435 . 1 . 1 139 139 ILE HG13 H 1 1.667 0.020 . 2 . . . . . 139 ILE HG13 . 50453 1 1436 . 1 . 1 139 139 ILE HG21 H 1 1.156 0.020 . 1 . . . . . 139 ILE HG2 . 50453 1 1437 . 1 . 1 139 139 ILE HG22 H 1 1.156 0.020 . 1 . . . . . 139 ILE HG2 . 50453 1 1438 . 1 . 1 139 139 ILE HG23 H 1 1.156 0.020 . 1 . . . . . 139 ILE HG2 . 50453 1 1439 . 1 . 1 139 139 ILE HD11 H 1 0.931 0.020 . 1 . . . . . 139 ILE HD1 . 50453 1 1440 . 1 . 1 139 139 ILE HD12 H 1 0.931 0.020 . 1 . . . . . 139 ILE HD1 . 50453 1 1441 . 1 . 1 139 139 ILE HD13 H 1 0.931 0.020 . 1 . . . . . 139 ILE HD1 . 50453 1 1442 . 1 . 1 139 139 ILE C C 13 176.219 0.3 . 1 . . . . . 139 ILE C . 50453 1 1443 . 1 . 1 139 139 ILE CA C 13 63.019 0.3 . 1 . . . . . 139 ILE CA . 50453 1 1444 . 1 . 1 139 139 ILE CB C 13 38.879 0.3 . 1 . . . . . 139 ILE CB . 50453 1 1445 . 1 . 1 139 139 ILE CG1 C 13 27.917 0.3 . 1 . . . . . 139 ILE CG1 . 50453 1 1446 . 1 . 1 139 139 ILE CG2 C 13 17.820 0.3 . 1 . . . . . 139 ILE CG2 . 50453 1 1447 . 1 . 1 139 139 ILE CD1 C 13 14.627 0.3 . 1 . . . . . 139 ILE CD1 . 50453 1 1448 . 1 . 1 139 139 ILE N N 15 116.899 0.3 . 1 . . . . . 139 ILE N . 50453 1 1449 . 1 . 1 140 140 GLY H H 1 7.543 0.020 . 1 . . . . . 140 GLY H . 50453 1 1450 . 1 . 1 140 140 GLY HA2 H 1 3.784 0.020 . 2 . . . . . 140 GLY HA2 . 50453 1 1451 . 1 . 1 140 140 GLY HA3 H 1 4.544 0.020 . 2 . . . . . 140 GLY HA3 . 50453 1 1452 . 1 . 1 140 140 GLY C C 13 175.399 0.3 . 1 . . . . . 140 GLY C . 50453 1 1453 . 1 . 1 140 140 GLY CA C 13 45.137 0.3 . 1 . . . . . 140 GLY CA . 50453 1 1454 . 1 . 1 140 140 GLY N N 15 106.937 0.3 . 1 . . . . . 140 GLY N . 50453 1 1455 . 1 . 1 141 141 LEU H H 1 7.480 0.020 . 1 . . . . . 141 LEU H . 50453 1 1456 . 1 . 1 141 141 LEU HA H 1 4.154 0.020 . 1 . . . . . 141 LEU HA . 50453 1 1457 . 1 . 1 141 141 LEU HB2 H 1 1.276 0.020 . 2 . . . . . 141 LEU HB2 . 50453 1 1458 . 1 . 1 141 141 LEU HB3 H 1 1.665 0.020 . 2 . . . . . 141 LEU HB3 . 50453 1 1459 . 1 . 1 141 141 LEU HG H 1 1.570 0.020 . 1 . . . . . 141 LEU HG . 50453 1 1460 . 1 . 1 141 141 LEU HD11 H 1 0.941 0.020 . 2 . . . . . 141 LEU HD1 . 50453 1 1461 . 1 . 1 141 141 LEU HD12 H 1 0.941 0.020 . 2 . . . . . 141 LEU HD1 . 50453 1 1462 . 1 . 1 141 141 LEU HD13 H 1 0.941 0.020 . 2 . . . . . 141 LEU HD1 . 50453 1 1463 . 1 . 1 141 141 LEU HD21 H 1 0.897 0.020 . 2 . . . . . 141 LEU HD2 . 50453 1 1464 . 1 . 1 141 141 LEU HD22 H 1 0.897 0.020 . 2 . . . . . 141 LEU HD2 . 50453 1 1465 . 1 . 1 141 141 LEU HD23 H 1 0.897 0.020 . 2 . . . . . 141 LEU HD2 . 50453 1 1466 . 1 . 1 141 141 LEU C C 13 175.282 0.3 . 1 . . . . . 141 LEU C . 50453 1 1467 . 1 . 1 141 141 LEU CA C 13 55.840 0.3 . 1 . . . . . 141 LEU CA . 50453 1 1468 . 1 . 1 141 141 LEU CB C 13 43.789 0.3 . 1 . . . . . 141 LEU CB . 50453 1 1469 . 1 . 1 141 141 LEU CG C 13 27.095 0.3 . 1 . . . . . 141 LEU CG . 50453 1 1470 . 1 . 1 141 141 LEU CD1 C 13 24.618 0.3 . 1 . . . . . 141 LEU CD1 . 50453 1 1471 . 1 . 1 141 141 LEU CD2 C 13 26.771 0.3 . 1 . . . . . 141 LEU CD2 . 50453 1 1472 . 1 . 1 141 141 LEU N N 15 123.219 0.3 . 1 . . . . . 141 LEU N . 50453 1 1473 . 1 . 1 142 142 LYS H H 1 8.931 0.020 . 1 . . . . . 142 LYS H . 50453 1 1474 . 1 . 1 142 142 LYS HA H 1 4.577 0.020 . 1 . . . . . 142 LYS HA . 50453 1 1475 . 1 . 1 142 142 LYS HB2 H 1 1.775 0.020 . 2 . . . . . 142 LYS HB2 . 50453 1 1476 . 1 . 1 142 142 LYS HB3 H 1 1.839 0.020 . 2 . . . . . 142 LYS HB3 . 50453 1 1477 . 1 . 1 142 142 LYS HG2 H 1 1.513 0.020 . 1 . . . . . 142 LYS HG2 . 50453 1 1478 . 1 . 1 142 142 LYS HG3 H 1 1.513 0.020 . 1 . . . . . 142 LYS HG3 . 50453 1 1479 . 1 . 1 142 142 LYS HD2 H 1 1.710 0.020 . 1 . . . . . 142 LYS HD2 . 50453 1 1480 . 1 . 1 142 142 LYS HD3 H 1 1.710 0.020 . 1 . . . . . 142 LYS HD3 . 50453 1 1481 . 1 . 1 142 142 LYS HE2 H 1 3.137 0.020 . 1 . . . . . 142 LYS HE2 . 50453 1 1482 . 1 . 1 142 142 LYS HE3 H 1 3.137 0.020 . 1 . . . . . 142 LYS HE3 . 50453 1 1483 . 1 . 1 142 142 LYS C C 13 175.466 0.3 . 1 . . . . . 142 LYS C . 50453 1 1484 . 1 . 1 142 142 LYS CA C 13 54.470 0.3 . 1 . . . . . 142 LYS CA . 50453 1 1485 . 1 . 1 142 142 LYS CB C 13 36.896 0.3 . 1 . . . . . 142 LYS CB . 50453 1 1486 . 1 . 1 142 142 LYS CG C 13 25.100 0.3 . 1 . . . . . 142 LYS CG . 50453 1 1487 . 1 . 1 142 142 LYS CD C 13 29.514 0.3 . 1 . . . . . 142 LYS CD . 50453 1 1488 . 1 . 1 142 142 LYS CE C 13 42.589 0.3 . 1 . . . . . 142 LYS CE . 50453 1 1489 . 1 . 1 142 142 LYS N N 15 123.230 0.3 . 1 . . . . . 142 LYS N . 50453 1 1490 . 1 . 1 143 143 LYS H H 1 8.642 0.020 . 1 . . . . . 143 LYS H . 50453 1 1491 . 1 . 1 143 143 LYS HA H 1 3.785 0.020 . 1 . . . . . 143 LYS HA . 50453 1 1492 . 1 . 1 143 143 LYS HB2 H 1 1.813 0.020 . 2 . . . . . 143 LYS HB2 . 50453 1 1493 . 1 . 1 143 143 LYS HB3 H 1 1.908 0.020 . 2 . . . . . 143 LYS HB3 . 50453 1 1494 . 1 . 1 143 143 LYS HG2 H 1 1.414 0.020 . 2 . . . . . 143 LYS HG2 . 50453 1 1495 . 1 . 1 143 143 LYS HG3 H 1 1.594 0.020 . 2 . . . . . 143 LYS HG3 . 50453 1 1496 . 1 . 1 143 143 LYS HD2 H 1 1.887 0.020 . 2 . . . . . 143 LYS HD2 . 50453 1 1497 . 1 . 1 143 143 LYS HD3 H 1 1.928 0.020 . 2 . . . . . 143 LYS HD3 . 50453 1 1498 . 1 . 1 143 143 LYS HE2 H 1 3.241 0.020 . 1 . . . . . 143 LYS HE2 . 50453 1 1499 . 1 . 1 143 143 LYS HE3 H 1 3.241 0.020 . 1 . . . . . 143 LYS HE3 . 50453 1 1500 . 1 . 1 143 143 LYS C C 13 177.991 0.3 . 1 . . . . . 143 LYS C . 50453 1 1501 . 1 . 1 143 143 LYS CA C 13 58.556 0.3 . 1 . . . . . 143 LYS CA . 50453 1 1502 . 1 . 1 143 143 LYS CB C 13 32.494 0.3 . 1 . . . . . 143 LYS CB . 50453 1 1503 . 1 . 1 143 143 LYS CG C 13 24.755 0.3 . 1 . . . . . 143 LYS CG . 50453 1 1504 . 1 . 1 143 143 LYS CD C 13 29.902 0.3 . 1 . . . . . 143 LYS CD . 50453 1 1505 . 1 . 1 143 143 LYS CE C 13 42.274 0.3 . 1 . . . . . 143 LYS CE . 50453 1 1506 . 1 . 1 143 143 LYS N N 15 123.435 0.3 . 1 . . . . . 143 LYS N . 50453 1 1507 . 1 . 1 144 144 GLY H H 1 9.622 0.020 . 1 . . . . . 144 GLY H . 50453 1 1508 . 1 . 1 144 144 GLY HA2 H 1 3.620 0.020 . 2 . . . . . 144 GLY HA2 . 50453 1 1509 . 1 . 1 144 144 GLY HA3 H 1 4.549 0.020 . 2 . . . . . 144 GLY HA3 . 50453 1 1510 . 1 . 1 144 144 GLY C C 13 174.513 0.3 . 1 . . . . . 144 GLY C . 50453 1 1511 . 1 . 1 144 144 GLY CA C 13 44.872 0.3 . 1 . . . . . 144 GLY CA . 50453 1 1512 . 1 . 1 144 144 GLY N N 15 119.551 0.3 . 1 . . . . . 144 GLY N . 50453 1 1513 . 1 . 1 145 145 ASP H H 1 8.279 0.020 . 1 . . . . . 145 ASP H . 50453 1 1514 . 1 . 1 145 145 ASP HA H 1 4.743 0.020 . 1 . . . . . 145 ASP HA . 50453 1 1515 . 1 . 1 145 145 ASP HB2 H 1 2.458 0.020 . 2 . . . . . 145 ASP HB2 . 50453 1 1516 . 1 . 1 145 145 ASP HB3 H 1 2.880 0.020 . 2 . . . . . 145 ASP HB3 . 50453 1 1517 . 1 . 1 145 145 ASP C C 13 175.165 0.3 . 1 . . . . . 145 ASP C . 50453 1 1518 . 1 . 1 145 145 ASP CA C 13 55.410 0.3 . 1 . . . . . 145 ASP CA . 50453 1 1519 . 1 . 1 145 145 ASP CB C 13 42.304 0.3 . 1 . . . . . 145 ASP CB . 50453 1 1520 . 1 . 1 145 145 ASP N N 15 126.595 0.3 . 1 . . . . . 145 ASP N . 50453 1 1521 . 1 . 1 146 146 VAL H H 1 8.356 0.020 . 1 . . . . . 146 VAL H . 50453 1 1522 . 1 . 1 146 146 VAL HA H 1 5.096 0.020 . 1 . . . . . 146 VAL HA . 50453 1 1523 . 1 . 1 146 146 VAL HB H 1 2.398 0.020 . 1 . . . . . 146 VAL HB . 50453 1 1524 . 1 . 1 146 146 VAL HG11 H 1 0.940 0.020 . 2 . . . . . 146 VAL HG1 . 50453 1 1525 . 1 . 1 146 146 VAL HG12 H 1 0.940 0.020 . 2 . . . . . 146 VAL HG1 . 50453 1 1526 . 1 . 1 146 146 VAL HG13 H 1 0.940 0.020 . 2 . . . . . 146 VAL HG1 . 50453 1 1527 . 1 . 1 146 146 VAL HG21 H 1 1.129 0.020 . 2 . . . . . 146 VAL HG2 . 50453 1 1528 . 1 . 1 146 146 VAL HG22 H 1 1.129 0.020 . 2 . . . . . 146 VAL HG2 . 50453 1 1529 . 1 . 1 146 146 VAL HG23 H 1 1.129 0.020 . 2 . . . . . 146 VAL HG2 . 50453 1 1530 . 1 . 1 146 146 VAL C C 13 176.453 0.3 . 1 . . . . . 146 VAL C . 50453 1 1531 . 1 . 1 146 146 VAL CA C 13 60.622 0.3 . 1 . . . . . 146 VAL CA . 50453 1 1532 . 1 . 1 146 146 VAL CB C 13 33.978 0.3 . 1 . . . . . 146 VAL CB . 50453 1 1533 . 1 . 1 146 146 VAL CG1 C 13 22.077 0.3 . 1 . . . . . 146 VAL CG1 . 50453 1 1534 . 1 . 1 146 146 VAL CG2 C 13 21.896 0.3 . 1 . . . . . 146 VAL CG2 . 50453 1 1535 . 1 . 1 146 146 VAL N N 15 121.565 0.3 . 1 . . . . . 146 VAL N . 50453 1 1536 . 1 . 1 147 147 ILE H H 1 10.234 0.020 . 1 . . . . . 147 ILE H . 50453 1 1537 . 1 . 1 147 147 ILE HA H 1 4.408 0.020 . 1 . . . . . 147 ILE HA . 50453 1 1538 . 1 . 1 147 147 ILE HB H 1 1.920 0.020 . 1 . . . . . 147 ILE HB . 50453 1 1539 . 1 . 1 147 147 ILE HG12 H 1 1.005 0.020 . 2 . . . . . 147 ILE HG12 . 50453 1 1540 . 1 . 1 147 147 ILE HG13 H 1 1.776 0.020 . 2 . . . . . 147 ILE HG13 . 50453 1 1541 . 1 . 1 147 147 ILE HG21 H 1 1.057 0.020 . 1 . . . . . 147 ILE HG2 . 50453 1 1542 . 1 . 1 147 147 ILE HG22 H 1 1.057 0.020 . 1 . . . . . 147 ILE HG2 . 50453 1 1543 . 1 . 1 147 147 ILE HG23 H 1 1.057 0.020 . 1 . . . . . 147 ILE HG2 . 50453 1 1544 . 1 . 1 147 147 ILE HD11 H 1 0.832 0.020 . 1 . . . . . 147 ILE HD1 . 50453 1 1545 . 1 . 1 147 147 ILE HD12 H 1 0.832 0.020 . 1 . . . . . 147 ILE HD1 . 50453 1 1546 . 1 . 1 147 147 ILE HD13 H 1 0.832 0.020 . 1 . . . . . 147 ILE HD1 . 50453 1 1547 . 1 . 1 147 147 ILE C C 13 175.834 0.3 . 1 . . . . . 147 ILE C . 50453 1 1548 . 1 . 1 147 147 ILE CA C 13 62.489 0.3 . 1 . . . . . 147 ILE CA . 50453 1 1549 . 1 . 1 147 147 ILE CB C 13 39.232 0.3 . 1 . . . . . 147 ILE CB . 50453 1 1550 . 1 . 1 147 147 ILE CG1 C 13 28.274 0.3 . 1 . . . . . 147 ILE CG1 . 50453 1 1551 . 1 . 1 147 147 ILE CG2 C 13 18.214 0.3 . 1 . . . . . 147 ILE CG2 . 50453 1 1552 . 1 . 1 147 147 ILE CD1 C 13 14.276 0.3 . 1 . . . . . 147 ILE CD1 . 50453 1 1553 . 1 . 1 147 147 ILE N N 15 131.699 0.3 . 1 . . . . . 147 ILE N . 50453 1 1554 . 1 . 1 148 148 ILE H H 1 8.701 0.020 . 1 . . . . . 148 ILE H . 50453 1 1555 . 1 . 1 148 148 ILE HA H 1 5.294 0.020 . 1 . . . . . 148 ILE HA . 50453 1 1556 . 1 . 1 148 148 ILE HB H 1 2.277 0.020 . 1 . . . . . 148 ILE HB . 50453 1 1557 . 1 . 1 148 148 ILE HG12 H 1 1.208 0.020 . 1 . . . . . 148 ILE HG12 . 50453 1 1558 . 1 . 1 148 148 ILE HG13 H 1 1.208 0.020 . 1 . . . . . 148 ILE HG13 . 50453 1 1559 . 1 . 1 148 148 ILE HG21 H 1 1.062 0.020 . 1 . . . . . 148 ILE HG2 . 50453 1 1560 . 1 . 1 148 148 ILE HG22 H 1 1.062 0.020 . 1 . . . . . 148 ILE HG2 . 50453 1 1561 . 1 . 1 148 148 ILE HG23 H 1 1.062 0.020 . 1 . . . . . 148 ILE HG2 . 50453 1 1562 . 1 . 1 148 148 ILE HD11 H 1 0.913 0.020 . 1 . . . . . 148 ILE HD1 . 50453 1 1563 . 1 . 1 148 148 ILE HD12 H 1 0.913 0.020 . 1 . . . . . 148 ILE HD1 . 50453 1 1564 . 1 . 1 148 148 ILE HD13 H 1 0.913 0.020 . 1 . . . . . 148 ILE HD1 . 50453 1 1565 . 1 . 1 148 148 ILE C C 13 178.108 0.3 . 1 . . . . . 148 ILE C . 50453 1 1566 . 1 . 1 148 148 ILE CA C 13 60.750 0.3 . 1 . . . . . 148 ILE CA . 50453 1 1567 . 1 . 1 148 148 ILE CB C 13 40.064 0.3 . 1 . . . . . 148 ILE CB . 50453 1 1568 . 1 . 1 148 148 ILE CG1 C 13 26.452 0.3 . 1 . . . . . 148 ILE CG1 . 50453 1 1569 . 1 . 1 148 148 ILE CG2 C 13 18.773 0.3 . 1 . . . . . 148 ILE CG2 . 50453 1 1570 . 1 . 1 148 148 ILE CD1 C 13 14.727 0.3 . 1 . . . . . 148 ILE CD1 . 50453 1 1571 . 1 . 1 148 148 ILE N N 15 120.626 0.3 . 1 . . . . . 148 ILE N . 50453 1 1572 . 1 . 1 149 149 GLY H H 1 8.298 0.020 . 1 . . . . . 149 GLY H . 50453 1 1573 . 1 . 1 149 149 GLY HA2 H 1 4.195 0.020 . 2 . . . . . 149 GLY HA2 . 50453 1 1574 . 1 . 1 149 149 GLY HA3 H 1 4.981 0.020 . 2 . . . . . 149 GLY HA3 . 50453 1 1575 . 1 . 1 149 149 GLY C C 13 171.353 0.3 . 1 . . . . . 149 GLY C . 50453 1 1576 . 1 . 1 149 149 GLY CA C 13 46.229 0.3 . 1 . . . . . 149 GLY CA . 50453 1 1577 . 1 . 1 149 149 GLY N N 15 114.508 0.3 . 1 . . . . . 149 GLY N . 50453 1 1578 . 1 . 1 150 150 ALA H H 1 9.161 0.020 . 1 . . . . . 150 ALA H . 50453 1 1579 . 1 . 1 150 150 ALA HA H 1 5.407 0.020 . 1 . . . . . 150 ALA HA . 50453 1 1580 . 1 . 1 150 150 ALA HB1 H 1 1.265 0.020 . 1 . . . . . 150 ALA HB . 50453 1 1581 . 1 . 1 150 150 ALA HB2 H 1 1.265 0.020 . 1 . . . . . 150 ALA HB . 50453 1 1582 . 1 . 1 150 150 ALA HB3 H 1 1.265 0.020 . 1 . . . . . 150 ALA HB . 50453 1 1583 . 1 . 1 150 150 ALA C C 13 176.085 0.3 . 1 . . . . . 150 ALA C . 50453 1 1584 . 1 . 1 150 150 ALA CA C 13 51.419 0.3 . 1 . . . . . 150 ALA CA . 50453 1 1585 . 1 . 1 150 150 ALA CB C 13 21.464 0.3 . 1 . . . . . 150 ALA CB . 50453 1 1586 . 1 . 1 150 150 ALA N N 15 125.475 0.3 . 1 . . . . . 150 ALA N . 50453 1 1587 . 1 . 1 151 151 ASN H H 1 9.825 0.020 . 1 . . . . . 151 ASN H . 50453 1 1588 . 1 . 1 151 151 ASN HA H 1 4.556 0.020 . 1 . . . . . 151 ASN HA . 50453 1 1589 . 1 . 1 151 151 ASN HB2 H 1 2.919 0.020 . 2 . . . . . 151 ASN HB2 . 50453 1 1590 . 1 . 1 151 151 ASN HB3 H 1 3.271 0.020 . 2 . . . . . 151 ASN HB3 . 50453 1 1591 . 1 . 1 151 151 ASN C C 13 174.647 0.3 . 1 . . . . . 151 ASN C . 50453 1 1592 . 1 . 1 151 151 ASN CA C 13 54.869 0.3 . 1 . . . . . 151 ASN CA . 50453 1 1593 . 1 . 1 151 151 ASN CB C 13 36.359 0.3 . 1 . . . . . 151 ASN CB . 50453 1 1594 . 1 . 1 151 151 ASN N N 15 125.573 0.3 . 1 . . . . . 151 ASN N . 50453 1 1595 . 1 . 1 152 152 GLN HA H 1 4.163 0.020 . 1 . . . . . 152 GLN HA . 50453 1 1596 . 1 . 1 152 152 GLN HB2 H 1 2.444 0.020 . 2 . . . . . 152 GLN HB2 . 50453 1 1597 . 1 . 1 152 152 GLN HB3 H 1 2.519 0.020 . 2 . . . . . 152 GLN HB3 . 50453 1 1598 . 1 . 1 152 152 GLN HG2 H 1 2.492 0.020 . 1 . . . . . 152 GLN HG2 . 50453 1 1599 . 1 . 1 152 152 GLN HG3 H 1 2.492 0.020 . 1 . . . . . 152 GLN HG3 . 50453 1 1600 . 1 . 1 152 152 GLN C C 13 174.997 0.3 . 1 . . . . . 152 GLN C . 50453 1 1601 . 1 . 1 152 152 GLN CA C 13 57.588 0.3 . 1 . . . . . 152 GLN CA . 50453 1 1602 . 1 . 1 152 152 GLN CB C 13 27.321 0.3 . 1 . . . . . 152 GLN CB . 50453 1 1603 . 1 . 1 152 152 GLN CG C 13 34.791 0.3 . 1 . . . . . 152 GLN CG . 50453 1 1604 . 1 . 1 153 153 GLN H H 1 8.349 0.020 . 1 . . . . . 153 GLN H . 50453 1 1605 . 1 . 1 153 153 GLN HA H 1 4.757 0.020 . 1 . . . . . 153 GLN HA . 50453 1 1606 . 1 . 1 153 153 GLN HB2 H 1 2.285 0.020 . 2 . . . . . 153 GLN HB2 . 50453 1 1607 . 1 . 1 153 153 GLN HB3 H 1 2.528 0.020 . 2 . . . . . 153 GLN HB3 . 50453 1 1608 . 1 . 1 153 153 GLN HG2 H 1 2.501 0.020 . 1 . . . . . 153 GLN HG2 . 50453 1 1609 . 1 . 1 153 153 GLN HG3 H 1 2.501 0.020 . 1 . . . . . 153 GLN HG3 . 50453 1 1610 . 1 . 1 153 153 GLN C C 13 175.337 0.3 . 1 . . . . . 153 GLN C . 50453 1 1611 . 1 . 1 153 153 GLN CA C 13 54.331 0.3 . 1 . . . . . 153 GLN CA . 50453 1 1612 . 1 . 1 153 153 GLN CB C 13 31.271 0.3 . 1 . . . . . 153 GLN CB . 50453 1 1613 . 1 . 1 153 153 GLN CG C 13 34.047 0.3 . 1 . . . . . 153 GLN CG . 50453 1 1614 . 1 . 1 153 153 GLN N N 15 122.317 0.3 . 1 . . . . . 153 GLN N . 50453 1 1615 . 1 . 1 154 154 ALA H H 1 8.794 0.020 . 1 . . . . . 154 ALA H . 50453 1 1616 . 1 . 1 154 154 ALA HA H 1 4.587 0.020 . 1 . . . . . 154 ALA HA . 50453 1 1617 . 1 . 1 154 154 ALA HB1 H 1 1.550 0.020 . 1 . . . . . 154 ALA HB . 50453 1 1618 . 1 . 1 154 154 ALA HB2 H 1 1.550 0.020 . 1 . . . . . 154 ALA HB . 50453 1 1619 . 1 . 1 154 154 ALA HB3 H 1 1.550 0.020 . 1 . . . . . 154 ALA HB . 50453 1 1620 . 1 . 1 154 154 ALA C C 13 177.243 0.3 . 1 . . . . . 154 ALA C . 50453 1 1621 . 1 . 1 154 154 ALA CA C 13 53.172 0.3 . 1 . . . . . 154 ALA CA . 50453 1 1622 . 1 . 1 154 154 ALA CB C 13 19.026 0.3 . 1 . . . . . 154 ALA CB . 50453 1 1623 . 1 . 1 154 154 ALA N N 15 129.771 0.3 . 1 . . . . . 154 ALA N . 50453 1 1624 . 1 . 1 155 155 VAL H H 1 7.801 0.020 . 1 . . . . . 155 VAL H . 50453 1 1625 . 1 . 1 155 155 VAL HA H 1 4.428 0.020 . 1 . . . . . 155 VAL HA . 50453 1 1626 . 1 . 1 155 155 VAL HB H 1 1.656 0.020 . 1 . . . . . 155 VAL HB . 50453 1 1627 . 1 . 1 155 155 VAL HG11 H 1 0.841 0.020 . 2 . . . . . 155 VAL HG1 . 50453 1 1628 . 1 . 1 155 155 VAL HG12 H 1 0.841 0.020 . 2 . . . . . 155 VAL HG1 . 50453 1 1629 . 1 . 1 155 155 VAL HG13 H 1 0.841 0.020 . 2 . . . . . 155 VAL HG1 . 50453 1 1630 . 1 . 1 155 155 VAL HG21 H 1 0.879 0.020 . 2 . . . . . 155 VAL HG2 . 50453 1 1631 . 1 . 1 155 155 VAL HG22 H 1 0.879 0.020 . 2 . . . . . 155 VAL HG2 . 50453 1 1632 . 1 . 1 155 155 VAL HG23 H 1 0.879 0.020 . 2 . . . . . 155 VAL HG2 . 50453 1 1633 . 1 . 1 155 155 VAL C C 13 174.966 0.3 . 1 . . . . . 155 VAL C . 50453 1 1634 . 1 . 1 155 155 VAL CA C 13 61.144 0.3 . 1 . . . . . 155 VAL CA . 50453 1 1635 . 1 . 1 155 155 VAL CB C 13 34.754 0.3 . 1 . . . . . 155 VAL CB . 50453 1 1636 . 1 . 1 155 155 VAL CG1 C 13 21.119 0.3 . 1 . . . . . 155 VAL CG1 . 50453 1 1637 . 1 . 1 155 155 VAL CG2 C 13 23.039 0.3 . 1 . . . . . 155 VAL CG2 . 50453 1 1638 . 1 . 1 155 155 VAL N N 15 123.214 0.3 . 1 . . . . . 155 VAL N . 50453 1 1639 . 1 . 1 156 156 LYS H H 1 9.201 0.020 . 1 . . . . . 156 LYS H . 50453 1 1640 . 1 . 1 156 156 LYS HA H 1 4.201 0.020 . 1 . . . . . 156 LYS HA . 50453 1 1641 . 1 . 1 156 156 LYS HB2 H 1 1.689 0.020 . 2 . . . . . 156 LYS HB2 . 50453 1 1642 . 1 . 1 156 156 LYS HB3 H 1 1.780 0.020 . 2 . . . . . 156 LYS HB3 . 50453 1 1643 . 1 . 1 156 156 LYS HG2 H 1 1.611 0.020 . 1 . . . . . 156 LYS HG2 . 50453 1 1644 . 1 . 1 156 156 LYS HG3 H 1 1.611 0.020 . 1 . . . . . 156 LYS HG3 . 50453 1 1645 . 1 . 1 156 156 LYS HD2 H 1 1.840 0.020 . 2 . . . . . 156 LYS HD2 . 50453 1 1646 . 1 . 1 156 156 LYS HD3 H 1 2.111 0.020 . 2 . . . . . 156 LYS HD3 . 50453 1 1647 . 1 . 1 156 156 LYS HE2 H 1 3.131 0.020 . 1 . . . . . 156 LYS HE2 . 50453 1 1648 . 1 . 1 156 156 LYS HE3 H 1 3.131 0.020 . 1 . . . . . 156 LYS HE3 . 50453 1 1649 . 1 . 1 156 156 LYS C C 13 176.340 0.3 . 1 . . . . . 156 LYS C . 50453 1 1650 . 1 . 1 156 156 LYS CA C 13 56.718 0.3 . 1 . . . . . 156 LYS CA . 50453 1 1651 . 1 . 1 156 156 LYS CB C 13 33.950 0.3 . 1 . . . . . 156 LYS CB . 50453 1 1652 . 1 . 1 156 156 LYS CG C 13 25.180 0.3 . 1 . . . . . 156 LYS CG . 50453 1 1653 . 1 . 1 156 156 LYS CD C 13 29.465 0.3 . 1 . . . . . 156 LYS CD . 50453 1 1654 . 1 . 1 156 156 LYS CE C 13 41.870 0.3 . 1 . . . . . 156 LYS CE . 50453 1 1655 . 1 . 1 156 156 LYS N N 15 124.884 0.3 . 1 . . . . . 156 LYS N . 50453 1 1656 . 1 . 1 157 157 ASN H H 1 7.592 0.020 . 1 . . . . . 157 ASN H . 50453 1 1657 . 1 . 1 157 157 ASN HA H 1 4.625 0.020 . 1 . . . . . 157 ASN HA . 50453 1 1658 . 1 . 1 157 157 ASN HB2 H 1 3.203 0.020 . 2 . . . . . 157 ASN HB2 . 50453 1 1659 . 1 . 1 157 157 ASN HB3 H 1 3.331 0.020 . 2 . . . . . 157 ASN HB3 . 50453 1 1660 . 1 . 1 157 157 ASN C C 13 175.371 0.3 . 1 . . . . . 157 ASN C . 50453 1 1661 . 1 . 1 157 157 ASN CA C 13 52.388 0.3 . 1 . . . . . 157 ASN CA . 50453 1 1662 . 1 . 1 157 157 ASN CB C 13 39.955 0.3 . 1 . . . . . 157 ASN CB . 50453 1 1663 . 1 . 1 157 157 ASN N N 15 112.675 0.3 . 1 . . . . . 157 ASN N . 50453 1 1664 . 1 . 1 158 158 ILE H H 1 9.965 0.020 . 1 . . . . . 158 ILE H . 50453 1 1665 . 1 . 1 158 158 ILE HA H 1 3.591 0.020 . 1 . . . . . 158 ILE HA . 50453 1 1666 . 1 . 1 158 158 ILE HB H 1 1.860 0.020 . 1 . . . . . 158 ILE HB . 50453 1 1667 . 1 . 1 158 158 ILE HG12 H 1 1.129 0.020 . 1 . . . . . 158 ILE HG12 . 50453 1 1668 . 1 . 1 158 158 ILE HG13 H 1 1.129 0.020 . 1 . . . . . 158 ILE HG13 . 50453 1 1669 . 1 . 1 158 158 ILE HG21 H 1 0.864 0.020 . 1 . . . . . 158 ILE HG2 . 50453 1 1670 . 1 . 1 158 158 ILE HG22 H 1 0.864 0.020 . 1 . . . . . 158 ILE HG2 . 50453 1 1671 . 1 . 1 158 158 ILE HG23 H 1 0.864 0.020 . 1 . . . . . 158 ILE HG2 . 50453 1 1672 . 1 . 1 158 158 ILE HD11 H 1 0.904 0.020 . 1 . . . . . 158 ILE HD1 . 50453 1 1673 . 1 . 1 158 158 ILE HD12 H 1 0.904 0.020 . 1 . . . . . 158 ILE HD1 . 50453 1 1674 . 1 . 1 158 158 ILE HD13 H 1 0.904 0.020 . 1 . . . . . 158 ILE HD1 . 50453 1 1675 . 1 . 1 158 158 ILE C C 13 176.658 0.3 . 1 . . . . . 158 ILE C . 50453 1 1676 . 1 . 1 158 158 ILE CA C 13 65.068 0.3 . 1 . . . . . 158 ILE CA . 50453 1 1677 . 1 . 1 158 158 ILE CB C 13 38.558 0.3 . 1 . . . . . 158 ILE CB . 50453 1 1678 . 1 . 1 158 158 ILE CG1 C 13 29.179 0.3 . 1 . . . . . 158 ILE CG1 . 50453 1 1679 . 1 . 1 158 158 ILE CG2 C 13 17.916 0.3 . 1 . . . . . 158 ILE CG2 . 50453 1 1680 . 1 . 1 158 158 ILE CD1 C 13 14.233 0.3 . 1 . . . . . 158 ILE CD1 . 50453 1 1681 . 1 . 1 158 158 ILE N N 15 121.583 0.3 . 1 . . . . . 158 ILE N . 50453 1 1682 . 1 . 1 159 159 ALA H H 1 8.410 0.020 . 1 . . . . . 159 ALA H . 50453 1 1683 . 1 . 1 159 159 ALA HA H 1 4.147 0.020 . 1 . . . . . 159 ALA HA . 50453 1 1684 . 1 . 1 159 159 ALA HB1 H 1 1.579 0.020 . 1 . . . . . 159 ALA HB . 50453 1 1685 . 1 . 1 159 159 ALA HB2 H 1 1.579 0.020 . 1 . . . . . 159 ALA HB . 50453 1 1686 . 1 . 1 159 159 ALA HB3 H 1 1.579 0.020 . 1 . . . . . 159 ALA HB . 50453 1 1687 . 1 . 1 159 159 ALA C C 13 181.389 0.3 . 1 . . . . . 159 ALA C . 50453 1 1688 . 1 . 1 159 159 ALA CA C 13 55.714 0.3 . 1 . . . . . 159 ALA CA . 50453 1 1689 . 1 . 1 159 159 ALA CB C 13 17.668 0.3 . 1 . . . . . 159 ALA CB . 50453 1 1690 . 1 . 1 159 159 ALA N N 15 127.696 0.3 . 1 . . . . . 159 ALA N . 50453 1 1691 . 1 . 1 160 160 GLU H H 1 8.402 0.020 . 1 . . . . . 160 GLU H . 50453 1 1692 . 1 . 1 160 160 GLU HA H 1 4.155 0.020 . 1 . . . . . 160 GLU HA . 50453 1 1693 . 1 . 1 160 160 GLU HB2 H 1 2.106 0.020 . 2 . . . . . 160 GLU HB2 . 50453 1 1694 . 1 . 1 160 160 GLU HB3 H 1 2.293 0.020 . 2 . . . . . 160 GLU HB3 . 50453 1 1695 . 1 . 1 160 160 GLU HG2 H 1 2.411 0.020 . 2 . . . . . 160 GLU HG2 . 50453 1 1696 . 1 . 1 160 160 GLU HG3 H 1 2.826 0.020 . 2 . . . . . 160 GLU HG3 . 50453 1 1697 . 1 . 1 160 160 GLU C C 13 179.166 0.3 . 1 . . . . . 160 GLU C . 50453 1 1698 . 1 . 1 160 160 GLU CA C 13 59.632 0.3 . 1 . . . . . 160 GLU CA . 50453 1 1699 . 1 . 1 160 160 GLU CB C 13 30.251 0.3 . 1 . . . . . 160 GLU CB . 50453 1 1700 . 1 . 1 160 160 GLU CG C 13 37.442 0.3 . 1 . . . . . 160 GLU CG . 50453 1 1701 . 1 . 1 160 160 GLU N N 15 120.770 0.3 . 1 . . . . . 160 GLU N . 50453 1 1702 . 1 . 1 161 161 LEU H H 1 7.990 0.020 . 1 . . . . . 161 LEU H . 50453 1 1703 . 1 . 1 161 161 LEU HA H 1 4.135 0.020 . 1 . . . . . 161 LEU HA . 50453 1 1704 . 1 . 1 161 161 LEU HB2 H 1 1.410 0.020 . 2 . . . . . 161 LEU HB2 . 50453 1 1705 . 1 . 1 161 161 LEU HB3 H 1 2.042 0.020 . 2 . . . . . 161 LEU HB3 . 50453 1 1706 . 1 . 1 161 161 LEU HG H 1 1.464 0.020 . 1 . . . . . 161 LEU HG . 50453 1 1707 . 1 . 1 161 161 LEU HD11 H 1 0.935 0.020 . 2 . . . . . 161 LEU HD1 . 50453 1 1708 . 1 . 1 161 161 LEU HD12 H 1 0.935 0.020 . 2 . . . . . 161 LEU HD1 . 50453 1 1709 . 1 . 1 161 161 LEU HD13 H 1 0.935 0.020 . 2 . . . . . 161 LEU HD1 . 50453 1 1710 . 1 . 1 161 161 LEU HD21 H 1 0.906 0.020 . 2 . . . . . 161 LEU HD2 . 50453 1 1711 . 1 . 1 161 161 LEU HD22 H 1 0.906 0.020 . 2 . . . . . 161 LEU HD2 . 50453 1 1712 . 1 . 1 161 161 LEU HD23 H 1 0.906 0.020 . 2 . . . . . 161 LEU HD2 . 50453 1 1713 . 1 . 1 161 161 LEU C C 13 178.129 0.3 . 1 . . . . . 161 LEU C . 50453 1 1714 . 1 . 1 161 161 LEU CA C 13 57.835 0.3 . 1 . . . . . 161 LEU CA . 50453 1 1715 . 1 . 1 161 161 LEU CB C 13 41.650 0.3 . 1 . . . . . 161 LEU CB . 50453 1 1716 . 1 . 1 161 161 LEU CG C 13 27.562 0.3 . 1 . . . . . 161 LEU CG . 50453 1 1717 . 1 . 1 161 161 LEU CD1 C 13 22.217 0.3 . 1 . . . . . 161 LEU CD1 . 50453 1 1718 . 1 . 1 161 161 LEU CD2 C 13 27.814 0.3 . 1 . . . . . 161 LEU CD2 . 50453 1 1719 . 1 . 1 161 161 LEU N N 15 123.243 0.3 . 1 . . . . . 161 LEU N . 50453 1 1720 . 1 . 1 162 162 ARG H H 1 8.969 0.020 . 1 . . . . . 162 ARG H . 50453 1 1721 . 1 . 1 162 162 ARG HA H 1 3.911 0.020 . 1 . . . . . 162 ARG HA . 50453 1 1722 . 1 . 1 162 162 ARG HB2 H 1 1.997 0.020 . 1 . . . . . 162 ARG HB2 . 50453 1 1723 . 1 . 1 162 162 ARG HB3 H 1 1.997 0.020 . 1 . . . . . 162 ARG HB3 . 50453 1 1724 . 1 . 1 162 162 ARG HG2 H 1 1.723 0.020 . 2 . . . . . 162 ARG HG2 . 50453 1 1725 . 1 . 1 162 162 ARG HG3 H 1 1.846 0.020 . 2 . . . . . 162 ARG HG3 . 50453 1 1726 . 1 . 1 162 162 ARG HD2 H 1 3.296 0.020 . 1 . . . . . 162 ARG HD2 . 50453 1 1727 . 1 . 1 162 162 ARG HD3 H 1 3.296 0.020 . 1 . . . . . 162 ARG HD3 . 50453 1 1728 . 1 . 1 162 162 ARG C C 13 177.561 0.3 . 1 . . . . . 162 ARG C . 50453 1 1729 . 1 . 1 162 162 ARG CA C 13 60.010 0.3 . 1 . . . . . 162 ARG CA . 50453 1 1730 . 1 . 1 162 162 ARG CB C 13 29.763 0.3 . 1 . . . . . 162 ARG CB . 50453 1 1731 . 1 . 1 162 162 ARG CG C 13 27.656 0.3 . 1 . . . . . 162 ARG CG . 50453 1 1732 . 1 . 1 162 162 ARG CD C 13 43.771 0.3 . 1 . . . . . 162 ARG CD . 50453 1 1733 . 1 . 1 162 162 ARG N N 15 121.333 0.3 . 1 . . . . . 162 ARG N . 50453 1 1734 . 1 . 1 163 163 LYS H H 1 7.639 0.020 . 1 . . . . . 163 LYS H . 50453 1 1735 . 1 . 1 163 163 LYS HA H 1 4.240 0.020 . 1 . . . . . 163 LYS HA . 50453 1 1736 . 1 . 1 163 163 LYS HB2 H 1 2.112 0.020 . 1 . . . . . 163 LYS HB2 . 50453 1 1737 . 1 . 1 163 163 LYS HB3 H 1 2.112 0.020 . 1 . . . . . 163 LYS HB3 . 50453 1 1738 . 1 . 1 163 163 LYS HG2 H 1 1.669 0.020 . 2 . . . . . 163 LYS HG2 . 50453 1 1739 . 1 . 1 163 163 LYS HG3 H 1 1.752 0.020 . 2 . . . . . 163 LYS HG3 . 50453 1 1740 . 1 . 1 163 163 LYS HD2 H 1 2.155 0.020 . 1 . . . . . 163 LYS HD2 . 50453 1 1741 . 1 . 1 163 163 LYS HD3 H 1 2.155 0.020 . 1 . . . . . 163 LYS HD3 . 50453 1 1742 . 1 . 1 163 163 LYS HE2 H 1 3.143 0.020 . 1 . . . . . 163 LYS HE2 . 50453 1 1743 . 1 . 1 163 163 LYS HE3 H 1 3.143 0.020 . 1 . . . . . 163 LYS HE3 . 50453 1 1744 . 1 . 1 163 163 LYS C C 13 179.684 0.3 . 1 . . . . . 163 LYS C . 50453 1 1745 . 1 . 1 163 163 LYS CA C 13 59.697 0.3 . 1 . . . . . 163 LYS CA . 50453 1 1746 . 1 . 1 163 163 LYS CB C 13 32.505 0.3 . 1 . . . . . 163 LYS CB . 50453 1 1747 . 1 . 1 163 163 LYS CG C 13 25.143 0.3 . 1 . . . . . 163 LYS CG . 50453 1 1748 . 1 . 1 163 163 LYS CD C 13 29.404 0.3 . 1 . . . . . 163 LYS CD . 50453 1 1749 . 1 . 1 163 163 LYS CE C 13 42.201 0.3 . 1 . . . . . 163 LYS CE . 50453 1 1750 . 1 . 1 163 163 LYS N N 15 120.123 0.3 . 1 . . . . . 163 LYS N . 50453 1 1751 . 1 . 1 164 164 VAL H H 1 7.670 0.020 . 1 . . . . . 164 VAL H . 50453 1 1752 . 1 . 1 164 164 VAL HA H 1 3.901 0.020 . 1 . . . . . 164 VAL HA . 50453 1 1753 . 1 . 1 164 164 VAL HB H 1 2.296 0.020 . 1 . . . . . 164 VAL HB . 50453 1 1754 . 1 . 1 164 164 VAL HG11 H 1 0.961 0.020 . 2 . . . . . 164 VAL HG1 . 50453 1 1755 . 1 . 1 164 164 VAL HG12 H 1 0.961 0.020 . 2 . . . . . 164 VAL HG1 . 50453 1 1756 . 1 . 1 164 164 VAL HG13 H 1 0.961 0.020 . 2 . . . . . 164 VAL HG1 . 50453 1 1757 . 1 . 1 164 164 VAL HG21 H 1 1.160 0.020 . 2 . . . . . 164 VAL HG2 . 50453 1 1758 . 1 . 1 164 164 VAL HG22 H 1 1.160 0.020 . 2 . . . . . 164 VAL HG2 . 50453 1 1759 . 1 . 1 164 164 VAL HG23 H 1 1.160 0.020 . 2 . . . . . 164 VAL HG2 . 50453 1 1760 . 1 . 1 164 164 VAL C C 13 179.383 0.3 . 1 . . . . . 164 VAL C . 50453 1 1761 . 1 . 1 164 164 VAL CA C 13 66.218 0.3 . 1 . . . . . 164 VAL CA . 50453 1 1762 . 1 . 1 164 164 VAL CB C 13 31.783 0.3 . 1 . . . . . 164 VAL CB . 50453 1 1763 . 1 . 1 164 164 VAL CG1 C 13 21.173 0.3 . 1 . . . . . 164 VAL CG1 . 50453 1 1764 . 1 . 1 164 164 VAL CG2 C 13 21.963 0.3 . 1 . . . . . 164 VAL CG2 . 50453 1 1765 . 1 . 1 164 164 VAL N N 15 120.999 0.3 . 1 . . . . . 164 VAL N . 50453 1 1766 . 1 . 1 165 165 LEU H H 1 8.437 0.020 . 1 . . . . . 165 LEU H . 50453 1 1767 . 1 . 1 165 165 LEU HA H 1 4.087 0.020 . 1 . . . . . 165 LEU HA . 50453 1 1768 . 1 . 1 165 165 LEU HB2 H 1 1.824 0.020 . 2 . . . . . 165 LEU HB2 . 50453 1 1769 . 1 . 1 165 165 LEU HB3 H 1 2.043 0.020 . 2 . . . . . 165 LEU HB3 . 50453 1 1770 . 1 . 1 165 165 LEU HG H 1 1.746 0.020 . 1 . . . . . 165 LEU HG . 50453 1 1771 . 1 . 1 165 165 LEU HD11 H 1 0.958 0.020 . 2 . . . . . 165 LEU HD1 . 50453 1 1772 . 1 . 1 165 165 LEU HD12 H 1 0.958 0.020 . 2 . . . . . 165 LEU HD1 . 50453 1 1773 . 1 . 1 165 165 LEU HD13 H 1 0.958 0.020 . 2 . . . . . 165 LEU HD1 . 50453 1 1774 . 1 . 1 165 165 LEU HD21 H 1 1.013 0.020 . 2 . . . . . 165 LEU HD2 . 50453 1 1775 . 1 . 1 165 165 LEU HD22 H 1 1.013 0.020 . 2 . . . . . 165 LEU HD2 . 50453 1 1776 . 1 . 1 165 165 LEU HD23 H 1 1.013 0.020 . 2 . . . . . 165 LEU HD2 . 50453 1 1777 . 1 . 1 165 165 LEU C C 13 180.470 0.3 . 1 . . . . . 165 LEU C . 50453 1 1778 . 1 . 1 165 165 LEU CA C 13 58.306 0.3 . 1 . . . . . 165 LEU CA . 50453 1 1779 . 1 . 1 165 165 LEU CB C 13 41.019 0.3 . 1 . . . . . 165 LEU CB . 50453 1 1780 . 1 . 1 165 165 LEU CG C 13 27.861 0.3 . 1 . . . . . 165 LEU CG . 50453 1 1781 . 1 . 1 165 165 LEU CD1 C 13 23.106 0.3 . 1 . . . . . 165 LEU CD1 . 50453 1 1782 . 1 . 1 165 165 LEU CD2 C 13 25.913 0.3 . 1 . . . . . 165 LEU CD2 . 50453 1 1783 . 1 . 1 165 165 LEU N N 15 123.131 0.3 . 1 . . . . . 165 LEU N . 50453 1 1784 . 1 . 1 166 166 ASP H H 1 9.041 0.020 . 1 . . . . . 166 ASP H . 50453 1 1785 . 1 . 1 166 166 ASP HA H 1 4.670 0.020 . 1 . . . . . 166 ASP HA . 50453 1 1786 . 1 . 1 166 166 ASP HB2 H 1 2.852 0.020 . 2 . . . . . 166 ASP HB2 . 50453 1 1787 . 1 . 1 166 166 ASP HB3 H 1 2.957 0.020 . 2 . . . . . 166 ASP HB3 . 50453 1 1788 . 1 . 1 166 166 ASP C C 13 177.444 0.3 . 1 . . . . . 166 ASP C . 50453 1 1789 . 1 . 1 166 166 ASP CA C 13 56.819 0.3 . 1 . . . . . 166 ASP CA . 50453 1 1790 . 1 . 1 166 166 ASP CB C 13 40.640 0.3 . 1 . . . . . 166 ASP CB . 50453 1 1791 . 1 . 1 166 166 ASP N N 15 122.820 0.3 . 1 . . . . . 166 ASP N . 50453 1 1792 . 1 . 1 167 167 SER H H 1 7.734 0.020 . 1 . . . . . 167 SER H . 50453 1 1793 . 1 . 1 167 167 SER HA H 1 4.570 0.020 . 1 . . . . . 167 SER HA . 50453 1 1794 . 1 . 1 167 167 SER HB2 H 1 4.220 0.020 . 1 . . . . . 167 SER HB2 . 50453 1 1795 . 1 . 1 167 167 SER HB3 H 1 4.220 0.020 . 1 . . . . . 167 SER HB3 . 50453 1 1796 . 1 . 1 167 167 SER C C 13 173.582 0.3 . 1 . . . . . 167 SER C . 50453 1 1797 . 1 . 1 167 167 SER CA C 13 59.534 0.3 . 1 . . . . . 167 SER CA . 50453 1 1798 . 1 . 1 167 167 SER CB C 13 63.933 0.3 . 1 . . . . . 167 SER CB . 50453 1 1799 . 1 . 1 167 167 SER N N 15 116.908 0.3 . 1 . . . . . 167 SER N . 50453 1 1800 . 1 . 1 168 168 LYS H H 1 8.158 0.020 . 1 . . . . . 168 LYS H . 50453 1 1801 . 1 . 1 168 168 LYS HA H 1 4.724 0.020 . 1 . . . . . 168 LYS HA . 50453 1 1802 . 1 . 1 168 168 LYS HB2 H 1 2.068 0.020 . 1 . . . . . 168 LYS HB2 . 50453 1 1803 . 1 . 1 168 168 LYS HB3 H 1 2.068 0.020 . 1 . . . . . 168 LYS HB3 . 50453 1 1804 . 1 . 1 168 168 LYS HG2 H 1 1.567 0.020 . 1 . . . . . 168 LYS HG2 . 50453 1 1805 . 1 . 1 168 168 LYS HG3 H 1 1.567 0.020 . 1 . . . . . 168 LYS HG3 . 50453 1 1806 . 1 . 1 168 168 LYS HD2 H 1 1.849 0.020 . 1 . . . . . 168 LYS HD2 . 50453 1 1807 . 1 . 1 168 168 LYS HD3 H 1 1.849 0.020 . 1 . . . . . 168 LYS HD3 . 50453 1 1808 . 1 . 1 168 168 LYS C C 13 172.963 0.3 . 1 . . . . . 168 LYS C . 50453 1 1809 . 1 . 1 168 168 LYS CA C 13 56.010 0.3 . 1 . . . . . 168 LYS CA . 50453 1 1810 . 1 . 1 168 168 LYS CB C 13 30.103 0.3 . 1 . . . . . 168 LYS CB . 50453 1 1811 . 1 . 1 168 168 LYS CG C 13 25.161 0.3 . 1 . . . . . 168 LYS CG . 50453 1 1812 . 1 . 1 168 168 LYS CD C 13 29.946 0.3 . 1 . . . . . 168 LYS CD . 50453 1 1813 . 1 . 1 168 168 LYS N N 15 120.753 0.3 . 1 . . . . . 168 LYS N . 50453 1 1814 . 1 . 1 169 169 PRO HA H 1 4.234 0.020 . 1 . . . . . 169 PRO HA . 50453 1 1815 . 1 . 1 169 169 PRO HB2 H 1 1.991 0.020 . 2 . . . . . 169 PRO HB2 . 50453 1 1816 . 1 . 1 169 169 PRO HB3 H 1 2.102 0.020 . 2 . . . . . 169 PRO HB3 . 50453 1 1817 . 1 . 1 169 169 PRO HG2 H 1 2.214 0.020 . 1 . . . . . 169 PRO HG2 . 50453 1 1818 . 1 . 1 169 169 PRO HG3 H 1 2.214 0.020 . 1 . . . . . 169 PRO HG3 . 50453 1 1819 . 1 . 1 169 169 PRO HD2 H 1 4.124 0.020 . 1 . . . . . 169 PRO HD2 . 50453 1 1820 . 1 . 1 169 169 PRO HD3 H 1 4.124 0.020 . 1 . . . . . 169 PRO HD3 . 50453 1 1821 . 1 . 1 169 169 PRO CA C 13 62.317 0.3 . 1 . . . . . 169 PRO CA . 50453 1 1822 . 1 . 1 169 169 PRO CB C 13 30.693 0.3 . 1 . . . . . 169 PRO CB . 50453 1 1823 . 1 . 1 169 169 PRO CG C 13 27.730 0.3 . 1 . . . . . 169 PRO CG . 50453 1 1824 . 1 . 1 169 169 PRO CD C 13 50.962 0.3 . 1 . . . . . 169 PRO CD . 50453 1 1825 . 1 . 1 170 170 SER HA H 1 4.338 0.020 . 1 . . . . . 170 SER HA . 50453 1 1826 . 1 . 1 170 170 SER HB2 H 1 4.086 0.020 . 1 . . . . . 170 SER HB2 . 50453 1 1827 . 1 . 1 170 170 SER HB3 H 1 4.086 0.020 . 1 . . . . . 170 SER HB3 . 50453 1 1828 . 1 . 1 170 170 SER C C 13 174.361 0.3 . 1 . . . . . 170 SER C . 50453 1 1829 . 1 . 1 170 170 SER CA C 13 60.878 0.3 . 1 . . . . . 170 SER CA . 50453 1 1830 . 1 . 1 170 170 SER CB C 13 63.412 0.3 . 1 . . . . . 170 SER CB . 50453 1 1831 . 1 . 1 171 171 VAL H H 1 7.618 0.020 . 1 . . . . . 171 VAL H . 50453 1 1832 . 1 . 1 171 171 VAL HA H 1 4.502 0.020 . 1 . . . . . 171 VAL HA . 50453 1 1833 . 1 . 1 171 171 VAL HB H 1 2.033 0.020 . 1 . . . . . 171 VAL HB . 50453 1 1834 . 1 . 1 171 171 VAL HG11 H 1 0.963 0.020 . 2 . . . . . 171 VAL HG1 . 50453 1 1835 . 1 . 1 171 171 VAL HG12 H 1 0.963 0.020 . 2 . . . . . 171 VAL HG1 . 50453 1 1836 . 1 . 1 171 171 VAL HG13 H 1 0.963 0.020 . 2 . . . . . 171 VAL HG1 . 50453 1 1837 . 1 . 1 171 171 VAL HG21 H 1 0.988 0.020 . 2 . . . . . 171 VAL HG2 . 50453 1 1838 . 1 . 1 171 171 VAL HG22 H 1 0.988 0.020 . 2 . . . . . 171 VAL HG2 . 50453 1 1839 . 1 . 1 171 171 VAL HG23 H 1 0.988 0.020 . 2 . . . . . 171 VAL HG2 . 50453 1 1840 . 1 . 1 171 171 VAL C C 13 173.816 0.3 . 1 . . . . . 171 VAL C . 50453 1 1841 . 1 . 1 171 171 VAL CA C 13 61.202 0.3 . 1 . . . . . 171 VAL CA . 50453 1 1842 . 1 . 1 171 171 VAL CB C 13 34.756 0.3 . 1 . . . . . 171 VAL CB . 50453 1 1843 . 1 . 1 171 171 VAL CG1 C 13 21.185 0.3 . 1 . . . . . 171 VAL CG1 . 50453 1 1844 . 1 . 1 171 171 VAL CG2 C 13 21.509 0.3 . 1 . . . . . 171 VAL CG2 . 50453 1 1845 . 1 . 1 171 171 VAL N N 15 120.379 0.3 . 1 . . . . . 171 VAL N . 50453 1 1846 . 1 . 1 172 172 LEU H H 1 8.848 0.020 . 1 . . . . . 172 LEU H . 50453 1 1847 . 1 . 1 172 172 LEU HA H 1 4.942 0.020 . 1 . . . . . 172 LEU HA . 50453 1 1848 . 1 . 1 172 172 LEU HB2 H 1 1.954 0.020 . 1 . . . . . 172 LEU HB2 . 50453 1 1849 . 1 . 1 172 172 LEU HB3 H 1 1.954 0.020 . 1 . . . . . 172 LEU HB3 . 50453 1 1850 . 1 . 1 172 172 LEU HG H 1 1.407 0.020 . 1 . . . . . 172 LEU HG . 50453 1 1851 . 1 . 1 172 172 LEU HD11 H 1 0.974 0.020 . 2 . . . . . 172 LEU HD1 . 50453 1 1852 . 1 . 1 172 172 LEU HD12 H 1 0.974 0.020 . 2 . . . . . 172 LEU HD1 . 50453 1 1853 . 1 . 1 172 172 LEU HD13 H 1 0.974 0.020 . 2 . . . . . 172 LEU HD1 . 50453 1 1854 . 1 . 1 172 172 LEU HD21 H 1 0.941 0.020 . 2 . . . . . 172 LEU HD2 . 50453 1 1855 . 1 . 1 172 172 LEU HD22 H 1 0.941 0.020 . 2 . . . . . 172 LEU HD2 . 50453 1 1856 . 1 . 1 172 172 LEU HD23 H 1 0.941 0.020 . 2 . . . . . 172 LEU HD2 . 50453 1 1857 . 1 . 1 172 172 LEU C C 13 173.247 0.3 . 1 . . . . . 172 LEU C . 50453 1 1858 . 1 . 1 172 172 LEU CA C 13 53.957 0.3 . 1 . . . . . 172 LEU CA . 50453 1 1859 . 1 . 1 172 172 LEU CB C 13 44.779 0.3 . 1 . . . . . 172 LEU CB . 50453 1 1860 . 1 . 1 172 172 LEU CG C 13 26.000 0.3 . 1 . . . . . 172 LEU CG . 50453 1 1861 . 1 . 1 172 172 LEU CD1 C 13 23.246 0.3 . 1 . . . . . 172 LEU CD1 . 50453 1 1862 . 1 . 1 172 172 LEU CD2 C 13 26.193 0.3 . 1 . . . . . 172 LEU CD2 . 50453 1 1863 . 1 . 1 172 172 LEU N N 15 130.003 0.3 . 1 . . . . . 172 LEU N . 50453 1 1864 . 1 . 1 173 173 ALA H H 1 9.145 0.020 . 1 . . . . . 173 ALA H . 50453 1 1865 . 1 . 1 173 173 ALA HA H 1 5.240 0.020 . 1 . . . . . 173 ALA HA . 50453 1 1866 . 1 . 1 173 173 ALA HB1 H 1 1.381 0.020 . 1 . . . . . 173 ALA HB . 50453 1 1867 . 1 . 1 173 173 ALA HB2 H 1 1.381 0.020 . 1 . . . . . 173 ALA HB . 50453 1 1868 . 1 . 1 173 173 ALA HB3 H 1 1.381 0.020 . 1 . . . . . 173 ALA HB . 50453 1 1869 . 1 . 1 173 173 ALA C C 13 176.859 0.3 . 1 . . . . . 173 ALA C . 50453 1 1870 . 1 . 1 173 173 ALA CA C 13 50.352 0.3 . 1 . . . . . 173 ALA CA . 50453 1 1871 . 1 . 1 173 173 ALA CB C 13 20.257 0.3 . 1 . . . . . 173 ALA CB . 50453 1 1872 . 1 . 1 173 173 ALA N N 15 132.378 0.3 . 1 . . . . . 173 ALA N . 50453 1 1873 . 1 . 1 174 174 LEU H H 1 9.425 0.020 . 1 . . . . . 174 LEU H . 50453 1 1874 . 1 . 1 174 174 LEU HA H 1 4.965 0.020 . 1 . . . . . 174 LEU HA . 50453 1 1875 . 1 . 1 174 174 LEU HB2 H 1 1.618 0.020 . 2 . . . . . 174 LEU HB2 . 50453 1 1876 . 1 . 1 174 174 LEU HB3 H 1 1.767 0.020 . 2 . . . . . 174 LEU HB3 . 50453 1 1877 . 1 . 1 174 174 LEU HG H 1 1.751 0.020 . 1 . . . . . 174 LEU HG . 50453 1 1878 . 1 . 1 174 174 LEU HD11 H 1 0.944 0.020 . 2 . . . . . 174 LEU HD1 . 50453 1 1879 . 1 . 1 174 174 LEU HD12 H 1 0.944 0.020 . 2 . . . . . 174 LEU HD1 . 50453 1 1880 . 1 . 1 174 174 LEU HD13 H 1 0.944 0.020 . 2 . . . . . 174 LEU HD1 . 50453 1 1881 . 1 . 1 174 174 LEU HD21 H 1 0.945 0.020 . 2 . . . . . 174 LEU HD2 . 50453 1 1882 . 1 . 1 174 174 LEU HD22 H 1 0.945 0.020 . 2 . . . . . 174 LEU HD2 . 50453 1 1883 . 1 . 1 174 174 LEU HD23 H 1 0.945 0.020 . 2 . . . . . 174 LEU HD2 . 50453 1 1884 . 1 . 1 174 174 LEU C C 13 174.652 0.3 . 1 . . . . . 174 LEU C . 50453 1 1885 . 1 . 1 174 174 LEU CA C 13 53.922 0.3 . 1 . . . . . 174 LEU CA . 50453 1 1886 . 1 . 1 174 174 LEU CB C 13 44.581 0.3 . 1 . . . . . 174 LEU CB . 50453 1 1887 . 1 . 1 174 174 LEU CG C 13 26.897 0.3 . 1 . . . . . 174 LEU CG . 50453 1 1888 . 1 . 1 174 174 LEU CD1 C 13 25.843 0.3 . 1 . . . . . 174 LEU CD1 . 50453 1 1889 . 1 . 1 174 174 LEU CD2 C 13 25.303 0.3 . 1 . . . . . 174 LEU CD2 . 50453 1 1890 . 1 . 1 174 174 LEU N N 15 126.484 0.3 . 1 . . . . . 174 LEU N . 50453 1 1891 . 1 . 1 175 175 ASN H H 1 8.721 0.020 . 1 . . . . . 175 ASN H . 50453 1 1892 . 1 . 1 175 175 ASN HA H 1 4.984 0.020 . 1 . . . . . 175 ASN HA . 50453 1 1893 . 1 . 1 175 175 ASN HB2 H 1 2.513 0.020 . 2 . . . . . 175 ASN HB2 . 50453 1 1894 . 1 . 1 175 175 ASN HB3 H 1 2.628 0.020 . 2 . . . . . 175 ASN HB3 . 50453 1 1895 . 1 . 1 175 175 ASN C C 13 173.749 0.3 . 1 . . . . . 175 ASN C . 50453 1 1896 . 1 . 1 175 175 ASN CA C 13 52.116 0.3 . 1 . . . . . 175 ASN CA . 50453 1 1897 . 1 . 1 175 175 ASN CB C 13 39.978 0.3 . 1 . . . . . 175 ASN CB . 50453 1 1898 . 1 . 1 175 175 ASN N N 15 125.222 0.3 . 1 . . . . . 175 ASN N . 50453 1 1899 . 1 . 1 176 176 ILE H H 1 9.126 0.020 . 1 . . . . . 176 ILE H . 50453 1 1900 . 1 . 1 176 176 ILE HA H 1 5.220 0.020 . 1 . . . . . 176 ILE HA . 50453 1 1901 . 1 . 1 176 176 ILE HB H 1 1.759 0.020 . 1 . . . . . 176 ILE HB . 50453 1 1902 . 1 . 1 176 176 ILE HG12 H 1 1.188 0.020 . 2 . . . . . 176 ILE HG12 . 50453 1 1903 . 1 . 1 176 176 ILE HG13 H 1 1.389 0.020 . 2 . . . . . 176 ILE HG13 . 50453 1 1904 . 1 . 1 176 176 ILE HG21 H 1 0.839 0.020 . 1 . . . . . 176 ILE HG2 . 50453 1 1905 . 1 . 1 176 176 ILE HG22 H 1 0.839 0.020 . 1 . . . . . 176 ILE HG2 . 50453 1 1906 . 1 . 1 176 176 ILE HG23 H 1 0.839 0.020 . 1 . . . . . 176 ILE HG2 . 50453 1 1907 . 1 . 1 176 176 ILE HD11 H 1 0.835 0.020 . 1 . . . . . 176 ILE HD1 . 50453 1 1908 . 1 . 1 176 176 ILE HD12 H 1 0.835 0.020 . 1 . . . . . 176 ILE HD1 . 50453 1 1909 . 1 . 1 176 176 ILE HD13 H 1 0.835 0.020 . 1 . . . . . 176 ILE HD1 . 50453 1 1910 . 1 . 1 176 176 ILE C C 13 174.799 0.3 . 1 . . . . . 176 ILE C . 50453 1 1911 . 1 . 1 176 176 ILE CA C 13 58.399 0.3 . 1 . . . . . 176 ILE CA . 50453 1 1912 . 1 . 1 176 176 ILE CB C 13 42.286 0.3 . 1 . . . . . 176 ILE CB . 50453 1 1913 . 1 . 1 176 176 ILE CG1 C 13 28.841 0.3 . 1 . . . . . 176 ILE CG1 . 50453 1 1914 . 1 . 1 176 176 ILE CG2 C 13 18.287 0.3 . 1 . . . . . 176 ILE CG2 . 50453 1 1915 . 1 . 1 176 176 ILE CD1 C 13 15.338 0.3 . 1 . . . . . 176 ILE CD1 . 50453 1 1916 . 1 . 1 176 176 ILE N N 15 128.924 0.3 . 1 . . . . . 176 ILE N . 50453 1 1917 . 1 . 1 177 177 GLN H H 1 9.967 0.020 . 1 . . . . . 177 GLN H . 50453 1 1918 . 1 . 1 177 177 GLN HA H 1 4.941 0.020 . 1 . . . . . 177 GLN HA . 50453 1 1919 . 1 . 1 177 177 GLN HB2 H 1 2.138 0.020 . 1 . . . . . 177 GLN HB2 . 50453 1 1920 . 1 . 1 177 177 GLN HB3 H 1 2.138 0.020 . 1 . . . . . 177 GLN HB3 . 50453 1 1921 . 1 . 1 177 177 GLN HG2 H 1 2.395 0.020 . 2 . . . . . 177 GLN HG2 . 50453 1 1922 . 1 . 1 177 177 GLN HG3 H 1 2.423 0.020 . 2 . . . . . 177 GLN HG3 . 50453 1 1923 . 1 . 1 177 177 GLN C C 13 174.904 0.3 . 1 . . . . . 177 GLN C . 50453 1 1924 . 1 . 1 177 177 GLN CA C 13 55.021 0.3 . 1 . . . . . 177 GLN CA . 50453 1 1925 . 1 . 1 177 177 GLN CB C 13 29.793 0.3 . 1 . . . . . 177 GLN CB . 50453 1 1926 . 1 . 1 177 177 GLN CG C 13 33.753 0.3 . 1 . . . . . 177 GLN CG . 50453 1 1927 . 1 . 1 177 177 GLN N N 15 128.341 0.3 . 1 . . . . . 177 GLN N . 50453 1 1928 . 1 . 1 178 178 ARG H H 1 8.945 0.020 . 1 . . . . . 178 ARG H . 50453 1 1929 . 1 . 1 178 178 ARG HA H 1 4.755 0.020 . 1 . . . . . 178 ARG HA . 50453 1 1930 . 1 . 1 178 178 ARG HB2 H 1 1.833 0.020 . 1 . . . . . 178 ARG HB2 . 50453 1 1931 . 1 . 1 178 178 ARG HB3 H 1 1.833 0.020 . 1 . . . . . 178 ARG HB3 . 50453 1 1932 . 1 . 1 178 178 ARG HG2 H 1 1.832 0.020 . 1 . . . . . 178 ARG HG2 . 50453 1 1933 . 1 . 1 178 178 ARG HG3 H 1 1.832 0.020 . 1 . . . . . 178 ARG HG3 . 50453 1 1934 . 1 . 1 178 178 ARG HD2 H 1 3.026 0.020 . 2 . . . . . 178 ARG HD2 . 50453 1 1935 . 1 . 1 178 178 ARG HD3 H 1 3.379 0.020 . 2 . . . . . 178 ARG HD3 . 50453 1 1936 . 1 . 1 178 178 ARG C C 13 175.906 0.3 . 1 . . . . . 178 ARG C . 50453 1 1937 . 1 . 1 178 178 ARG CA C 13 55.078 0.3 . 1 . . . . . 178 ARG CA . 50453 1 1938 . 1 . 1 178 178 ARG CB C 13 31.757 0.3 . 1 . . . . . 178 ARG CB . 50453 1 1939 . 1 . 1 178 178 ARG CG C 13 27.299 0.3 . 1 . . . . . 178 ARG CG . 50453 1 1940 . 1 . 1 178 178 ARG CD C 13 43.756 0.3 . 1 . . . . . 178 ARG CD . 50453 1 1941 . 1 . 1 178 178 ARG N N 15 134.328 0.3 . 1 . . . . . 178 ARG N . 50453 1 1942 . 1 . 1 179 179 GLY HA2 H 1 3.827 0.020 . 2 . . . . . 179 GLY HA2 . 50453 1 1943 . 1 . 1 179 179 GLY HA3 H 1 4.172 0.020 . 2 . . . . . 179 GLY HA3 . 50453 1 1944 . 1 . 1 179 179 GLY CA C 13 47.422 0.3 . 1 . . . . . 179 GLY CA . 50453 1 1945 . 1 . 1 180 180 ASP HA H 1 4.846 0.020 . 1 . . . . . 180 ASP HA . 50453 1 1946 . 1 . 1 180 180 ASP HB2 H 1 2.861 0.020 . 1 . . . . . 180 ASP HB2 . 50453 1 1947 . 1 . 1 180 180 ASP HB3 H 1 2.861 0.020 . 1 . . . . . 180 ASP HB3 . 50453 1 1948 . 1 . 1 180 180 ASP C C 13 175.927 0.3 . 1 . . . . . 180 ASP C . 50453 1 1949 . 1 . 1 180 180 ASP CA C 13 54.432 0.3 . 1 . . . . . 180 ASP CA . 50453 1 1950 . 1 . 1 180 180 ASP CB C 13 41.112 0.3 . 1 . . . . . 180 ASP CB . 50453 1 1951 . 1 . 1 181 181 SER H H 1 8.164 0.020 . 1 . . . . . 181 SER H . 50453 1 1952 . 1 . 1 181 181 SER HA H 1 4.993 0.020 . 1 . . . . . 181 SER HA . 50453 1 1953 . 1 . 1 181 181 SER HB2 H 1 4.007 0.020 . 1 . . . . . 181 SER HB2 . 50453 1 1954 . 1 . 1 181 181 SER HB3 H 1 4.007 0.020 . 1 . . . . . 181 SER HB3 . 50453 1 1955 . 1 . 1 181 181 SER C C 13 172.829 0.3 . 1 . . . . . 181 SER C . 50453 1 1956 . 1 . 1 181 181 SER CA C 13 57.954 0.3 . 1 . . . . . 181 SER CA . 50453 1 1957 . 1 . 1 181 181 SER CB C 13 66.005 0.3 . 1 . . . . . 181 SER CB . 50453 1 1958 . 1 . 1 181 181 SER N N 15 118.171 0.3 . 1 . . . . . 181 SER N . 50453 1 1959 . 1 . 1 182 182 THR H H 1 8.541 0.020 . 1 . . . . . 182 THR H . 50453 1 1960 . 1 . 1 182 182 THR HA H 1 5.436 0.020 . 1 . . . . . 182 THR HA . 50453 1 1961 . 1 . 1 182 182 THR HB H 1 4.089 0.020 . 1 . . . . . 182 THR HB . 50453 1 1962 . 1 . 1 182 182 THR HG21 H 1 1.162 0.020 . 1 . . . . . 182 THR HG2 . 50453 1 1963 . 1 . 1 182 182 THR HG22 H 1 1.162 0.020 . 1 . . . . . 182 THR HG2 . 50453 1 1964 . 1 . 1 182 182 THR HG23 H 1 1.162 0.020 . 1 . . . . . 182 THR HG2 . 50453 1 1965 . 1 . 1 182 182 THR C C 13 174.267 0.3 . 1 . . . . . 182 THR C . 50453 1 1966 . 1 . 1 182 182 THR CA C 13 61.067 0.3 . 1 . . . . . 182 THR CA . 50453 1 1967 . 1 . 1 182 182 THR CB C 13 70.612 0.3 . 1 . . . . . 182 THR CB . 50453 1 1968 . 1 . 1 182 182 THR CG2 C 13 21.950 0.3 . 1 . . . . . 182 THR CG2 . 50453 1 1969 . 1 . 1 182 182 THR N N 15 120.011 0.3 . 1 . . . . . 182 THR N . 50453 1 1970 . 1 . 1 183 183 ILE H H 1 9.486 0.020 . 1 . . . . . 183 ILE H . 50453 1 1971 . 1 . 1 183 183 ILE HA H 1 4.785 0.020 . 1 . . . . . 183 ILE HA . 50453 1 1972 . 1 . 1 183 183 ILE HB H 1 1.975 0.020 . 1 . . . . . 183 ILE HB . 50453 1 1973 . 1 . 1 183 183 ILE HG12 H 1 1.089 0.020 . 2 . . . . . 183 ILE HG12 . 50453 1 1974 . 1 . 1 183 183 ILE HG13 H 1 1.330 0.020 . 2 . . . . . 183 ILE HG13 . 50453 1 1975 . 1 . 1 183 183 ILE HD11 H 1 0.844 0.020 . 1 . . . . . 183 ILE HD1 . 50453 1 1976 . 1 . 1 183 183 ILE HD12 H 1 0.844 0.020 . 1 . . . . . 183 ILE HD1 . 50453 1 1977 . 1 . 1 183 183 ILE HD13 H 1 0.844 0.020 . 1 . . . . . 183 ILE HD1 . 50453 1 1978 . 1 . 1 183 183 ILE C C 13 174.051 0.3 . 1 . . . . . 183 ILE C . 50453 1 1979 . 1 . 1 183 183 ILE CA C 13 59.497 0.3 . 1 . . . . . 183 ILE CA . 50453 1 1980 . 1 . 1 183 183 ILE CB C 13 42.430 0.3 . 1 . . . . . 183 ILE CB . 50453 1 1981 . 1 . 1 183 183 ILE CG1 C 13 27.079 0.3 . 1 . . . . . 183 ILE CG1 . 50453 1 1982 . 1 . 1 183 183 ILE CG2 C 13 17.646 0.3 . 1 . . . . . 183 ILE CG2 . 50453 1 1983 . 1 . 1 183 183 ILE CD1 C 13 14.233 0.3 . 1 . . . . . 183 ILE CD1 . 50453 1 1984 . 1 . 1 183 183 ILE N N 15 124.978 0.3 . 1 . . . . . 183 ILE N . 50453 1 1985 . 1 . 1 184 184 TYR H H 1 8.653 0.020 . 1 . . . . . 184 TYR H . 50453 1 1986 . 1 . 1 184 184 TYR HA H 1 5.751 0.020 . 1 . . . . . 184 TYR HA . 50453 1 1987 . 1 . 1 184 184 TYR HB2 H 1 2.925 0.020 . 1 . . . . . 184 TYR HB2 . 50453 1 1988 . 1 . 1 184 184 TYR HB3 H 1 2.925 0.020 . 1 . . . . . 184 TYR HB3 . 50453 1 1989 . 1 . 1 184 184 TYR C C 13 175.462 0.3 . 1 . . . . . 184 TYR C . 50453 1 1990 . 1 . 1 184 184 TYR CA C 13 56.751 0.3 . 1 . . . . . 184 TYR CA . 50453 1 1991 . 1 . 1 184 184 TYR CB C 13 41.122 0.3 . 1 . . . . . 184 TYR CB . 50453 1 1992 . 1 . 1 184 184 TYR N N 15 125.227 0.3 . 1 . . . . . 184 TYR N . 50453 1 1993 . 1 . 1 185 185 LEU H H 1 8.992 0.020 . 1 . . . . . 185 LEU H . 50453 1 1994 . 1 . 1 185 185 LEU HA H 1 4.835 0.020 . 1 . . . . . 185 LEU HA . 50453 1 1995 . 1 . 1 185 185 LEU HB2 H 1 1.394 0.020 . 2 . . . . . 185 LEU HB2 . 50453 1 1996 . 1 . 1 185 185 LEU HB3 H 1 1.633 0.020 . 2 . . . . . 185 LEU HB3 . 50453 1 1997 . 1 . 1 185 185 LEU HG H 1 1.591 0.020 . 1 . . . . . 185 LEU HG . 50453 1 1998 . 1 . 1 185 185 LEU HD11 H 1 0.903 0.020 . 2 . . . . . 185 LEU HD1 . 50453 1 1999 . 1 . 1 185 185 LEU HD12 H 1 0.903 0.020 . 2 . . . . . 185 LEU HD1 . 50453 1 2000 . 1 . 1 185 185 LEU HD13 H 1 0.903 0.020 . 2 . . . . . 185 LEU HD1 . 50453 1 2001 . 1 . 1 185 185 LEU HD21 H 1 0.889 0.020 . 2 . . . . . 185 LEU HD2 . 50453 1 2002 . 1 . 1 185 185 LEU HD22 H 1 0.889 0.020 . 2 . . . . . 185 LEU HD2 . 50453 1 2003 . 1 . 1 185 185 LEU HD23 H 1 0.889 0.020 . 2 . . . . . 185 LEU HD2 . 50453 1 2004 . 1 . 1 185 185 LEU C C 13 175.287 0.3 . 1 . . . . . 185 LEU C . 50453 1 2005 . 1 . 1 185 185 LEU CA C 13 53.593 0.3 . 1 . . . . . 185 LEU CA . 50453 1 2006 . 1 . 1 185 185 LEU CB C 13 44.792 0.3 . 1 . . . . . 185 LEU CB . 50453 1 2007 . 1 . 1 185 185 LEU CG C 13 26.927 0.3 . 1 . . . . . 185 LEU CG . 50453 1 2008 . 1 . 1 185 185 LEU CD1 C 13 24.199 0.3 . 1 . . . . . 185 LEU CD1 . 50453 1 2009 . 1 . 1 185 185 LEU CD2 C 13 24.613 0.3 . 1 . . . . . 185 LEU CD2 . 50453 1 2010 . 1 . 1 185 185 LEU N N 15 125.949 0.3 . 1 . . . . . 185 LEU N . 50453 1 2011 . 1 . 1 186 186 LEU H H 1 8.673 0.020 . 1 . . . . . 186 LEU H . 50453 1 2012 . 1 . 1 186 186 LEU HA H 1 5.130 0.020 . 1 . . . . . 186 LEU HA . 50453 1 2013 . 1 . 1 186 186 LEU HB2 H 1 1.564 0.020 . 2 . . . . . 186 LEU HB2 . 50453 1 2014 . 1 . 1 186 186 LEU HB3 H 1 1.644 0.020 . 2 . . . . . 186 LEU HB3 . 50453 1 2015 . 1 . 1 186 186 LEU HG H 1 1.585 0.020 . 1 . . . . . 186 LEU HG . 50453 1 2016 . 1 . 1 186 186 LEU HD11 H 1 1.085 0.020 . 2 . . . . . 186 LEU HD1 . 50453 1 2017 . 1 . 1 186 186 LEU HD12 H 1 1.085 0.020 . 2 . . . . . 186 LEU HD1 . 50453 1 2018 . 1 . 1 186 186 LEU HD13 H 1 1.085 0.020 . 2 . . . . . 186 LEU HD1 . 50453 1 2019 . 1 . 1 186 186 LEU HD21 H 1 0.978 0.020 . 2 . . . . . 186 LEU HD2 . 50453 1 2020 . 1 . 1 186 186 LEU HD22 H 1 0.978 0.020 . 2 . . . . . 186 LEU HD2 . 50453 1 2021 . 1 . 1 186 186 LEU HD23 H 1 0.978 0.020 . 2 . . . . . 186 LEU HD2 . 50453 1 2022 . 1 . 1 186 186 LEU C C 13 176.156 0.3 . 1 . . . . . 186 LEU C . 50453 1 2023 . 1 . 1 186 186 LEU CA C 13 54.299 0.3 . 1 . . . . . 186 LEU CA . 50453 1 2024 . 1 . 1 186 186 LEU CB C 13 44.956 0.3 . 1 . . . . . 186 LEU CB . 50453 1 2025 . 1 . 1 186 186 LEU CG C 13 27.123 0.3 . 1 . . . . . 186 LEU CG . 50453 1 2026 . 1 . 1 186 186 LEU CD1 C 13 22.643 0.3 . 1 . . . . . 186 LEU CD1 . 50453 1 2027 . 1 . 1 186 186 LEU CD2 C 13 24.632 0.3 . 1 . . . . . 186 LEU CD2 . 50453 1 2028 . 1 . 1 186 186 LEU N N 15 126.129 0.3 . 1 . . . . . 186 LEU N . 50453 1 2029 . 1 . 1 187 187 MET H H 1 9.143 0.020 . 1 . . . . . 187 MET H . 50453 1 2030 . 1 . 1 187 187 MET HA H 1 4.730 0.020 . 1 . . . . . 187 MET HA . 50453 1 2031 . 1 . 1 187 187 MET HB2 H 1 2.493 0.020 . 2 . . . . . 187 MET HB2 . 50453 1 2032 . 1 . 1 187 187 MET HB3 H 1 2.549 0.020 . 2 . . . . . 187 MET HB3 . 50453 1 2033 . 1 . 1 187 187 MET HG2 H 1 2.621 0.020 . 1 . . . . . 187 MET HG2 . 50453 1 2034 . 1 . 1 187 187 MET HG3 H 1 2.621 0.020 . 1 . . . . . 187 MET HG3 . 50453 1 2035 . 1 . 1 187 187 MET C C 13 174.083 0.3 . 1 . . . . . 187 MET C . 50453 1 2036 . 1 . 1 187 187 MET CA C 13 55.785 0.3 . 1 . . . . . 187 MET CA . 50453 1 2037 . 1 . 1 187 187 MET CB C 13 33.990 0.3 . 1 . . . . . 187 MET CB . 50453 1 2038 . 1 . 1 187 187 MET CG C 13 32.435 0.3 . 1 . . . . . 187 MET CG . 50453 1 2039 . 1 . 1 187 187 MET N N 15 126.886 0.3 . 1 . . . . . 187 MET N . 50453 1 2040 . 1 . 1 188 188 GLN H H 1 8.100 0.020 . 1 . . . . . 188 GLN H . 50453 1 2041 . 1 . 1 188 188 GLN HA H 1 4.563 0.020 . 1 . . . . . 188 GLN HA . 50453 1 2042 . 1 . 1 188 188 GLN HB2 H 1 2.159 0.020 . 2 . . . . . 188 GLN HB2 . 50453 1 2043 . 1 . 1 188 188 GLN HB3 H 1 2.249 0.020 . 2 . . . . . 188 GLN HB3 . 50453 1 2044 . 1 . 1 188 188 GLN HG2 H 1 2.344 0.020 . 1 . . . . . 188 GLN HG2 . 50453 1 2045 . 1 . 1 188 188 GLN HG3 H 1 2.344 0.020 . 1 . . . . . 188 GLN HG3 . 50453 1 2046 . 1 . 1 188 188 GLN C C 13 179.634 0.3 . 1 . . . . . 188 GLN C . 50453 1 2047 . 1 . 1 188 188 GLN CA C 13 57.150 0.3 . 1 . . . . . 188 GLN CA . 50453 1 2048 . 1 . 1 188 188 GLN CB C 13 31.367 0.3 . 1 . . . . . 188 GLN CB . 50453 1 2049 . 1 . 1 188 188 GLN CG C 13 34.090 0.3 . 1 . . . . . 188 GLN CG . 50453 1 2050 . 1 . 1 188 188 GLN N N 15 130.893 0.3 . 1 . . . . . 188 GLN N . 50453 1 stop_ save_