data_15275 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15275 _Entry.Title ; Soution Structure of Af54 M-domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-05-31 _Entry.Accession_date 2007-05-31 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.100 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Udayar Ilangovan . . . 15275 2 Andrew Hinck . P. . 15275 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID af54 . 15275 'nmr structure' . 15275 solution . 15275 srp54 . 15275 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15275 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 397 15275 '15N chemical shifts' 90 15275 '1H chemical shifts' 594 15275 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 . . 2008-09-11 2007-05-31 update BMRB 'complete entry citation' 15275 1 . . 2008-07-15 2007-05-31 original author 'original release' 15275 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2JQE 'BMRB Entry Tracking System' 15275 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15275 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18618268 _Citation.Full_citation . _Citation.Title 'A. fulgidus SRP54 M-domain' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of Biomolecular NMR' _Citation.Journal_volume 41 _Citation.Journal_issue 4 _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 241 _Citation.Page_last 248 _Citation.Year 2008 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Udayar Ilangovan . . . 15275 1 2 Shakhawat Bhuiyan . H. . 15275 1 3 Cynthia Hinck . S. . 15275 1 4 Jeffrey Hoyle . T. . 15275 1 5 Olga Pakhomova . N. . 15275 1 6 Christian Zwieb . . . 15275 1 7 Andrew Hinck . P. . 15275 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID af54 15275 1 dynamics 15275 1 NMR 15275 1 protein 15275 1 solution 15275 1 srp54 15275 1 structure 15275 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15275 _Assembly.ID 1 _Assembly.Name 'srp54 of archaeoglobus fulgius' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 srp54 1 $af54 A . yes native no no . . . 15275 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_af54 _Entity.Sf_category entity _Entity.Sf_framecode af54 _Entity.Entry_ID 15275 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name af54 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MEKGTFTLKDIYKQIEAMNK MGPVRKIFEMLPFGLGLKVD NDVMEMTQEKMKKFRVIMDS MTEEELLNPKIIDSSRIRRI AIGSGTSPQEVKELLNYYKT MKNLMKKMKKNKLPI ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 311-415 _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 115 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'SRP54 M-domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 no PDB 2JQE . "Soution Structure Of Af54 M-Domain" . . . . . 100.00 119 100.00 100.00 3.95e-74 . . . . 15275 1 2 no GB AAB90619 . "signal recognition particle, subunit SRP54 (srp54) [Archaeoglobus fulgidus DSM 4304]" . . . . . 98.26 433 100.00 100.00 1.68e-70 . . . . 15275 1 3 no GB AIG97502 . "Signal recognition particle GTPase [Archaeoglobus fulgidus DSM 8774]" . . . . . 98.26 433 100.00 100.00 1.68e-70 . . . . 15275 1 4 no REF WP_010878126 . "signal recognition particle [Archaeoglobus fulgidus]" . . . . . 98.26 433 100.00 100.00 1.68e-70 . . . . 15275 1 5 no SP O29633 . "RecName: Full=Signal recognition particle 54 kDa protein; Short=SRP54" . . . . . 98.26 433 100.00 100.00 1.68e-70 . . . . 15275 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'RNA binding' 15275 1 'signal peptide binding' 15275 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 1 311 MET . 15275 1 2 312 GLU . 15275 1 3 313 LYS . 15275 1 4 314 GLY . 15275 1 5 315 THR . 15275 1 6 316 PHE . 15275 1 7 317 THR . 15275 1 8 318 LEU . 15275 1 9 319 LYS . 15275 1 10 320 ASP . 15275 1 11 321 ILE . 15275 1 12 322 TYR . 15275 1 13 323 LYS . 15275 1 14 324 GLN . 15275 1 15 325 ILE . 15275 1 16 326 GLU . 15275 1 17 327 ALA . 15275 1 18 328 MET . 15275 1 19 329 ASN . 15275 1 20 330 LYS . 15275 1 21 331 MET . 15275 1 22 332 GLY . 15275 1 23 333 PRO . 15275 1 24 334 VAL . 15275 1 25 335 ARG . 15275 1 26 336 LYS . 15275 1 27 337 ILE . 15275 1 28 338 PHE . 15275 1 29 339 GLU . 15275 1 30 340 MET . 15275 1 31 341 LEU . 15275 1 32 342 PRO . 15275 1 33 343 PHE . 15275 1 34 344 GLY . 15275 1 35 345 LEU . 15275 1 36 346 GLY . 15275 1 37 347 LEU . 15275 1 38 348 LYS . 15275 1 39 349 VAL . 15275 1 40 350 ASP . 15275 1 41 351 ASN . 15275 1 42 352 ASP . 15275 1 43 353 VAL . 15275 1 44 354 MET . 15275 1 45 355 GLU . 15275 1 46 356 MET . 15275 1 47 357 THR . 15275 1 48 358 GLN . 15275 1 49 359 GLU . 15275 1 50 360 LYS . 15275 1 51 361 MET . 15275 1 52 362 LYS . 15275 1 53 363 LYS . 15275 1 54 364 PHE . 15275 1 55 365 ARG . 15275 1 56 366 VAL . 15275 1 57 367 ILE . 15275 1 58 368 MET . 15275 1 59 369 ASP . 15275 1 60 370 SER . 15275 1 61 371 MET . 15275 1 62 372 THR . 15275 1 63 373 GLU . 15275 1 64 374 GLU . 15275 1 65 375 GLU . 15275 1 66 376 LEU . 15275 1 67 377 LEU . 15275 1 68 378 ASN . 15275 1 69 379 PRO . 15275 1 70 380 LYS . 15275 1 71 381 ILE . 15275 1 72 382 ILE . 15275 1 73 383 ASP . 15275 1 74 384 SER . 15275 1 75 385 SER . 15275 1 76 386 ARG . 15275 1 77 387 ILE . 15275 1 78 388 ARG . 15275 1 79 389 ARG . 15275 1 80 390 ILE . 15275 1 81 391 ALA . 15275 1 82 392 ILE . 15275 1 83 393 GLY . 15275 1 84 394 SER . 15275 1 85 395 GLY . 15275 1 86 396 THR . 15275 1 87 397 SER . 15275 1 88 398 PRO . 15275 1 89 399 GLN . 15275 1 90 400 GLU . 15275 1 91 401 VAL . 15275 1 92 402 LYS . 15275 1 93 403 GLU . 15275 1 94 404 LEU . 15275 1 95 405 LEU . 15275 1 96 406 ASN . 15275 1 97 407 TYR . 15275 1 98 408 TYR . 15275 1 99 409 LYS . 15275 1 100 410 THR . 15275 1 101 411 MET . 15275 1 102 412 LYS . 15275 1 103 413 ASN . 15275 1 104 414 LEU . 15275 1 105 415 MET . 15275 1 106 416 LYS . 15275 1 107 417 LYS . 15275 1 108 418 MET . 15275 1 109 419 LYS . 15275 1 110 420 LYS . 15275 1 111 421 ASN . 15275 1 112 422 LYS . 15275 1 113 423 LEU . 15275 1 114 424 PRO . 15275 1 115 425 ILE . 15275 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 15275 1 . GLU 2 2 15275 1 . LYS 3 3 15275 1 . GLY 4 4 15275 1 . THR 5 5 15275 1 . PHE 6 6 15275 1 . THR 7 7 15275 1 . LEU 8 8 15275 1 . LYS 9 9 15275 1 . ASP 10 10 15275 1 . ILE 11 11 15275 1 . TYR 12 12 15275 1 . LYS 13 13 15275 1 . GLN 14 14 15275 1 . ILE 15 15 15275 1 . GLU 16 16 15275 1 . ALA 17 17 15275 1 . MET 18 18 15275 1 . ASN 19 19 15275 1 . LYS 20 20 15275 1 . MET 21 21 15275 1 . GLY 22 22 15275 1 . PRO 23 23 15275 1 . VAL 24 24 15275 1 . ARG 25 25 15275 1 . LYS 26 26 15275 1 . ILE 27 27 15275 1 . PHE 28 28 15275 1 . GLU 29 29 15275 1 . MET 30 30 15275 1 . LEU 31 31 15275 1 . PRO 32 32 15275 1 . PHE 33 33 15275 1 . GLY 34 34 15275 1 . LEU 35 35 15275 1 . GLY 36 36 15275 1 . LEU 37 37 15275 1 . LYS 38 38 15275 1 . VAL 39 39 15275 1 . ASP 40 40 15275 1 . ASN 41 41 15275 1 . ASP 42 42 15275 1 . VAL 43 43 15275 1 . MET 44 44 15275 1 . GLU 45 45 15275 1 . MET 46 46 15275 1 . THR 47 47 15275 1 . GLN 48 48 15275 1 . GLU 49 49 15275 1 . LYS 50 50 15275 1 . MET 51 51 15275 1 . LYS 52 52 15275 1 . LYS 53 53 15275 1 . PHE 54 54 15275 1 . ARG 55 55 15275 1 . VAL 56 56 15275 1 . ILE 57 57 15275 1 . MET 58 58 15275 1 . ASP 59 59 15275 1 . SER 60 60 15275 1 . MET 61 61 15275 1 . THR 62 62 15275 1 . GLU 63 63 15275 1 . GLU 64 64 15275 1 . GLU 65 65 15275 1 . LEU 66 66 15275 1 . LEU 67 67 15275 1 . ASN 68 68 15275 1 . PRO 69 69 15275 1 . LYS 70 70 15275 1 . ILE 71 71 15275 1 . ILE 72 72 15275 1 . ASP 73 73 15275 1 . SER 74 74 15275 1 . SER 75 75 15275 1 . ARG 76 76 15275 1 . ILE 77 77 15275 1 . ARG 78 78 15275 1 . ARG 79 79 15275 1 . ILE 80 80 15275 1 . ALA 81 81 15275 1 . ILE 82 82 15275 1 . GLY 83 83 15275 1 . SER 84 84 15275 1 . GLY 85 85 15275 1 . THR 86 86 15275 1 . SER 87 87 15275 1 . PRO 88 88 15275 1 . GLN 89 89 15275 1 . GLU 90 90 15275 1 . VAL 91 91 15275 1 . LYS 92 92 15275 1 . GLU 93 93 15275 1 . LEU 94 94 15275 1 . LEU 95 95 15275 1 . ASN 96 96 15275 1 . TYR 97 97 15275 1 . TYR 98 98 15275 1 . LYS 99 99 15275 1 . THR 100 100 15275 1 . MET 101 101 15275 1 . LYS 102 102 15275 1 . ASN 103 103 15275 1 . LEU 104 104 15275 1 . MET 105 105 15275 1 . LYS 106 106 15275 1 . LYS 107 107 15275 1 . MET 108 108 15275 1 . LYS 109 109 15275 1 . LYS 110 110 15275 1 . ASN 111 111 15275 1 . LYS 112 112 15275 1 . LEU 113 113 15275 1 . PRO 114 114 15275 1 . ILE 115 115 15275 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15275 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $af54 . 2234 organism . 'Archaeoglobus fulgidus' . . . Archaea . Archaeoglobus fulgidus . . . . . . . . . . . . . . . . . . . . . 15275 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 15275 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $af54 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pLysS . . . . . . 15275 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15275 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N_af54 sample in 25 mM sodium phosphate, 0.02% (w/v) sodium azide, pH 5.5, 0.5 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 af54 '[U-95% 15N]' . . 1 $af54 . . 0.5 . . mM 0.05 . . . 15275 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 15275 1 3 'sodium azide' 'natural abundance' . . . . . . 0.02 . . '% (w/v)' . . . . 15275 1 4 H2O 'natural abundance' . . . . . . 95 . . % . . . . 15275 1 5 D2O . . . . . . . 5 . . % . . . . 15275 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15275 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C,15N_af54 sample in 25 mM sodium phosphate, 0.02% (w/v) sodium azide, pH 5.5, 0.5 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 af54 '[U-95% 13C; U-95% 15N]' . . 1 $af54 . . 0.5 . . mM 0.05 . . . 15275 2 2 af54 '[U-95% 15N]' . . . . . . 0.5 . . mM 0.05 . . . 15275 2 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 15275 2 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . '% (w/v)' . . . . 15275 2 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 15275 2 6 D2O . . . . . . . 5 . . % . . . . 15275 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15275 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M 15275 1 pH 5.5 0.05 pH 15275 1 pressure 1 . atm 15275 1 temperature 300 0.2 K 15275 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 15275 _Sample_condition_list.ID 2 _Sample_condition_list.Details '5% poly acrylamide gel stretched (6.0 mm --> 4.2 mm) for RDC mesurement' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M 15275 2 pH 5.5 0.05 pH 15275 2 pressure 1 . atm 15275 2 temperature 300 0.2 K 15275 2 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 15275 _Software.ID 1 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 15275 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15275 1 'data analysis' 15275 1 'peak picking' 15275 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15275 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15275 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15275 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 15275 _Software.ID 3 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15275 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Spectral Visualization' 15275 3 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 15275 _Software.ID 4 _Software.Name 'X-PLOR NIH' _Software.Version 2.9.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 15275 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15275 4 'structure solution' 15275 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15275 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15275 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with cryo probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15275 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 15275 1 2 spectrometer_2 Bruker DRX . 600 'equipped with cryo probe' . . 15275 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15275 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 2 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15275 1 3 '3D HNHB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 6 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 8 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15275 1 11 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15275 1 12 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15275 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15275 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 'separate tube (no insert) not similar to the experimental sample tube' cylindrical parallel . . . . . . 15275 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) not similar to the experimental sample tube' cylindrical parallel . . temperature . . . 15275 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 'separate tube (no insert) not similar to the experimental sample tube' cylindrical parallel . . . . . . 15275 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15275 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15275 1 2 '3D HNHA' . . . 15275 1 3 '3D HNHB' . . . 15275 1 5 '2D 1H-13C HSQC' . . . 15275 1 6 '3D HNCACB' . . . 15275 1 7 '3D CBCA(CO)NH' . . . 15275 1 8 '3D C(CO)NH' . . . 15275 1 9 '3D HCCH-TOCSY' . . . 15275 1 11 '3D HNCO' . . . 15275 1 12 '3D HN(CA)CO' . . . 15275 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 $NMRView . . 15275 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.47 0.03 . 1 . . . . 311 MET HA . 15275 1 2 . 1 1 1 1 MET C C 13 176.15 0.1 . 1 . . . . 311 MET C . 15275 1 3 . 1 1 1 1 MET CA C 13 55.65 0.1 . 1 . . . . 311 MET CA . 15275 1 4 . 1 1 1 1 MET CB C 13 32.95 0.1 . 1 . . . . 311 MET CB . 15275 1 5 . 1 1 1 1 MET N N 15 122.72 0.1 . 1 . . . . 311 MET N . 15275 1 6 . 1 1 2 2 GLU H H 1 8.41 0.03 . 1 . . . . 312 GLU H . 15275 1 7 . 1 1 2 2 GLU HA H 1 4.33 0.03 . 1 . . . . 312 GLU HA . 15275 1 8 . 1 1 2 2 GLU HB2 H 1 1.79 0.03 . 2 . . . . 312 GLU HB2 . 15275 1 9 . 1 1 2 2 GLU HB3 H 1 1.84 0.03 . 2 . . . . 312 GLU HB3 . 15275 1 10 . 1 1 2 2 GLU C C 13 176.48 0.1 . 1 . . . . 312 GLU C . 15275 1 11 . 1 1 2 2 GLU CA C 13 56.66 0.1 . 1 . . . . 312 GLU CA . 15275 1 12 . 1 1 2 2 GLU CB C 13 30.29 0.1 . 1 . . . . 312 GLU CB . 15275 1 13 . 1 1 2 2 GLU CG C 13 36.16 0.1 . 1 . . . . 312 GLU CG . 15275 1 14 . 1 1 2 2 GLU N N 15 122.70 0.1 . 1 . . . . 312 GLU N . 15275 1 15 . 1 1 3 3 LYS H H 1 8.42 0.03 . 1 . . . . 313 LYS H . 15275 1 16 . 1 1 3 3 LYS HA H 1 4.29 0.03 . 1 . . . . 313 LYS HA . 15275 1 17 . 1 1 3 3 LYS HB2 H 1 1.90 0.03 . 2 . . . . 313 LYS HB2 . 15275 1 18 . 1 1 3 3 LYS HB3 H 1 1.90 0.03 . 2 . . . . 313 LYS HB3 . 15275 1 19 . 1 1 3 3 LYS HE2 H 1 3.00 0.03 . 2 . . . . 313 LYS HE2 . 15275 1 20 . 1 1 3 3 LYS HE3 H 1 3.00 0.03 . 2 . . . . 313 LYS HE3 . 15275 1 21 . 1 1 3 3 LYS C C 13 177.15 0.1 . 1 . . . . 313 LYS C . 15275 1 22 . 1 1 3 3 LYS CA C 13 56.66 0.1 . 1 . . . . 313 LYS CA . 15275 1 23 . 1 1 3 3 LYS CB C 13 33.10 0.1 . 1 . . . . 313 LYS CB . 15275 1 24 . 1 1 3 3 LYS CD C 13 29.09 0.1 . 1 . . . . 313 LYS CD . 15275 1 25 . 1 1 3 3 LYS CE C 13 42.14 0.1 . 1 . . . . 313 LYS CE . 15275 1 26 . 1 1 3 3 LYS CG C 13 24.84 0.1 . 1 . . . . 313 LYS CG . 15275 1 27 . 1 1 3 3 LYS N N 15 122.86 0.1 . 1 . . . . 313 LYS N . 15275 1 28 . 1 1 4 4 GLY H H 1 8.54 0.03 . 1 . . . . 314 GLY H . 15275 1 29 . 1 1 4 4 GLY HA2 H 1 4.00 0.03 . 2 . . . . 314 GLY HA2 . 15275 1 30 . 1 1 4 4 GLY HA3 H 1 4.03 0.03 . 2 . . . . 314 GLY HA3 . 15275 1 31 . 1 1 4 4 GLY C C 13 174.15 0.1 . 1 . . . . 314 GLY C . 15275 1 32 . 1 1 4 4 GLY CA C 13 45.64 0.1 . 1 . . . . 314 GLY CA . 15275 1 33 . 1 1 4 4 GLY N N 15 110.13 0.1 . 1 . . . . 314 GLY N . 15275 1 34 . 1 1 5 5 THR H H 1 7.97 0.03 . 1 . . . . 315 THR H . 15275 1 35 . 1 1 5 5 THR HA H 1 4.42 0.03 . 1 . . . . 315 THR HA . 15275 1 36 . 1 1 5 5 THR HB H 1 4.19 0.03 . 1 . . . . 315 THR HB . 15275 1 37 . 1 1 5 5 THR HG21 H 1 1.22 0.03 . 1 . . . . 315 THR HG2 . 15275 1 38 . 1 1 5 5 THR HG22 H 1 1.22 0.03 . 1 . . . . 315 THR HG2 . 15275 1 39 . 1 1 5 5 THR HG23 H 1 1.22 0.03 . 1 . . . . 315 THR HG2 . 15275 1 40 . 1 1 5 5 THR C C 13 173.43 0.1 . 1 . . . . 315 THR C . 15275 1 41 . 1 1 5 5 THR CA C 13 61.70 0.1 . 1 . . . . 315 THR CA . 15275 1 42 . 1 1 5 5 THR CB C 13 70.50 0.1 . 1 . . . . 315 THR CB . 15275 1 43 . 1 1 5 5 THR CG2 C 13 21.74 0.1 . 1 . . . . 315 THR CG2 . 15275 1 44 . 1 1 5 5 THR N N 15 113.81 0.1 . 1 . . . . 315 THR N . 15275 1 45 . 1 1 6 6 PHE H H 1 8.49 0.03 . 1 . . . . 316 PHE H . 15275 1 46 . 1 1 6 6 PHE HA H 1 5.05 0.03 . 1 . . . . 316 PHE HA . 15275 1 47 . 1 1 6 6 PHE HB2 H 1 2.98 0.03 . 2 . . . . 316 PHE HB2 . 15275 1 48 . 1 1 6 6 PHE HB3 H 1 3.10 0.03 . 2 . . . . 316 PHE HB3 . 15275 1 49 . 1 1 6 6 PHE HD1 H 1 6.74 0.03 . 3 . . . . 316 PHE HD1 . 15275 1 50 . 1 1 6 6 PHE HD2 H 1 6.73 0.03 . 3 . . . . 316 PHE HD2 . 15275 1 51 . 1 1 6 6 PHE HE1 H 1 7.13 0.03 . 3 . . . . 316 PHE HE1 . 15275 1 52 . 1 1 6 6 PHE HE2 H 1 7.13 0.03 . 3 . . . . 316 PHE HE2 . 15275 1 53 . 1 1 6 6 PHE C C 13 175.68 0.1 . 1 . . . . 316 PHE C . 15275 1 54 . 1 1 6 6 PHE CA C 13 58.10 0.1 . 1 . . . . 316 PHE CA . 15275 1 55 . 1 1 6 6 PHE CB C 13 41.02 0.1 . 1 . . . . 316 PHE CB . 15275 1 56 . 1 1 6 6 PHE N N 15 125.09 0.1 . 1 . . . . 316 PHE N . 15275 1 57 . 1 1 7 7 THR H H 1 9.77 0.03 . 1 . . . . 317 THR H . 15275 1 58 . 1 1 7 7 THR HA H 1 4.73 0.03 . 1 . . . . 317 THR HA . 15275 1 59 . 1 1 7 7 THR HB H 1 5.01 0.03 . 1 . . . . 317 THR HB . 15275 1 60 . 1 1 7 7 THR HG21 H 1 1.32 0.03 . 1 . . . . 317 THR HG2 . 15275 1 61 . 1 1 7 7 THR HG22 H 1 1.32 0.03 . 1 . . . . 317 THR HG2 . 15275 1 62 . 1 1 7 7 THR HG23 H 1 1.32 0.03 . 1 . . . . 317 THR HG2 . 15275 1 63 . 1 1 7 7 THR C C 13 175.49 0.1 . 1 . . . . 317 THR C . 15275 1 64 . 1 1 7 7 THR CA C 13 61.78 0.1 . 1 . . . . 317 THR CA . 15275 1 65 . 1 1 7 7 THR CB C 13 71.70 0.1 . 1 . . . . 317 THR CB . 15275 1 66 . 1 1 7 7 THR CG2 C 13 21.31 0.1 . 1 . . . . 317 THR CG2 . 15275 1 67 . 1 1 7 7 THR N N 15 122.29 0.1 . 1 . . . . 317 THR N . 15275 1 68 . 1 1 8 8 LEU H H 1 7.80 0.03 . 1 . . . . 318 LEU H . 15275 1 69 . 1 1 8 8 LEU HA H 1 3.95 0.03 . 1 . . . . 318 LEU HA . 15275 1 70 . 1 1 8 8 LEU HB2 H 1 2.03 0.03 . 2 . . . . 318 LEU HB2 . 15275 1 71 . 1 1 8 8 LEU HB3 H 1 1.61 0.03 . 2 . . . . 318 LEU HB3 . 15275 1 72 . 1 1 8 8 LEU HD11 H 1 0.70 0.03 . 2 . . . . 318 LEU HD1 . 15275 1 73 . 1 1 8 8 LEU HD12 H 1 0.70 0.03 . 2 . . . . 318 LEU HD1 . 15275 1 74 . 1 1 8 8 LEU HD13 H 1 0.70 0.03 . 2 . . . . 318 LEU HD1 . 15275 1 75 . 1 1 8 8 LEU HD21 H 1 0.69 0.03 . 2 . . . . 318 LEU HD2 . 15275 1 76 . 1 1 8 8 LEU HD22 H 1 0.69 0.03 . 2 . . . . 318 LEU HD2 . 15275 1 77 . 1 1 8 8 LEU HD23 H 1 0.69 0.03 . 2 . . . . 318 LEU HD2 . 15275 1 78 . 1 1 8 8 LEU HG H 1 1.00 0.03 . 1 . . . . 318 LEU HG . 15275 1 79 . 1 1 8 8 LEU C C 13 179.40 0.1 . 1 . . . . 318 LEU C . 15275 1 80 . 1 1 8 8 LEU CA C 13 58.12 0.1 . 1 . . . . 318 LEU CA . 15275 1 81 . 1 1 8 8 LEU CB C 13 41.26 0.1 . 1 . . . . 318 LEU CB . 15275 1 82 . 1 1 8 8 LEU CD1 C 13 26.36 0.1 . 1 . . . . 318 LEU CD1 . 15275 1 83 . 1 1 8 8 LEU CD2 C 13 24.48 0.1 . 1 . . . . 318 LEU CD2 . 15275 1 84 . 1 1 8 8 LEU CG C 13 27.73 0.1 . 1 . . . . 318 LEU CG . 15275 1 85 . 1 1 8 8 LEU N N 15 116.97 0.1 . 1 . . . . 318 LEU N . 15275 1 86 . 1 1 9 9 LYS H H 1 7.95 0.03 . 1 . . . . 319 LYS H . 15275 1 87 . 1 1 9 9 LYS HA H 1 3.88 0.03 . 1 . . . . 319 LYS HA . 15275 1 88 . 1 1 9 9 LYS HB2 H 1 1.55 0.03 . 2 . . . . 319 LYS HB2 . 15275 1 89 . 1 1 9 9 LYS HB3 H 1 1.74 0.03 . 2 . . . . 319 LYS HB3 . 15275 1 90 . 1 1 9 9 LYS HE2 H 1 2.89 0.03 . 2 . . . . 319 LYS HE2 . 15275 1 91 . 1 1 9 9 LYS HE3 H 1 2.89 0.03 . 2 . . . . 319 LYS HE3 . 15275 1 92 . 1 1 9 9 LYS C C 13 178.79 0.1 . 1 . . . . 319 LYS C . 15275 1 93 . 1 1 9 9 LYS CA C 13 59.40 0.1 . 1 . . . . 319 LYS CA . 15275 1 94 . 1 1 9 9 LYS CB C 13 31.51 0.1 . 1 . . . . 319 LYS CB . 15275 1 95 . 1 1 9 9 LYS CD C 13 29.17 0.1 . 1 . . . . 319 LYS CD . 15275 1 96 . 1 1 9 9 LYS CE C 13 41.56 0.1 . 1 . . . . 319 LYS CE . 15275 1 97 . 1 1 9 9 LYS CG C 13 26.21 0.1 . 1 . . . . 319 LYS CG . 15275 1 98 . 1 1 9 9 LYS N N 15 118.06 0.1 . 1 . . . . 319 LYS N . 15275 1 99 . 1 1 10 10 ASP H H 1 7.17 0.03 . 1 . . . . 320 ASP H . 15275 1 100 . 1 1 10 10 ASP HA H 1 4.35 0.03 . 1 . . . . 320 ASP HA . 15275 1 101 . 1 1 10 10 ASP HB2 H 1 2.49 0.03 . 2 . . . . 320 ASP HB2 . 15275 1 102 . 1 1 10 10 ASP HB3 H 1 2.42 0.03 . 2 . . . . 320 ASP HB3 . 15275 1 103 . 1 1 10 10 ASP C C 13 178.85 0.1 . 1 . . . . 320 ASP C . 15275 1 104 . 1 1 10 10 ASP CA C 13 58.10 0.1 . 1 . . . . 320 ASP CA . 15275 1 105 . 1 1 10 10 ASP CB C 13 41.75 0.1 . 1 . . . . 320 ASP CB . 15275 1 106 . 1 1 10 10 ASP N N 15 117.26 0.1 . 1 . . . . 320 ASP N . 15275 1 107 . 1 1 11 11 ILE H H 1 7.00 0.03 . 1 . . . . 321 ILE H . 15275 1 108 . 1 1 11 11 ILE HA H 1 3.97 0.03 . 1 . . . . 321 ILE HA . 15275 1 109 . 1 1 11 11 ILE HB H 1 2.36 0.03 . 1 . . . . 321 ILE HB . 15275 1 110 . 1 1 11 11 ILE HD11 H 1 1.13 0.03 . 1 . . . . 321 ILE HD1 . 15275 1 111 . 1 1 11 11 ILE HD12 H 1 1.13 0.03 . 1 . . . . 321 ILE HD1 . 15275 1 112 . 1 1 11 11 ILE HD13 H 1 1.13 0.03 . 1 . . . . 321 ILE HD1 . 15275 1 113 . 1 1 11 11 ILE HG21 H 1 1.09 0.03 . 1 . . . . 321 ILE HG2 . 15275 1 114 . 1 1 11 11 ILE HG22 H 1 1.09 0.03 . 1 . . . . 321 ILE HG2 . 15275 1 115 . 1 1 11 11 ILE HG23 H 1 1.09 0.03 . 1 . . . . 321 ILE HG2 . 15275 1 116 . 1 1 11 11 ILE C C 13 178.19 0.1 . 1 . . . . 321 ILE C . 15275 1 117 . 1 1 11 11 ILE CA C 13 62.80 0.1 . 1 . . . . 321 ILE CA . 15275 1 118 . 1 1 11 11 ILE CB C 13 38.16 0.1 . 1 . . . . 321 ILE CB . 15275 1 119 . 1 1 11 11 ILE CD1 C 13 11.98 0.1 . 1 . . . . 321 ILE CD1 . 15275 1 120 . 1 1 11 11 ILE CG2 C 13 17.35 0.1 . 1 . . . . 321 ILE CG2 . 15275 1 121 . 1 1 11 11 ILE N N 15 119.34 0.1 . 1 . . . . 321 ILE N . 15275 1 122 . 1 1 12 12 TYR HD1 H 1 7.15 0.03 . 3 . . . . 322 TYR HD1 . 15275 1 123 . 1 1 12 12 TYR HD2 H 1 7.15 0.03 . 3 . . . . 322 TYR HD2 . 15275 1 124 . 1 1 12 12 TYR HE1 H 1 6.83 0.03 . 3 . . . . 322 TYR HE1 . 15275 1 125 . 1 1 12 12 TYR HE2 H 1 6.83 0.03 . 3 . . . . 322 TYR HE2 . 15275 1 126 . 1 1 12 12 TYR C C 13 178.18 0.1 . 1 . . . . 322 TYR C . 15275 1 127 . 1 1 12 12 TYR CA C 13 62.80 0.1 . 1 . . . . 322 TYR CA . 15275 1 128 . 1 1 12 12 TYR CB C 13 38.30 0.1 . 1 . . . . 322 TYR CB . 15275 1 129 . 1 1 12 12 TYR CE1 C 13 118.55 0.1 . 3 . . . . 322 TYR CE1 . 15275 1 130 . 1 1 12 12 TYR CE2 C 13 118.55 0.1 . 3 . . . . 322 TYR CE2 . 15275 1 131 . 1 1 13 13 LYS H H 1 8.07 0.03 . 1 . . . . 323 LYS H . 15275 1 132 . 1 1 13 13 LYS HA H 1 4.22 0.03 . 1 . . . . 323 LYS HA . 15275 1 133 . 1 1 13 13 LYS HB2 H 1 1.99 0.03 . 2 . . . . 323 LYS HB2 . 15275 1 134 . 1 1 13 13 LYS HB3 H 1 1.99 0.03 . 2 . . . . 323 LYS HB3 . 15275 1 135 . 1 1 13 13 LYS HE2 H 1 2.83 0.03 . 1 . . . . 323 LYS HE2 . 15275 1 136 . 1 1 13 13 LYS CA C 13 54.64 0.1 . 1 . . . . 323 LYS CA . 15275 1 137 . 1 1 13 13 LYS CB C 13 32.40 0.1 . 1 . . . . 323 LYS CB . 15275 1 138 . 1 1 13 13 LYS CD C 13 29.24 0.1 . 1 . . . . 323 LYS CD . 15275 1 139 . 1 1 13 13 LYS CE C 13 42.06 0.1 . 1 . . . . 323 LYS CE . 15275 1 140 . 1 1 13 13 LYS CG C 13 25.42 0.1 . 1 . . . . 323 LYS CG . 15275 1 141 . 1 1 13 13 LYS N N 15 116.43 0.1 . 1 . . . . 323 LYS N . 15275 1 142 . 1 1 14 14 GLN H H 1 7.77 0.03 . 1 . . . . 324 GLN H . 15275 1 143 . 1 1 14 14 GLN HA H 1 4.13 0.03 . 1 . . . . 324 GLN HA . 15275 1 144 . 1 1 14 14 GLN HB2 H 1 2.31 0.03 . 2 . . . . 324 GLN HB2 . 15275 1 145 . 1 1 14 14 GLN HB3 H 1 2.31 0.03 . 2 . . . . 324 GLN HB3 . 15275 1 146 . 1 1 14 14 GLN C C 13 178.25 0.1 . 1 . . . . 324 GLN C . 15275 1 147 . 1 1 14 14 GLN CA C 13 58.85 0.1 . 1 . . . . 324 GLN CA . 15275 1 148 . 1 1 14 14 GLN CB C 13 28.43 0.1 . 1 . . . . 324 GLN CB . 15275 1 149 . 1 1 14 14 GLN CG C 13 33.63 0.1 . 1 . . . . 324 GLN CG . 15275 1 150 . 1 1 14 14 GLN N N 15 120.42 0.1 . 1 . . . . 324 GLN N . 15275 1 151 . 1 1 15 15 ILE H H 1 8.25 0.03 . 1 . . . . 325 ILE H . 15275 1 152 . 1 1 15 15 ILE HA H 1 3.72 0.03 . 1 . . . . 325 ILE HA . 15275 1 153 . 1 1 15 15 ILE HB H 1 1.87 0.03 . 1 . . . . 325 ILE HB . 15275 1 154 . 1 1 15 15 ILE HD11 H 1 0.86 0.03 . 1 . . . . 325 ILE HD1 . 15275 1 155 . 1 1 15 15 ILE HD12 H 1 0.86 0.03 . 1 . . . . 325 ILE HD1 . 15275 1 156 . 1 1 15 15 ILE HD13 H 1 0.86 0.03 . 1 . . . . 325 ILE HD1 . 15275 1 157 . 1 1 15 15 ILE HG21 H 1 0.81 0.03 . 1 . . . . 325 ILE HG2 . 15275 1 158 . 1 1 15 15 ILE HG22 H 1 0.81 0.03 . 1 . . . . 325 ILE HG2 . 15275 1 159 . 1 1 15 15 ILE HG23 H 1 0.81 0.03 . 1 . . . . 325 ILE HG2 . 15275 1 160 . 1 1 15 15 ILE C C 13 178.29 0.1 . 1 . . . . 325 ILE C . 15275 1 161 . 1 1 15 15 ILE CA C 13 65.40 0.1 . 1 . . . . 325 ILE CA . 15275 1 162 . 1 1 15 15 ILE CB C 13 37.66 0.1 . 1 . . . . 325 ILE CB . 15275 1 163 . 1 1 15 15 ILE CD1 C 13 14.55 0.1 . 1 . . . . 325 ILE CD1 . 15275 1 164 . 1 1 15 15 ILE CG2 C 13 17.45 0.1 . 1 . . . . 325 ILE CG2 . 15275 1 165 . 1 1 15 15 ILE N N 15 119.66 0.1 . 1 . . . . 325 ILE N . 15275 1 166 . 1 1 16 16 GLU H H 1 8.19 0.03 . 1 . . . . 326 GLU H . 15275 1 167 . 1 1 16 16 GLU HA H 1 3.97 0.03 . 1 . . . . 326 GLU HA . 15275 1 168 . 1 1 16 16 GLU HB2 H 1 2.05 0.03 . 2 . . . . 326 GLU HB2 . 15275 1 169 . 1 1 16 16 GLU HB3 H 1 2.05 0.03 . 2 . . . . 326 GLU HB3 . 15275 1 170 . 1 1 16 16 GLU HG2 H 1 2.35 0.03 . 1 . . . . 326 GLU HG2 . 15275 1 171 . 1 1 16 16 GLU HG3 H 1 2.64 0.03 . 1 . . . . 326 GLU HG3 . 15275 1 172 . 1 1 16 16 GLU C C 13 179.44 0.1 . 1 . . . . 326 GLU C . 15275 1 173 . 1 1 16 16 GLU CA C 13 59.62 0.1 . 1 . . . . 326 GLU CA . 15275 1 174 . 1 1 16 16 GLU CB C 13 30.00 0.1 . 1 . . . . 326 GLU CB . 15275 1 175 . 1 1 16 16 GLU CG C 13 36.66 0.1 . 1 . . . . 326 GLU CG . 15275 1 176 . 1 1 16 16 GLU N N 15 120.16 0.1 . 1 . . . . 326 GLU N . 15275 1 177 . 1 1 17 17 ALA H H 1 7.81 0.03 . 1 . . . . 327 ALA H . 15275 1 178 . 1 1 17 17 ALA HA H 1 4.16 0.03 . 1 . . . . 327 ALA HA . 15275 1 179 . 1 1 17 17 ALA HB1 H 1 1.52 0.03 . 1 . . . . 327 ALA HB . 15275 1 180 . 1 1 17 17 ALA HB2 H 1 1.52 0.03 . 1 . . . . 327 ALA HB . 15275 1 181 . 1 1 17 17 ALA HB3 H 1 1.52 0.03 . 1 . . . . 327 ALA HB . 15275 1 182 . 1 1 17 17 ALA CA C 13 54.50 0.1 . 1 . . . . 327 ALA CA . 15275 1 183 . 1 1 17 17 ALA CB C 13 18.41 0.1 . 1 . . . . 327 ALA CB . 15275 1 184 . 1 1 17 17 ALA N N 15 120.58 0.1 . 1 . . . . 327 ALA N . 15275 1 185 . 1 1 32 32 PRO HA H 1 4.53 0.03 . 1 . . . . 342 PRO HA . 15275 1 186 . 1 1 32 32 PRO HB2 H 1 2.15 0.03 . 1 . . . . 342 PRO HB2 . 15275 1 187 . 1 1 32 32 PRO HB3 H 1 2.35 0.03 . 1 . . . . 342 PRO HB3 . 15275 1 188 . 1 1 32 32 PRO HD2 H 1 3.56 0.03 . 1 . . . . 342 PRO HD2 . 15275 1 189 . 1 1 32 32 PRO HD3 H 1 3.46 0.03 . 1 . . . . 342 PRO HD3 . 15275 1 190 . 1 1 32 32 PRO HG2 H 1 1.90 0.03 . 1 . . . . 342 PRO HG2 . 15275 1 191 . 1 1 32 32 PRO HG3 H 1 1.85 0.03 . 1 . . . . 342 PRO HG3 . 15275 1 192 . 1 1 32 32 PRO C C 13 175.47 0.1 . 1 . . . . 342 PRO C . 15275 1 193 . 1 1 32 32 PRO CA C 13 62.67 0.1 . 1 . . . . 342 PRO CA . 15275 1 194 . 1 1 32 32 PRO CB C 13 34.61 0.1 . 1 . . . . 342 PRO CB . 15275 1 195 . 1 1 32 32 PRO CD C 13 50.39 0.1 . 1 . . . . 342 PRO CD . 15275 1 196 . 1 1 32 32 PRO CG C 13 24.77 0.1 . 1 . . . . 342 PRO CG . 15275 1 197 . 1 1 33 33 PHE H H 1 7.95 0.03 . 1 . . . . 343 PHE H . 15275 1 198 . 1 1 33 33 PHE HA H 1 3.99 0.03 . 1 . . . . 343 PHE HA . 15275 1 199 . 1 1 33 33 PHE HB2 H 1 1.82 0.03 . 2 . . . . 343 PHE HB2 . 15275 1 200 . 1 1 33 33 PHE HB3 H 1 1.82 0.03 . 2 . . . . 343 PHE HB3 . 15275 1 201 . 1 1 33 33 PHE CA C 13 63.36 0.1 . 1 . . . . 343 PHE CA . 15275 1 202 . 1 1 33 33 PHE CB C 13 39.15 0.1 . 1 . . . . 343 PHE CB . 15275 1 203 . 1 1 33 33 PHE N N 15 124.18 0.1 . 1 . . . . 343 PHE N . 15275 1 204 . 1 1 34 34 GLY HA2 H 1 3.93 0.03 . 2 . . . . 344 GLY HA2 . 15275 1 205 . 1 1 34 34 GLY HA3 H 1 3.93 0.03 . 2 . . . . 344 GLY HA3 . 15275 1 206 . 1 1 34 34 GLY C C 13 173.78 0.1 . 1 . . . . 344 GLY C . 15275 1 207 . 1 1 34 34 GLY CA C 13 45.28 0.1 . 1 . . . . 344 GLY CA . 15275 1 208 . 1 1 35 35 LEU H H 1 8.06 0.03 . 1 . . . . 345 LEU H . 15275 1 209 . 1 1 35 35 LEU HA H 1 4.32 0.03 . 1 . . . . 345 LEU HA . 15275 1 210 . 1 1 35 35 LEU HB2 H 1 1.51 0.03 . 1 . . . . 345 LEU HB2 . 15275 1 211 . 1 1 35 35 LEU HD21 H 1 0.83 0.03 . 2 . . . . 345 LEU HD2 . 15275 1 212 . 1 1 35 35 LEU HD22 H 1 0.83 0.03 . 2 . . . . 345 LEU HD2 . 15275 1 213 . 1 1 35 35 LEU HD23 H 1 0.83 0.03 . 2 . . . . 345 LEU HD2 . 15275 1 214 . 1 1 35 35 LEU CA C 13 55.15 0.1 . 1 . . . . 345 LEU CA . 15275 1 215 . 1 1 35 35 LEU CB C 13 42.75 0.1 . 1 . . . . 345 LEU CB . 15275 1 216 . 1 1 35 35 LEU CD2 C 13 23.72 0.1 . 1 . . . . 345 LEU CD2 . 15275 1 217 . 1 1 35 35 LEU N N 15 121.81 0.1 . 1 . . . . 345 LEU N . 15275 1 218 . 1 1 37 37 LEU C C 13 174.43 0.1 . 1 . . . . 347 LEU C . 15275 1 219 . 1 1 37 37 LEU CA C 13 53.42 0.1 . 1 . . . . 347 LEU CA . 15275 1 220 . 1 1 37 37 LEU CB C 13 39.30 0.1 . 1 . . . . 347 LEU CB . 15275 1 221 . 1 1 38 38 LYS H H 1 7.98 0.03 . 1 . . . . 348 LYS H . 15275 1 222 . 1 1 38 38 LYS HA H 1 4.26 0.03 . 1 . . . . 348 LYS HA . 15275 1 223 . 1 1 38 38 LYS HB2 H 1 1.80 0.03 . 2 . . . . 348 LYS HB2 . 15275 1 224 . 1 1 38 38 LYS HB3 H 1 1.80 0.03 . 2 . . . . 348 LYS HB3 . 15275 1 225 . 1 1 38 38 LYS HG2 H 1 1.42 0.03 . 2 . . . . 348 LYS HG2 . 15275 1 226 . 1 1 38 38 LYS HG3 H 1 1.42 0.03 . 2 . . . . 348 LYS HG3 . 15275 1 227 . 1 1 38 38 LYS CA C 13 56.23 0.1 . 1 . . . . 348 LYS CA . 15275 1 228 . 1 1 38 38 LYS CB C 13 33.31 0.1 . 1 . . . . 348 LYS CB . 15275 1 229 . 1 1 38 38 LYS CD C 13 29.17 0.1 . 1 . . . . 348 LYS CD . 15275 1 230 . 1 1 38 38 LYS CG C 13 24.84 0.1 . 1 . . . . 348 LYS CG . 15275 1 231 . 1 1 38 38 LYS N N 15 120.95 0.1 . 1 . . . . 348 LYS N . 15275 1 232 . 1 1 39 39 VAL H H 1 8.18 0.03 . 1 . . . . 349 VAL H . 15275 1 233 . 1 1 39 39 VAL HA H 1 4.12 0.03 . 1 . . . . 349 VAL HA . 15275 1 234 . 1 1 39 39 VAL HB H 1 2.00 0.03 . 1 . . . . 349 VAL HB . 15275 1 235 . 1 1 39 39 VAL HG11 H 1 0.82 0.03 . 2 . . . . 349 VAL HG1 . 15275 1 236 . 1 1 39 39 VAL HG12 H 1 0.82 0.03 . 2 . . . . 349 VAL HG1 . 15275 1 237 . 1 1 39 39 VAL HG13 H 1 0.82 0.03 . 2 . . . . 349 VAL HG1 . 15275 1 238 . 1 1 39 39 VAL HG21 H 1 0.83 0.03 . 2 . . . . 349 VAL HG2 . 15275 1 239 . 1 1 39 39 VAL HG22 H 1 0.83 0.03 . 2 . . . . 349 VAL HG2 . 15275 1 240 . 1 1 39 39 VAL HG23 H 1 0.83 0.03 . 2 . . . . 349 VAL HG2 . 15275 1 241 . 1 1 39 39 VAL C C 13 175.59 0.1 . 1 . . . . 349 VAL C . 15275 1 242 . 1 1 39 39 VAL CA C 13 62.09 0.1 . 1 . . . . 349 VAL CA . 15275 1 243 . 1 1 39 39 VAL CB C 13 32.95 0.1 . 1 . . . . 349 VAL CB . 15275 1 244 . 1 1 39 39 VAL CG1 C 13 21.58 0.1 . 1 . . . . 349 VAL CG1 . 15275 1 245 . 1 1 39 39 VAL CG2 C 13 20.60 0.1 . 1 . . . . 349 VAL CG2 . 15275 1 246 . 1 1 39 39 VAL N N 15 121.73 0.1 . 1 . . . . 349 VAL N . 15275 1 247 . 1 1 40 40 ASP H H 1 8.34 0.03 . 1 . . . . 350 ASP H . 15275 1 248 . 1 1 40 40 ASP HA H 1 4.58 0.03 . 1 . . . . 350 ASP HA . 15275 1 249 . 1 1 40 40 ASP HB2 H 1 2.69 0.03 . 2 . . . . 350 ASP HB2 . 15275 1 250 . 1 1 40 40 ASP HB3 H 1 2.69 0.03 . 2 . . . . 350 ASP HB3 . 15275 1 251 . 1 1 40 40 ASP C C 13 175.89 0.1 . 1 . . . . 350 ASP C . 15275 1 252 . 1 1 40 40 ASP CA C 13 54.35 0.1 . 1 . . . . 350 ASP CA . 15275 1 253 . 1 1 40 40 ASP CB C 13 41.27 0.1 . 1 . . . . 350 ASP CB . 15275 1 254 . 1 1 40 40 ASP N N 15 123.89 0.1 . 1 . . . . 350 ASP N . 15275 1 255 . 1 1 41 41 ASN H H 1 8.36 0.03 . 1 . . . . 351 ASN H . 15275 1 256 . 1 1 41 41 ASN HA H 1 4.76 0.03 . 1 . . . . 351 ASN HA . 15275 1 257 . 1 1 41 41 ASN HB2 H 1 2.76 0.03 . 2 . . . . 351 ASN HB2 . 15275 1 258 . 1 1 41 41 ASN HB3 H 1 3.24 0.03 . 2 . . . . 351 ASN HB3 . 15275 1 259 . 1 1 41 41 ASN CA C 13 51.92 0.1 . 1 . . . . 351 ASN CA . 15275 1 260 . 1 1 41 41 ASN CB C 13 42.27 0.1 . 1 . . . . 351 ASN CB . 15275 1 261 . 1 1 41 41 ASN N N 15 118.83 0.1 . 1 . . . . 351 ASN N . 15275 1 262 . 1 1 42 42 ASP H H 1 8.40 0.03 . 1 . . . . 352 ASP H . 15275 1 263 . 1 1 42 42 ASP HA H 1 4.54 0.03 . 1 . . . . 352 ASP HA . 15275 1 264 . 1 1 42 42 ASP N N 15 119.36 0.1 . 1 . . . . 352 ASP N . 15275 1 265 . 1 1 47 47 THR HA H 1 4.33 0.03 . 1 . . . . 357 THR HA . 15275 1 266 . 1 1 47 47 THR HB H 1 4.21 0.03 . 1 . . . . 357 THR HB . 15275 1 267 . 1 1 47 47 THR HG21 H 1 1.18 0.03 . 1 . . . . 357 THR HG2 . 15275 1 268 . 1 1 47 47 THR HG22 H 1 1.18 0.03 . 1 . . . . 357 THR HG2 . 15275 1 269 . 1 1 47 47 THR HG23 H 1 1.18 0.03 . 1 . . . . 357 THR HG2 . 15275 1 270 . 1 1 47 47 THR CA C 13 62.05 0.1 . 1 . . . . 357 THR CA . 15275 1 271 . 1 1 47 47 THR CB C 13 69.76 0.1 . 1 . . . . 357 THR CB . 15275 1 272 . 1 1 48 48 GLN HA H 1 3.93 0.03 . 1 . . . . 358 GLN HA . 15275 1 273 . 1 1 48 48 GLN HB2 H 1 2.07 0.03 . 2 . . . . 358 GLN HB2 . 15275 1 274 . 1 1 48 48 GLN HB3 H 1 2.07 0.03 . 2 . . . . 358 GLN HB3 . 15275 1 275 . 1 1 48 48 GLN HE21 H 1 7.50 0.03 . 1 . . . . 358 GLN HE21 . 15275 1 276 . 1 1 48 48 GLN HE22 H 1 6.90 0.03 . 1 . . . . 358 GLN HE22 . 15275 1 277 . 1 1 48 48 GLN HG2 H 1 2.39 0.03 . 2 . . . . 358 GLN HG2 . 15275 1 278 . 1 1 48 48 GLN HG3 H 1 2.39 0.03 . 2 . . . . 358 GLN HG3 . 15275 1 279 . 1 1 48 48 GLN NE2 N 15 111.96 0.1 . 1 . . . . 358 GLN NE2 . 15275 1 280 . 1 1 50 50 LYS HA H 1 3.63 0.03 . 1 . . . . 360 LYS HA . 15275 1 281 . 1 1 50 50 LYS HB2 H 1 1.27 0.03 . 2 . . . . 360 LYS HB2 . 15275 1 282 . 1 1 50 50 LYS HB3 H 1 1.27 0.03 . 2 . . . . 360 LYS HB3 . 15275 1 283 . 1 1 50 50 LYS HD2 H 1 1.57 0.03 . 2 . . . . 360 LYS HD2 . 15275 1 284 . 1 1 50 50 LYS HD3 H 1 1.57 0.03 . 2 . . . . 360 LYS HD3 . 15275 1 285 . 1 1 50 50 LYS HE2 H 1 2.86 0.03 . 1 . . . . 360 LYS HE2 . 15275 1 286 . 1 1 50 50 LYS HG2 H 1 1.47 0.03 . 2 . . . . 360 LYS HG2 . 15275 1 287 . 1 1 50 50 LYS HG3 H 1 1.47 0.03 . 2 . . . . 360 LYS HG3 . 15275 1 288 . 1 1 50 50 LYS C C 13 178.30 0.1 . 1 . . . . 360 LYS C . 15275 1 289 . 1 1 50 50 LYS CA C 13 58.84 0.1 . 1 . . . . 360 LYS CA . 15275 1 290 . 1 1 50 50 LYS CB C 13 31.60 0.1 . 1 . . . . 360 LYS CB . 15275 1 291 . 1 1 50 50 LYS CD C 13 28.66 0.1 . 1 . . . . 360 LYS CD . 15275 1 292 . 1 1 50 50 LYS CE C 13 41.78 0.1 . 1 . . . . 360 LYS CE . 15275 1 293 . 1 1 50 50 LYS CG C 13 24.12 0.1 . 1 . . . . 360 LYS CG . 15275 1 294 . 1 1 51 51 MET H H 1 7.91 0.03 . 1 . . . . 361 MET H . 15275 1 295 . 1 1 51 51 MET HA H 1 3.65 0.03 . 1 . . . . 361 MET HA . 15275 1 296 . 1 1 51 51 MET HB2 H 1 1.89 0.03 . 2 . . . . 361 MET HB2 . 15275 1 297 . 1 1 51 51 MET HB3 H 1 1.89 0.03 . 2 . . . . 361 MET HB3 . 15275 1 298 . 1 1 51 51 MET HE1 H 1 2.09 0.03 . 1 . . . . 361 MET HE . 15275 1 299 . 1 1 51 51 MET HE2 H 1 2.09 0.03 . 1 . . . . 361 MET HE . 15275 1 300 . 1 1 51 51 MET HE3 H 1 2.09 0.03 . 1 . . . . 361 MET HE . 15275 1 301 . 1 1 51 51 MET HG2 H 1 2.52 0.03 . 1 . . . . 361 MET HG2 . 15275 1 302 . 1 1 51 51 MET HG3 H 1 2.33 0.03 . 1 . . . . 361 MET HG3 . 15275 1 303 . 1 1 51 51 MET C C 13 178.17 0.1 . 1 . . . . 361 MET C . 15275 1 304 . 1 1 51 51 MET CA C 13 59.33 0.1 . 1 . . . . 361 MET CA . 15275 1 305 . 1 1 51 51 MET CB C 13 32.52 0.1 . 1 . . . . 361 MET CB . 15275 1 306 . 1 1 51 51 MET CG C 13 33.06 0.1 . 1 . . . . 361 MET CG . 15275 1 307 . 1 1 51 51 MET N N 15 116.59 0.1 . 1 . . . . 361 MET N . 15275 1 308 . 1 1 52 52 LYS H H 1 7.67 0.03 . 1 . . . . 362 LYS H . 15275 1 309 . 1 1 52 52 LYS HA H 1 3.91 0.03 . 1 . . . . 362 LYS HA . 15275 1 310 . 1 1 52 52 LYS HB2 H 1 1.87 0.03 . 2 . . . . 362 LYS HB2 . 15275 1 311 . 1 1 52 52 LYS HB3 H 1 1.87 0.03 . 2 . . . . 362 LYS HB3 . 15275 1 312 . 1 1 52 52 LYS HD2 H 1 1.63 0.03 . 2 . . . . 362 LYS HD2 . 15275 1 313 . 1 1 52 52 LYS HD3 H 1 1.63 0.03 . 2 . . . . 362 LYS HD3 . 15275 1 314 . 1 1 52 52 LYS HE2 H 1 2.91 0.03 . 2 . . . . 362 LYS HE2 . 15275 1 315 . 1 1 52 52 LYS HE3 H 1 2.91 0.03 . 2 . . . . 362 LYS HE3 . 15275 1 316 . 1 1 52 52 LYS C C 13 178.88 0.1 . 1 . . . . 362 LYS C . 15275 1 317 . 1 1 52 52 LYS CA C 13 59.76 0.1 . 1 . . . . 362 LYS CA . 15275 1 318 . 1 1 52 52 LYS CB C 13 32.16 0.1 . 1 . . . . 362 LYS CB . 15275 1 319 . 1 1 52 52 LYS CD C 13 29.45 0.1 . 1 . . . . 362 LYS CD . 15275 1 320 . 1 1 52 52 LYS CE C 13 42.14 0.1 . 1 . . . . 362 LYS CE . 15275 1 321 . 1 1 52 52 LYS CG C 13 25.42 0.1 . 1 . . . . 362 LYS CG . 15275 1 322 . 1 1 52 52 LYS N N 15 118.30 0.1 . 1 . . . . 362 LYS N . 15275 1 323 . 1 1 53 53 LYS H H 1 7.61 0.03 . 1 . . . . 363 LYS H . 15275 1 324 . 1 1 53 53 LYS HA H 1 4.04 0.03 . 1 . . . . 363 LYS HA . 15275 1 325 . 1 1 53 53 LYS HB2 H 1 1.79 0.03 . 2 . . . . 363 LYS HB2 . 15275 1 326 . 1 1 53 53 LYS HB3 H 1 1.93 0.03 . 2 . . . . 363 LYS HB3 . 15275 1 327 . 1 1 53 53 LYS HE2 H 1 2.96 0.03 . 2 . . . . 363 LYS HE2 . 15275 1 328 . 1 1 53 53 LYS HE3 H 1 2.96 0.03 . 2 . . . . 363 LYS HE3 . 15275 1 329 . 1 1 53 53 LYS CA C 13 58.82 0.1 . 1 . . . . 363 LYS CA . 15275 1 330 . 1 1 53 53 LYS CB C 13 31.76 0.1 . 1 . . . . 363 LYS CB . 15275 1 331 . 1 1 53 53 LYS CD C 13 28.95 0.1 . 1 . . . . 363 LYS CD . 15275 1 332 . 1 1 53 53 LYS CE C 13 41.56 0.1 . 1 . . . . 363 LYS CE . 15275 1 333 . 1 1 53 53 LYS CG C 13 24.84 0.1 . 1 . . . . 363 LYS CG . 15275 1 334 . 1 1 53 53 LYS N N 15 119.69 0.1 . 1 . . . . 363 LYS N . 15275 1 335 . 1 1 54 54 PHE H H 1 8.71 0.03 . 1 . . . . 364 PHE H . 15275 1 336 . 1 1 54 54 PHE HA H 1 4.47 0.03 . 1 . . . . 364 PHE HA . 15275 1 337 . 1 1 54 54 PHE HB2 H 1 2.88 0.03 . 2 . . . . 364 PHE HB2 . 15275 1 338 . 1 1 54 54 PHE HB3 H 1 3.45 0.03 . 2 . . . . 364 PHE HB3 . 15275 1 339 . 1 1 54 54 PHE C C 13 175.61 0.1 . 1 . . . . 364 PHE C . 15275 1 340 . 1 1 54 54 PHE CA C 13 57.60 0.1 . 1 . . . . 364 PHE CA . 15275 1 341 . 1 1 54 54 PHE CB C 13 36.56 0.1 . 1 . . . . 364 PHE CB . 15275 1 342 . 1 1 54 54 PHE N N 15 117.29 0.1 . 1 . . . . 364 PHE N . 15275 1 343 . 1 1 55 55 ARG H H 1 7.85 0.03 . 1 . . . . 365 ARG H . 15275 1 344 . 1 1 55 55 ARG HA H 1 3.75 0.03 . 1 . . . . 365 ARG HA . 15275 1 345 . 1 1 55 55 ARG HB2 H 1 1.74 0.03 . 1 . . . . 365 ARG HB2 . 15275 1 346 . 1 1 55 55 ARG HB3 H 1 2.02 0.03 . 1 . . . . 365 ARG HB3 . 15275 1 347 . 1 1 55 55 ARG HD2 H 1 2.99 0.03 . 2 . . . . 365 ARG HD2 . 15275 1 348 . 1 1 55 55 ARG HD3 H 1 2.99 0.03 . 2 . . . . 365 ARG HD3 . 15275 1 349 . 1 1 55 55 ARG HG2 H 1 1.43 0.03 . 1 . . . . 365 ARG HG2 . 15275 1 350 . 1 1 55 55 ARG HG3 H 1 1.43 0.03 . 1 . . . . 365 ARG HG3 . 15275 1 351 . 1 1 55 55 ARG C C 13 176.94 0.1 . 1 . . . . 365 ARG C . 15275 1 352 . 1 1 55 55 ARG CA C 13 60.77 0.1 . 1 . . . . 365 ARG CA . 15275 1 353 . 1 1 55 55 ARG CB C 13 30.07 0.1 . 1 . . . . 365 ARG CB . 15275 1 354 . 1 1 55 55 ARG CD C 13 43.58 0.1 . 1 . . . . 365 ARG CD . 15275 1 355 . 1 1 55 55 ARG CG C 13 27.51 0.1 . 1 . . . . 365 ARG CG . 15275 1 356 . 1 1 55 55 ARG N N 15 119.29 0.1 . 1 . . . . 365 ARG N . 15275 1 357 . 1 1 56 56 VAL H H 1 7.71 0.03 . 1 . . . . 366 VAL H . 15275 1 358 . 1 1 56 56 VAL HA H 1 3.92 0.03 . 1 . . . . 366 VAL HA . 15275 1 359 . 1 1 56 56 VAL HB H 1 2.28 0.03 . 1 . . . . 366 VAL HB . 15275 1 360 . 1 1 56 56 VAL HG11 H 1 1.13 0.03 . 2 . . . . 366 VAL HG1 . 15275 1 361 . 1 1 56 56 VAL HG12 H 1 1.13 0.03 . 2 . . . . 366 VAL HG1 . 15275 1 362 . 1 1 56 56 VAL HG13 H 1 1.13 0.03 . 2 . . . . 366 VAL HG1 . 15275 1 363 . 1 1 56 56 VAL HG21 H 1 1.17 0.03 . 2 . . . . 366 VAL HG2 . 15275 1 364 . 1 1 56 56 VAL HG22 H 1 1.17 0.03 . 2 . . . . 366 VAL HG2 . 15275 1 365 . 1 1 56 56 VAL HG23 H 1 1.17 0.03 . 2 . . . . 366 VAL HG2 . 15275 1 366 . 1 1 56 56 VAL CA C 13 66.16 0.1 . 1 . . . . 366 VAL CA . 15275 1 367 . 1 1 56 56 VAL CB C 13 31.66 0.1 . 1 . . . . 366 VAL CB . 15275 1 368 . 1 1 56 56 VAL CG1 C 13 21.66 0.1 . 1 . . . . 366 VAL CG1 . 15275 1 369 . 1 1 56 56 VAL CG2 C 13 22.57 0.1 . 1 . . . . 366 VAL CG2 . 15275 1 370 . 1 1 56 56 VAL N N 15 117.28 0.1 . 1 . . . . 366 VAL N . 15275 1 371 . 1 1 57 57 ILE H H 1 8.29 0.03 . 1 . . . . 367 ILE H . 15275 1 372 . 1 1 57 57 ILE HA H 1 3.53 0.03 . 1 . . . . 367 ILE HA . 15275 1 373 . 1 1 57 57 ILE HB H 1 2.00 0.03 . 1 . . . . 367 ILE HB . 15275 1 374 . 1 1 57 57 ILE HD11 H 1 0.79 0.03 . 1 . . . . 367 ILE HD1 . 15275 1 375 . 1 1 57 57 ILE HD12 H 1 0.79 0.03 . 1 . . . . 367 ILE HD1 . 15275 1 376 . 1 1 57 57 ILE HD13 H 1 0.79 0.03 . 1 . . . . 367 ILE HD1 . 15275 1 377 . 1 1 57 57 ILE HG21 H 1 0.80 0.03 . 1 . . . . 367 ILE HG2 . 15275 1 378 . 1 1 57 57 ILE HG22 H 1 0.80 0.03 . 1 . . . . 367 ILE HG2 . 15275 1 379 . 1 1 57 57 ILE HG23 H 1 0.80 0.03 . 1 . . . . 367 ILE HG2 . 15275 1 380 . 1 1 57 57 ILE CA C 13 66.46 0.1 . 1 . . . . 367 ILE CA . 15275 1 381 . 1 1 57 57 ILE CB C 13 38.34 0.1 . 1 . . . . 367 ILE CB . 15275 1 382 . 1 1 57 57 ILE CD1 C 13 14.04 0.1 . 1 . . . . 367 ILE CD1 . 15275 1 383 . 1 1 57 57 ILE CG2 C 13 19.34 0.1 . 1 . . . . 367 ILE CG2 . 15275 1 384 . 1 1 57 57 ILE N N 15 121.69 0.1 . 1 . . . . 367 ILE N . 15275 1 385 . 1 1 58 58 MET H H 1 8.03 0.03 . 1 . . . . 368 MET H . 15275 1 386 . 1 1 58 58 MET HA H 1 4.22 0.03 . 1 . . . . 368 MET HA . 15275 1 387 . 1 1 58 58 MET HB2 H 1 2.02 0.03 . 2 . . . . 368 MET HB2 . 15275 1 388 . 1 1 58 58 MET HB3 H 1 2.49 0.03 . 2 . . . . 368 MET HB3 . 15275 1 389 . 1 1 58 58 MET C C 13 179.03 0.1 . 1 . . . . 368 MET C . 15275 1 390 . 1 1 58 58 MET CA C 13 60.19 0.1 . 1 . . . . 368 MET CA . 15275 1 391 . 1 1 58 58 MET CB C 13 34.43 0.1 . 1 . . . . 368 MET CB . 15275 1 392 . 1 1 58 58 MET N N 15 117.63 0.1 . 1 . . . . 368 MET N . 15275 1 393 . 1 1 59 59 ASP H H 1 8.47 0.03 . 1 . . . . 369 ASP H . 15275 1 394 . 1 1 59 59 ASP HA H 1 4.64 0.03 . 1 . . . . 369 ASP HA . 15275 1 395 . 1 1 59 59 ASP HB2 H 1 2.81 0.03 . 2 . . . . 369 ASP HB2 . 15275 1 396 . 1 1 59 59 ASP HB3 H 1 2.93 0.03 . 2 . . . . 369 ASP HB3 . 15275 1 397 . 1 1 59 59 ASP C C 13 177.55 0.1 . 1 . . . . 369 ASP C . 15275 1 398 . 1 1 59 59 ASP CA C 13 56.61 0.1 . 1 . . . . 369 ASP CA . 15275 1 399 . 1 1 59 59 ASP CB C 13 40.26 0.1 . 1 . . . . 369 ASP CB . 15275 1 400 . 1 1 59 59 ASP N N 15 119.65 0.1 . 1 . . . . 369 ASP N . 15275 1 401 . 1 1 60 60 SER H H 1 7.64 0.03 . 1 . . . . 370 SER H . 15275 1 402 . 1 1 60 60 SER HA H 1 4.63 0.03 . 1 . . . . 370 SER HA . 15275 1 403 . 1 1 60 60 SER HB2 H 1 3.92 0.03 . 2 . . . . 370 SER HB2 . 15275 1 404 . 1 1 60 60 SER HB3 H 1 4.13 0.03 . 2 . . . . 370 SER HB3 . 15275 1 405 . 1 1 60 60 SER C C 13 173.81 0.1 . 1 . . . . 370 SER C . 15275 1 406 . 1 1 60 60 SER CA C 13 59.71 0.1 . 1 . . . . 370 SER CA . 15275 1 407 . 1 1 60 60 SER CB C 13 65.62 0.1 . 1 . . . . 370 SER CB . 15275 1 408 . 1 1 60 60 SER N N 15 115.26 0.1 . 1 . . . . 370 SER N . 15275 1 409 . 1 1 61 61 MET H H 1 7.50 0.03 . 1 . . . . 371 MET H . 15275 1 410 . 1 1 61 61 MET HA H 1 4.37 0.03 . 1 . . . . 371 MET HA . 15275 1 411 . 1 1 61 61 MET HB2 H 1 2.15 0.03 . 2 . . . . 371 MET HB2 . 15275 1 412 . 1 1 61 61 MET HB3 H 1 2.10 0.03 . 2 . . . . 371 MET HB3 . 15275 1 413 . 1 1 61 61 MET HE1 H 1 1.77 0.03 . 1 . . . . 371 MET HE . 15275 1 414 . 1 1 61 61 MET HE2 H 1 1.77 0.03 . 1 . . . . 371 MET HE . 15275 1 415 . 1 1 61 61 MET HE3 H 1 1.77 0.03 . 1 . . . . 371 MET HE . 15275 1 416 . 1 1 61 61 MET C C 13 176.33 0.1 . 1 . . . . 371 MET C . 15275 1 417 . 1 1 61 61 MET CA C 13 56.08 0.1 . 1 . . . . 371 MET CA . 15275 1 418 . 1 1 61 61 MET CB C 13 33.90 0.1 . 1 . . . . 371 MET CB . 15275 1 419 . 1 1 61 61 MET CE C 13 18.21 0.1 . 1 . . . . 371 MET CE . 15275 1 420 . 1 1 61 61 MET N N 15 121.56 0.1 . 1 . . . . 371 MET N . 15275 1 421 . 1 1 62 62 THR H H 1 9.07 0.03 . 1 . . . . 372 THR H . 15275 1 422 . 1 1 62 62 THR HA H 1 4.41 0.03 . 1 . . . . 372 THR HA . 15275 1 423 . 1 1 62 62 THR HB H 1 4.63 0.03 . 1 . . . . 372 THR HB . 15275 1 424 . 1 1 62 62 THR HG21 H 1 1.18 0.03 . 1 . . . . 372 THR HG2 . 15275 1 425 . 1 1 62 62 THR HG22 H 1 1.18 0.03 . 1 . . . . 372 THR HG2 . 15275 1 426 . 1 1 62 62 THR HG23 H 1 1.18 0.03 . 1 . . . . 372 THR HG2 . 15275 1 427 . 1 1 62 62 THR C C 13 175.14 0.1 . 1 . . . . 372 THR C . 15275 1 428 . 1 1 62 62 THR CA C 13 60.20 0.1 . 1 . . . . 372 THR CA . 15275 1 429 . 1 1 62 62 THR CB C 13 70.69 0.1 . 1 . . . . 372 THR CB . 15275 1 430 . 1 1 62 62 THR CG2 C 13 21.73 0.1 . 1 . . . . 372 THR CG2 . 15275 1 431 . 1 1 62 62 THR N N 15 113.55 0.1 . 1 . . . . 372 THR N . 15275 1 432 . 1 1 63 63 GLU H H 1 8.67 0.03 . 1 . . . . 373 GLU H . 15275 1 433 . 1 1 63 63 GLU HA H 1 3.88 0.03 . 1 . . . . 373 GLU HA . 15275 1 434 . 1 1 63 63 GLU HB2 H 1 1.92 0.03 . 2 . . . . 373 GLU HB2 . 15275 1 435 . 1 1 63 63 GLU HB3 H 1 1.99 0.03 . 2 . . . . 373 GLU HB3 . 15275 1 436 . 1 1 63 63 GLU HG2 H 1 2.23 0.03 . 2 . . . . 373 GLU HG2 . 15275 1 437 . 1 1 63 63 GLU HG3 H 1 2.23 0.03 . 2 . . . . 373 GLU HG3 . 15275 1 438 . 1 1 63 63 GLU C C 13 177.85 0.1 . 1 . . . . 373 GLU C . 15275 1 439 . 1 1 63 63 GLU CA C 13 59.86 0.1 . 1 . . . . 373 GLU CA . 15275 1 440 . 1 1 63 63 GLU CB C 13 29.37 0.1 . 1 . . . . 373 GLU CB . 15275 1 441 . 1 1 63 63 GLU CG C 13 35.66 0.1 . 1 . . . . 373 GLU CG . 15275 1 442 . 1 1 63 63 GLU N N 15 121.20 0.1 . 1 . . . . 373 GLU N . 15275 1 443 . 1 1 64 64 GLU H H 1 8.05 0.03 . 1 . . . . 374 GLU H . 15275 1 444 . 1 1 64 64 GLU HA H 1 3.84 0.03 . 1 . . . . 374 GLU HA . 15275 1 445 . 1 1 64 64 GLU HB2 H 1 1.84 0.03 . 2 . . . . 374 GLU HB2 . 15275 1 446 . 1 1 64 64 GLU HB3 H 1 1.96 0.03 . 2 . . . . 374 GLU HB3 . 15275 1 447 . 1 1 64 64 GLU C C 13 178.67 0.1 . 1 . . . . 374 GLU C . 15275 1 448 . 1 1 64 64 GLU CA C 13 59.47 0.1 . 1 . . . . 374 GLU CA . 15275 1 449 . 1 1 64 64 GLU CB C 13 29.54 0.1 . 1 . . . . 374 GLU CB . 15275 1 450 . 1 1 64 64 GLU CG C 13 36.17 0.1 . 1 . . . . 374 GLU CG . 15275 1 451 . 1 1 64 64 GLU N N 15 115.72 0.1 . 1 . . . . 374 GLU N . 15275 1 452 . 1 1 65 65 GLU H H 1 7.25 0.03 . 1 . . . . 375 GLU H . 15275 1 453 . 1 1 65 65 GLU HA H 1 3.51 0.03 . 1 . . . . 375 GLU HA . 15275 1 454 . 1 1 65 65 GLU HB2 H 1 1.64 0.03 . 2 . . . . 375 GLU HB2 . 15275 1 455 . 1 1 65 65 GLU HB3 H 1 2.37 0.03 . 2 . . . . 375 GLU HB3 . 15275 1 456 . 1 1 65 65 GLU HG2 H 1 2.25 0.03 . 2 . . . . 375 GLU HG2 . 15275 1 457 . 1 1 65 65 GLU HG3 H 1 2.38 0.03 . 2 . . . . 375 GLU HG3 . 15275 1 458 . 1 1 65 65 GLU C C 13 176.68 0.1 . 1 . . . . 375 GLU C . 15275 1 459 . 1 1 65 65 GLU CA C 13 58.65 0.1 . 1 . . . . 375 GLU CA . 15275 1 460 . 1 1 65 65 GLU CB C 13 29.52 0.1 . 1 . . . . 375 GLU CB . 15275 1 461 . 1 1 65 65 GLU CG C 13 37.77 0.1 . 1 . . . . 375 GLU CG . 15275 1 462 . 1 1 65 65 GLU N N 15 119.01 0.1 . 1 . . . . 375 GLU N . 15275 1 463 . 1 1 66 66 LEU H H 1 7.73 0.03 . 1 . . . . 376 LEU H . 15275 1 464 . 1 1 66 66 LEU HA H 1 3.91 0.03 . 1 . . . . 376 LEU HA . 15275 1 465 . 1 1 66 66 LEU HB2 H 1 1.87 0.03 . 2 . . . . 376 LEU HB2 . 15275 1 466 . 1 1 66 66 LEU HB3 H 1 1.00 0.03 . 2 . . . . 376 LEU HB3 . 15275 1 467 . 1 1 66 66 LEU HD11 H 1 0.65 0.03 . 2 . . . . 376 LEU HD1 . 15275 1 468 . 1 1 66 66 LEU HD12 H 1 0.65 0.03 . 2 . . . . 376 LEU HD1 . 15275 1 469 . 1 1 66 66 LEU HD13 H 1 0.65 0.03 . 2 . . . . 376 LEU HD1 . 15275 1 470 . 1 1 66 66 LEU HD21 H 1 0.76 0.03 . 2 . . . . 376 LEU HD2 . 15275 1 471 . 1 1 66 66 LEU HD22 H 1 0.76 0.03 . 2 . . . . 376 LEU HD2 . 15275 1 472 . 1 1 66 66 LEU HD23 H 1 0.76 0.03 . 2 . . . . 376 LEU HD2 . 15275 1 473 . 1 1 66 66 LEU HG H 1 1.67 0.03 . 1 . . . . 376 LEU HG . 15275 1 474 . 1 1 66 66 LEU C C 13 179.54 0.1 . 1 . . . . 376 LEU C . 15275 1 475 . 1 1 66 66 LEU CA C 13 57.31 0.1 . 1 . . . . 376 LEU CA . 15275 1 476 . 1 1 66 66 LEU CB C 13 43.01 0.1 . 1 . . . . 376 LEU CB . 15275 1 477 . 1 1 66 66 LEU CD1 C 13 26.33 0.1 . 1 . . . . 376 LEU CD1 . 15275 1 478 . 1 1 66 66 LEU CD2 C 13 24.98 0.1 . 1 . . . . 376 LEU CD2 . 15275 1 479 . 1 1 66 66 LEU N N 15 114.32 0.1 . 1 . . . . 376 LEU N . 15275 1 480 . 1 1 67 67 LEU H H 1 7.79 0.03 . 1 . . . . 377 LEU H . 15275 1 481 . 1 1 67 67 LEU HA H 1 4.17 0.03 . 1 . . . . 377 LEU HA . 15275 1 482 . 1 1 67 67 LEU HB2 H 1 1.47 0.03 . 2 . . . . 377 LEU HB2 . 15275 1 483 . 1 1 67 67 LEU HB3 H 1 1.77 0.03 . 2 . . . . 377 LEU HB3 . 15275 1 484 . 1 1 67 67 LEU HD11 H 1 0.84 0.03 . 2 . . . . 377 LEU HD1 . 15275 1 485 . 1 1 67 67 LEU HD12 H 1 0.84 0.03 . 2 . . . . 377 LEU HD1 . 15275 1 486 . 1 1 67 67 LEU HD13 H 1 0.84 0.03 . 2 . . . . 377 LEU HD1 . 15275 1 487 . 1 1 67 67 LEU HD21 H 1 0.86 0.03 . 2 . . . . 377 LEU HD2 . 15275 1 488 . 1 1 67 67 LEU HD22 H 1 0.86 0.03 . 2 . . . . 377 LEU HD2 . 15275 1 489 . 1 1 67 67 LEU HD23 H 1 0.86 0.03 . 2 . . . . 377 LEU HD2 . 15275 1 490 . 1 1 67 67 LEU HG H 1 1.72 0.03 . 1 . . . . 377 LEU HG . 15275 1 491 . 1 1 67 67 LEU C C 13 177.37 0.1 . 1 . . . . 377 LEU C . 15275 1 492 . 1 1 67 67 LEU CA C 13 56.02 0.1 . 1 . . . . 377 LEU CA . 15275 1 493 . 1 1 67 67 LEU CB C 13 43.13 0.1 . 1 . . . . 377 LEU CB . 15275 1 494 . 1 1 67 67 LEU CD1 C 13 25.37 0.1 . 1 . . . . 377 LEU CD1 . 15275 1 495 . 1 1 67 67 LEU CD2 C 13 23.03 0.1 . 1 . . . . 377 LEU CD2 . 15275 1 496 . 1 1 67 67 LEU CG C 13 27.16 0.1 . 1 . . . . 377 LEU CG . 15275 1 497 . 1 1 67 67 LEU N N 15 114.60 0.1 . 1 . . . . 377 LEU N . 15275 1 498 . 1 1 68 68 ASN H H 1 7.71 0.03 . 1 . . . . 378 ASN H . 15275 1 499 . 1 1 68 68 ASN HA H 1 5.06 0.03 . 1 . . . . 378 ASN HA . 15275 1 500 . 1 1 68 68 ASN HB2 H 1 2.65 0.03 . 1 . . . . 378 ASN HB2 . 15275 1 501 . 1 1 68 68 ASN HB3 H 1 2.91 0.03 . 1 . . . . 378 ASN HB3 . 15275 1 502 . 1 1 68 68 ASN HD21 H 1 7.74 0.03 . 1 . . . . 378 ASN HD21 . 15275 1 503 . 1 1 68 68 ASN HD22 H 1 6.93 0.03 . 1 . . . . 378 ASN HD22 . 15275 1 504 . 1 1 68 68 ASN C C 13 171.13 0.1 . 1 . . . . 378 ASN C . 15275 1 505 . 1 1 68 68 ASN CA C 13 50.46 0.1 . 1 . . . . 378 ASN CA . 15275 1 506 . 1 1 68 68 ASN CB C 13 38.68 0.1 . 1 . . . . 378 ASN CB . 15275 1 507 . 1 1 68 68 ASN N N 15 115.27 0.1 . 1 . . . . 378 ASN N . 15275 1 508 . 1 1 68 68 ASN ND2 N 15 112.90 0.1 . 1 . . . . 378 ASN ND2 . 15275 1 509 . 1 1 69 69 PRO HA H 1 4.45 0.03 . 1 . . . . 379 PRO HA . 15275 1 510 . 1 1 69 69 PRO HB2 H 1 1.68 0.03 . 2 . . . . 379 PRO HB2 . 15275 1 511 . 1 1 69 69 PRO HB3 H 1 1.93 0.03 . 2 . . . . 379 PRO HB3 . 15275 1 512 . 1 1 69 69 PRO HD2 H 1 3.59 0.03 . 1 . . . . 379 PRO HD2 . 15275 1 513 . 1 1 69 69 PRO HD3 H 1 3.41 0.03 . 1 . . . . 379 PRO HD3 . 15275 1 514 . 1 1 69 69 PRO HG2 H 1 1.37 0.03 . 2 . . . . 379 PRO HG2 . 15275 1 515 . 1 1 69 69 PRO HG3 H 1 1.48 0.03 . 2 . . . . 379 PRO HG3 . 15275 1 516 . 1 1 69 69 PRO C C 13 178.12 0.1 . 1 . . . . 379 PRO C . 15275 1 517 . 1 1 69 69 PRO CA C 13 64.18 0.1 . 1 . . . . 379 PRO CA . 15275 1 518 . 1 1 69 69 PRO CB C 13 31.70 0.1 . 1 . . . . 379 PRO CB . 15275 1 519 . 1 1 69 69 PRO CD C 13 49.29 0.1 . 1 . . . . 379 PRO CD . 15275 1 520 . 1 1 69 69 PRO CG C 13 27.56 0.1 . 1 . . . . 379 PRO CG . 15275 1 521 . 1 1 70 70 LYS H H 1 7.73 0.03 . 1 . . . . 380 LYS H . 15275 1 522 . 1 1 70 70 LYS HA H 1 4.14 0.03 . 1 . . . . 380 LYS HA . 15275 1 523 . 1 1 70 70 LYS HB2 H 1 1.84 0.03 . 1 . . . . 380 LYS HB2 . 15275 1 524 . 1 1 70 70 LYS HB3 H 1 1.93 0.03 . 1 . . . . 380 LYS HB3 . 15275 1 525 . 1 1 70 70 LYS HE2 H 1 3.02 0.03 . 2 . . . . 380 LYS HE2 . 15275 1 526 . 1 1 70 70 LYS C C 13 177.86 0.1 . 1 . . . . 380 LYS C . 15275 1 527 . 1 1 70 70 LYS CA C 13 58.72 0.1 . 1 . . . . 380 LYS CA . 15275 1 528 . 1 1 70 70 LYS CB C 13 31.98 0.1 . 1 . . . . 380 LYS CB . 15275 1 529 . 1 1 70 70 LYS CD C 13 29.44 0.1 . 1 . . . . 380 LYS CD . 15275 1 530 . 1 1 70 70 LYS CE C 13 41.93 0.1 . 1 . . . . 380 LYS CE . 15275 1 531 . 1 1 70 70 LYS CG C 13 24.94 0.1 . 1 . . . . 380 LYS CG . 15275 1 532 . 1 1 70 70 LYS N N 15 117.69 0.1 . 1 . . . . 380 LYS N . 15275 1 533 . 1 1 71 71 ILE H H 1 7.83 0.03 . 1 . . . . 381 ILE H . 15275 1 534 . 1 1 71 71 ILE HA H 1 4.21 0.03 . 1 . . . . 381 ILE HA . 15275 1 535 . 1 1 71 71 ILE HB H 1 2.06 0.03 . 1 . . . . 381 ILE HB . 15275 1 536 . 1 1 71 71 ILE HD11 H 1 0.67 0.03 . 1 . . . . 381 ILE HD1 . 15275 1 537 . 1 1 71 71 ILE HD12 H 1 0.67 0.03 . 1 . . . . 381 ILE HD1 . 15275 1 538 . 1 1 71 71 ILE HD13 H 1 0.67 0.03 . 1 . . . . 381 ILE HD1 . 15275 1 539 . 1 1 71 71 ILE HG12 H 1 1.08 0.03 . 2 . . . . 381 ILE HG12 . 15275 1 540 . 1 1 71 71 ILE HG13 H 1 1.08 0.03 . 2 . . . . 381 ILE HG13 . 15275 1 541 . 1 1 71 71 ILE HG21 H 1 0.90 0.03 . 1 . . . . 381 ILE HG2 . 15275 1 542 . 1 1 71 71 ILE HG22 H 1 0.90 0.03 . 1 . . . . 381 ILE HG2 . 15275 1 543 . 1 1 71 71 ILE HG23 H 1 0.90 0.03 . 1 . . . . 381 ILE HG2 . 15275 1 544 . 1 1 71 71 ILE C C 13 176.30 0.1 . 1 . . . . 381 ILE C . 15275 1 545 . 1 1 71 71 ILE CA C 13 61.97 0.1 . 1 . . . . 381 ILE CA . 15275 1 546 . 1 1 71 71 ILE CB C 13 38.41 0.1 . 1 . . . . 381 ILE CB . 15275 1 547 . 1 1 71 71 ILE CD1 C 13 14.21 0.1 . 1 . . . . 381 ILE CD1 . 15275 1 548 . 1 1 71 71 ILE CG1 C 13 25.78 0.1 . 1 . . . . 381 ILE CG1 . 15275 1 549 . 1 1 71 71 ILE CG2 C 13 17.49 0.1 . 1 . . . . 381 ILE CG2 . 15275 1 550 . 1 1 71 71 ILE N N 15 112.78 0.1 . 1 . . . . 381 ILE N . 15275 1 551 . 1 1 72 72 ILE H H 1 7.45 0.03 . 1 . . . . 382 ILE H . 15275 1 552 . 1 1 72 72 ILE HA H 1 3.49 0.03 . 1 . . . . 382 ILE HA . 15275 1 553 . 1 1 72 72 ILE HB H 1 1.95 0.03 . 1 . . . . 382 ILE HB . 15275 1 554 . 1 1 72 72 ILE HD11 H 1 0.79 0.03 . 1 . . . . 382 ILE HD1 . 15275 1 555 . 1 1 72 72 ILE HD12 H 1 0.79 0.03 . 1 . . . . 382 ILE HD1 . 15275 1 556 . 1 1 72 72 ILE HD13 H 1 0.79 0.03 . 1 . . . . 382 ILE HD1 . 15275 1 557 . 1 1 72 72 ILE HG12 H 1 0.64 0.03 . 2 . . . . 382 ILE HG12 . 15275 1 558 . 1 1 72 72 ILE HG13 H 1 0.64 0.03 . 2 . . . . 382 ILE HG13 . 15275 1 559 . 1 1 72 72 ILE HG21 H 1 0.77 0.03 . 1 . . . . 382 ILE HG2 . 15275 1 560 . 1 1 72 72 ILE HG22 H 1 0.77 0.03 . 1 . . . . 382 ILE HG2 . 15275 1 561 . 1 1 72 72 ILE HG23 H 1 0.77 0.03 . 1 . . . . 382 ILE HG2 . 15275 1 562 . 1 1 72 72 ILE C C 13 173.13 0.1 . 1 . . . . 382 ILE C . 15275 1 563 . 1 1 72 72 ILE CA C 13 64.10 0.1 . 1 . . . . 382 ILE CA . 15275 1 564 . 1 1 72 72 ILE CB C 13 36.63 0.1 . 1 . . . . 382 ILE CB . 15275 1 565 . 1 1 72 72 ILE CD1 C 13 13.96 0.1 . 1 . . . . 382 ILE CD1 . 15275 1 566 . 1 1 72 72 ILE CG1 C 13 29.11 0.1 . 1 . . . . 382 ILE CG1 . 15275 1 567 . 1 1 72 72 ILE CG2 C 13 18.98 0.1 . 1 . . . . 382 ILE CG2 . 15275 1 568 . 1 1 72 72 ILE N N 15 121.09 0.1 . 1 . . . . 382 ILE N . 15275 1 569 . 1 1 73 73 ASP H H 1 7.58 0.03 . 1 . . . . 383 ASP H . 15275 1 570 . 1 1 73 73 ASP HA H 1 4.80 0.03 . 1 . . . . 383 ASP HA . 15275 1 571 . 1 1 73 73 ASP HB2 H 1 2.76 0.03 . 1 . . . . 383 ASP HB2 . 15275 1 572 . 1 1 73 73 ASP HB3 H 1 3.25 0.03 . 1 . . . . 383 ASP HB3 . 15275 1 573 . 1 1 73 73 ASP C C 13 176.15 0.1 . 1 . . . . 383 ASP C . 15275 1 574 . 1 1 73 73 ASP CA C 13 51.97 0.1 . 1 . . . . 383 ASP CA . 15275 1 575 . 1 1 73 73 ASP CB C 13 42.28 0.1 . 1 . . . . 383 ASP CB . 15275 1 576 . 1 1 73 73 ASP N N 15 130.96 0.1 . 1 . . . . 383 ASP N . 15275 1 577 . 1 1 74 74 SER H H 1 8.61 0.03 . 1 . . . . 384 SER H . 15275 1 578 . 1 1 74 74 SER HA H 1 5.09 0.03 . 1 . . . . 384 SER HA . 15275 1 579 . 1 1 74 74 SER HB2 H 1 3.94 0.03 . 2 . . . . 384 SER HB2 . 15275 1 580 . 1 1 74 74 SER HB3 H 1 3.94 0.03 . 2 . . . . 384 SER HB3 . 15275 1 581 . 1 1 74 74 SER CA C 13 62.63 0.1 . 1 . . . . 384 SER CA . 15275 1 582 . 1 1 74 74 SER N N 15 113.80 0.1 . 1 . . . . 384 SER N . 15275 1 583 . 1 1 75 75 SER HA H 1 4.25 0.03 . 1 . . . . 385 SER HA . 15275 1 584 . 1 1 75 75 SER HB2 H 1 3.72 0.03 . 2 . . . . 385 SER HB2 . 15275 1 585 . 1 1 75 75 SER C C 13 177.36 0.1 . 1 . . . . 385 SER C . 15275 1 586 . 1 1 75 75 SER CA C 13 61.66 0.1 . 1 . . . . 385 SER CA . 15275 1 587 . 1 1 75 75 SER CB C 13 62.70 0.1 . 1 . . . . 385 SER CB . 15275 1 588 . 1 1 76 76 ARG H H 1 8.09 0.03 . 1 . . . . 386 ARG H . 15275 1 589 . 1 1 76 76 ARG HA H 1 4.16 0.03 . 1 . . . . 386 ARG HA . 15275 1 590 . 1 1 76 76 ARG HB2 H 1 1.76 0.03 . 1 . . . . 386 ARG HB2 . 15275 1 591 . 1 1 76 76 ARG HB3 H 1 1.99 0.03 . 1 . . . . 386 ARG HB3 . 15275 1 592 . 1 1 76 76 ARG HD2 H 1 3.40 0.03 . 2 . . . . 386 ARG HD2 . 15275 1 593 . 1 1 76 76 ARG HD3 H 1 3.40 0.03 . 2 . . . . 386 ARG HD3 . 15275 1 594 . 1 1 76 76 ARG HG2 H 1 1.61 0.03 . 2 . . . . 386 ARG HG2 . 15275 1 595 . 1 1 76 76 ARG C C 13 178.11 0.1 . 1 . . . . 386 ARG C . 15275 1 596 . 1 1 76 76 ARG CA C 13 59.58 0.1 . 1 . . . . 386 ARG CA . 15275 1 597 . 1 1 76 76 ARG CB C 13 29.93 0.1 . 1 . . . . 386 ARG CB . 15275 1 598 . 1 1 76 76 ARG CD C 13 43.87 0.1 . 1 . . . . 386 ARG CD . 15275 1 599 . 1 1 76 76 ARG N N 15 124.66 0.1 . 1 . . . . 386 ARG N . 15275 1 600 . 1 1 77 77 ILE H H 1 8.76 0.03 . 1 . . . . 387 ILE H . 15275 1 601 . 1 1 77 77 ILE HA H 1 3.38 0.03 . 1 . . . . 387 ILE HA . 15275 1 602 . 1 1 77 77 ILE HB H 1 1.90 0.03 . 1 . . . . 387 ILE HB . 15275 1 603 . 1 1 77 77 ILE HD11 H 1 0.66 0.03 . 1 . . . . 387 ILE HD1 . 15275 1 604 . 1 1 77 77 ILE HD12 H 1 0.66 0.03 . 1 . . . . 387 ILE HD1 . 15275 1 605 . 1 1 77 77 ILE HD13 H 1 0.66 0.03 . 1 . . . . 387 ILE HD1 . 15275 1 606 . 1 1 77 77 ILE HG12 H 1 0.64 0.03 . 2 . . . . 387 ILE HG12 . 15275 1 607 . 1 1 77 77 ILE HG13 H 1 0.64 0.03 . 2 . . . . 387 ILE HG13 . 15275 1 608 . 1 1 77 77 ILE HG21 H 1 0.85 0.03 . 1 . . . . 387 ILE HG2 . 15275 1 609 . 1 1 77 77 ILE HG22 H 1 0.85 0.03 . 1 . . . . 387 ILE HG2 . 15275 1 610 . 1 1 77 77 ILE HG23 H 1 0.85 0.03 . 1 . . . . 387 ILE HG2 . 15275 1 611 . 1 1 77 77 ILE C C 13 177.10 0.1 . 1 . . . . 387 ILE C . 15275 1 612 . 1 1 77 77 ILE CA C 13 66.86 0.1 . 1 . . . . 387 ILE CA . 15275 1 613 . 1 1 77 77 ILE CB C 13 37.34 0.1 . 1 . . . . 387 ILE CB . 15275 1 614 . 1 1 77 77 ILE CD1 C 13 13.19 0.1 . 1 . . . . 387 ILE CD1 . 15275 1 615 . 1 1 77 77 ILE CG1 C 13 30.55 0.1 . 1 . . . . 387 ILE CG1 . 15275 1 616 . 1 1 77 77 ILE CG2 C 13 17.42 0.1 . 1 . . . . 387 ILE CG2 . 15275 1 617 . 1 1 77 77 ILE N N 15 119.26 0.1 . 1 . . . . 387 ILE N . 15275 1 618 . 1 1 78 78 ARG H H 1 7.56 0.03 . 1 . . . . 388 ARG H . 15275 1 619 . 1 1 78 78 ARG HA H 1 3.87 0.03 . 1 . . . . 388 ARG HA . 15275 1 620 . 1 1 78 78 ARG HB2 H 1 1.95 0.03 . 2 . . . . 388 ARG HB2 . 15275 1 621 . 1 1 78 78 ARG HB3 H 1 1.95 0.03 . 2 . . . . 388 ARG HB3 . 15275 1 622 . 1 1 78 78 ARG HD2 H 1 3.23 0.03 . 2 . . . . 388 ARG HD2 . 15275 1 623 . 1 1 78 78 ARG HD3 H 1 3.23 0.03 . 2 . . . . 388 ARG HD3 . 15275 1 624 . 1 1 78 78 ARG HG2 H 1 1.60 0.03 . 2 . . . . 388 ARG HG2 . 15275 1 625 . 1 1 78 78 ARG HG3 H 1 1.60 0.03 . 2 . . . . 388 ARG HG3 . 15275 1 626 . 1 1 78 78 ARG C C 13 177.55 0.1 . 1 . . . . 388 ARG C . 15275 1 627 . 1 1 78 78 ARG CA C 13 60.16 0.1 . 1 . . . . 388 ARG CA . 15275 1 628 . 1 1 78 78 ARG CB C 13 29.85 0.1 . 1 . . . . 388 ARG CB . 15275 1 629 . 1 1 78 78 ARG CD C 13 43.43 0.1 . 1 . . . . 388 ARG CD . 15275 1 630 . 1 1 78 78 ARG CG C 13 27.73 0.1 . 1 . . . . 388 ARG CG . 15275 1 631 . 1 1 78 78 ARG N N 15 118.05 0.1 . 1 . . . . 388 ARG N . 15275 1 632 . 1 1 79 79 ARG H H 1 7.40 0.03 . 1 . . . . 389 ARG H . 15275 1 633 . 1 1 79 79 ARG HA H 1 3.85 0.03 . 1 . . . . 389 ARG HA . 15275 1 634 . 1 1 79 79 ARG HB2 H 1 2.06 0.03 . 2 . . . . 389 ARG HB2 . 15275 1 635 . 1 1 79 79 ARG HB3 H 1 2.06 0.03 . 2 . . . . 389 ARG HB3 . 15275 1 636 . 1 1 79 79 ARG C C 13 179.98 0.1 . 1 . . . . 389 ARG C . 15275 1 637 . 1 1 79 79 ARG CA C 13 59.77 0.1 . 1 . . . . 389 ARG CA . 15275 1 638 . 1 1 79 79 ARG CB C 13 30.53 0.1 . 1 . . . . 389 ARG CB . 15275 1 639 . 1 1 79 79 ARG CD C 13 42.57 0.1 . 1 . . . . 389 ARG CD . 15275 1 640 . 1 1 79 79 ARG N N 15 119.78 0.1 . 1 . . . . 389 ARG N . 15275 1 641 . 1 1 80 80 ILE H H 1 8.88 0.03 . 1 . . . . 390 ILE H . 15275 1 642 . 1 1 80 80 ILE HA H 1 3.55 0.03 . 1 . . . . 390 ILE HA . 15275 1 643 . 1 1 80 80 ILE HB H 1 1.70 0.03 . 1 . . . . 390 ILE HB . 15275 1 644 . 1 1 80 80 ILE HD11 H 1 0.72 0.03 . 1 . . . . 390 ILE HD1 . 15275 1 645 . 1 1 80 80 ILE HD12 H 1 0.72 0.03 . 1 . . . . 390 ILE HD1 . 15275 1 646 . 1 1 80 80 ILE HD13 H 1 0.72 0.03 . 1 . . . . 390 ILE HD1 . 15275 1 647 . 1 1 80 80 ILE HG12 H 1 0.78 0.03 . 2 . . . . 390 ILE HG12 . 15275 1 648 . 1 1 80 80 ILE HG13 H 1 0.78 0.03 . 2 . . . . 390 ILE HG13 . 15275 1 649 . 1 1 80 80 ILE HG21 H 1 0.80 0.03 . 1 . . . . 390 ILE HG2 . 15275 1 650 . 1 1 80 80 ILE HG22 H 1 0.80 0.03 . 1 . . . . 390 ILE HG2 . 15275 1 651 . 1 1 80 80 ILE HG23 H 1 0.80 0.03 . 1 . . . . 390 ILE HG2 . 15275 1 652 . 1 1 80 80 ILE C C 13 179.36 0.1 . 1 . . . . 390 ILE C . 15275 1 653 . 1 1 80 80 ILE CA C 13 64.85 0.1 . 1 . . . . 390 ILE CA . 15275 1 654 . 1 1 80 80 ILE CB C 13 39.21 0.1 . 1 . . . . 390 ILE CB . 15275 1 655 . 1 1 80 80 ILE CD1 C 13 14.91 0.1 . 1 . . . . 390 ILE CD1 . 15275 1 656 . 1 1 80 80 ILE CG1 C 13 30.13 0.1 . 1 . . . . 390 ILE CG1 . 15275 1 657 . 1 1 80 80 ILE CG2 C 13 20.18 0.1 . 1 . . . . 390 ILE CG2 . 15275 1 658 . 1 1 80 80 ILE N N 15 121.35 0.1 . 1 . . . . 390 ILE N . 15275 1 659 . 1 1 81 81 ALA H H 1 8.85 0.03 . 1 . . . . 391 ALA H . 15275 1 660 . 1 1 81 81 ALA HA H 1 3.77 0.03 . 1 . . . . 391 ALA HA . 15275 1 661 . 1 1 81 81 ALA HB1 H 1 1.29 0.03 . 1 . . . . 391 ALA HB . 15275 1 662 . 1 1 81 81 ALA HB2 H 1 1.29 0.03 . 1 . . . . 391 ALA HB . 15275 1 663 . 1 1 81 81 ALA HB3 H 1 1.29 0.03 . 1 . . . . 391 ALA HB . 15275 1 664 . 1 1 81 81 ALA C C 13 179.00 0.1 . 1 . . . . 391 ALA C . 15275 1 665 . 1 1 81 81 ALA CA C 13 55.23 0.1 . 1 . . . . 391 ALA CA . 15275 1 666 . 1 1 81 81 ALA CB C 13 17.66 0.1 . 1 . . . . 391 ALA CB . 15275 1 667 . 1 1 81 81 ALA N N 15 125.76 0.1 . 1 . . . . 391 ALA N . 15275 1 668 . 1 1 82 82 ILE H H 1 8.05 0.03 . 1 . . . . 392 ILE H . 15275 1 669 . 1 1 82 82 ILE HA H 1 3.83 0.03 . 1 . . . . 392 ILE HA . 15275 1 670 . 1 1 82 82 ILE HB H 1 1.87 0.03 . 1 . . . . 392 ILE HB . 15275 1 671 . 1 1 82 82 ILE HD11 H 1 0.86 0.03 . 1 . . . . 392 ILE HD1 . 15275 1 672 . 1 1 82 82 ILE HD12 H 1 0.86 0.03 . 1 . . . . 392 ILE HD1 . 15275 1 673 . 1 1 82 82 ILE HD13 H 1 0.86 0.03 . 1 . . . . 392 ILE HD1 . 15275 1 674 . 1 1 82 82 ILE HG12 H 1 1.22 0.03 . 2 . . . . 392 ILE HG12 . 15275 1 675 . 1 1 82 82 ILE HG13 H 1 1.22 0.03 . 2 . . . . 392 ILE HG13 . 15275 1 676 . 1 1 82 82 ILE HG21 H 1 0.93 0.03 . 1 . . . . 392 ILE HG2 . 15275 1 677 . 1 1 82 82 ILE HG22 H 1 0.93 0.03 . 1 . . . . 392 ILE HG2 . 15275 1 678 . 1 1 82 82 ILE HG23 H 1 0.93 0.03 . 1 . . . . 392 ILE HG2 . 15275 1 679 . 1 1 82 82 ILE C C 13 180.58 0.1 . 1 . . . . 392 ILE C . 15275 1 680 . 1 1 82 82 ILE CA C 13 64.58 0.1 . 1 . . . . 392 ILE CA . 15275 1 681 . 1 1 82 82 ILE CB C 13 38.12 0.1 . 1 . . . . 392 ILE CB . 15275 1 682 . 1 1 82 82 ILE CD1 C 13 13.20 0.1 . 1 . . . . 392 ILE CD1 . 15275 1 683 . 1 1 82 82 ILE CG1 C 13 29.44 0.1 . 1 . . . . 392 ILE CG1 . 15275 1 684 . 1 1 82 82 ILE CG2 C 13 17.10 0.1 . 1 . . . . 392 ILE CG2 . 15275 1 685 . 1 1 82 82 ILE N N 15 117.47 0.1 . 1 . . . . 392 ILE N . 15275 1 686 . 1 1 83 83 GLY H H 1 8.58 0.03 . 1 . . . . 393 GLY H . 15275 1 687 . 1 1 83 83 GLY HA2 H 1 3.88 0.03 . 2 . . . . 393 GLY HA2 . 15275 1 688 . 1 1 83 83 GLY HA3 H 1 3.88 0.03 . 2 . . . . 393 GLY HA3 . 15275 1 689 . 1 1 83 83 GLY C C 13 174.70 0.1 . 1 . . . . 393 GLY C . 15275 1 690 . 1 1 83 83 GLY CA C 13 47.29 0.1 . 1 . . . . 393 GLY CA . 15275 1 691 . 1 1 83 83 GLY N N 15 107.99 0.1 . 1 . . . . 393 GLY N . 15275 1 692 . 1 1 84 84 SER H H 1 7.99 0.03 . 1 . . . . 394 SER H . 15275 1 693 . 1 1 84 84 SER HA H 1 4.45 0.03 . 1 . . . . 394 SER HA . 15275 1 694 . 1 1 84 84 SER HB2 H 1 3.94 0.03 . 2 . . . . 394 SER HB2 . 15275 1 695 . 1 1 84 84 SER HB3 H 1 3.94 0.03 . 2 . . . . 394 SER HB3 . 15275 1 696 . 1 1 84 84 SER C C 13 175.28 0.1 . 1 . . . . 394 SER C . 15275 1 697 . 1 1 84 84 SER CA C 13 58.38 0.1 . 1 . . . . 394 SER CA . 15275 1 698 . 1 1 84 84 SER CB C 13 66.22 0.1 . 1 . . . . 394 SER CB . 15275 1 699 . 1 1 84 84 SER N N 15 110.90 0.1 . 1 . . . . 394 SER N . 15275 1 700 . 1 1 85 85 GLY H H 1 7.80 0.03 . 1 . . . . 395 GLY H . 15275 1 701 . 1 1 85 85 GLY HA2 H 1 3.99 0.03 . 2 . . . . 395 GLY HA2 . 15275 1 702 . 1 1 85 85 GLY HA3 H 1 3.99 0.03 . 2 . . . . 395 GLY HA3 . 15275 1 703 . 1 1 85 85 GLY C C 13 175.36 0.1 . 1 . . . . 395 GLY C . 15275 1 704 . 1 1 85 85 GLY CA C 13 46.76 0.1 . 1 . . . . 395 GLY CA . 15275 1 705 . 1 1 85 85 GLY N N 15 112.27 0.1 . 1 . . . . 395 GLY N . 15275 1 706 . 1 1 86 86 THR H H 1 8.33 0.03 . 1 . . . . 396 THR H . 15275 1 707 . 1 1 86 86 THR HA H 1 4.63 0.03 . 1 . . . . 396 THR HA . 15275 1 708 . 1 1 86 86 THR HB H 1 4.34 0.03 . 1 . . . . 396 THR HB . 15275 1 709 . 1 1 86 86 THR HG21 H 1 1.02 0.03 . 1 . . . . 396 THR HG2 . 15275 1 710 . 1 1 86 86 THR HG22 H 1 1.02 0.03 . 1 . . . . 396 THR HG2 . 15275 1 711 . 1 1 86 86 THR HG23 H 1 1.02 0.03 . 1 . . . . 396 THR HG2 . 15275 1 712 . 1 1 86 86 THR C C 13 173.34 0.1 . 1 . . . . 396 THR C . 15275 1 713 . 1 1 86 86 THR CA C 13 60.17 0.1 . 1 . . . . 396 THR CA . 15275 1 714 . 1 1 86 86 THR CB C 13 70.03 0.1 . 1 . . . . 396 THR CB . 15275 1 715 . 1 1 86 86 THR CG2 C 13 21.31 0.1 . 1 . . . . 396 THR CG2 . 15275 1 716 . 1 1 86 86 THR N N 15 111.61 0.1 . 1 . . . . 396 THR N . 15275 1 717 . 1 1 87 87 SER H H 1 8.55 0.03 . 1 . . . . 397 SER H . 15275 1 718 . 1 1 87 87 SER HA H 1 5.04 0.03 . 1 . . . . 397 SER HA . 15275 1 719 . 1 1 87 87 SER HB2 H 1 3.99 0.03 . 1 . . . . 397 SER HB2 . 15275 1 720 . 1 1 87 87 SER HB3 H 1 4.23 0.03 . 1 . . . . 397 SER HB3 . 15275 1 721 . 1 1 87 87 SER C C 13 174.09 0.1 . 1 . . . . 397 SER C . 15275 1 722 . 1 1 87 87 SER CA C 13 56.11 0.1 . 1 . . . . 397 SER CA . 15275 1 723 . 1 1 87 87 SER CB C 13 64.18 0.1 . 1 . . . . 397 SER CB . 15275 1 724 . 1 1 87 87 SER N N 15 114.97 0.1 . 1 . . . . 397 SER N . 15275 1 725 . 1 1 88 88 PRO HA H 1 4.52 0.03 . 1 . . . . 398 PRO HA . 15275 1 726 . 1 1 88 88 PRO HD2 H 1 3.95 0.03 . 2 . . . . 398 PRO HD2 . 15275 1 727 . 1 1 88 88 PRO HD3 H 1 3.88 0.03 . 2 . . . . 398 PRO HD3 . 15275 1 728 . 1 1 88 88 PRO HG2 H 1 2.27 0.03 . 2 . . . . 398 PRO HG2 . 15275 1 729 . 1 1 88 88 PRO HG3 H 1 1.76 0.03 . 2 . . . . 398 PRO HG3 . 15275 1 730 . 1 1 88 88 PRO C C 13 177.97 0.1 . 1 . . . . 398 PRO C . 15275 1 731 . 1 1 88 88 PRO CA C 13 66.09 0.1 . 1 . . . . 398 PRO CA . 15275 1 732 . 1 1 88 88 PRO CB C 13 31.91 0.1 . 1 . . . . 398 PRO CB . 15275 1 733 . 1 1 88 88 PRO CD C 13 50.41 0.1 . 1 . . . . 398 PRO CD . 15275 1 734 . 1 1 88 88 PRO CG C 13 28.42 0.1 . 1 . . . . 398 PRO CG . 15275 1 735 . 1 1 89 89 GLN H H 1 8.44 0.03 . 1 . . . . 399 GLN H . 15275 1 736 . 1 1 89 89 GLN HA H 1 3.94 0.03 . 1 . . . . 399 GLN HA . 15275 1 737 . 1 1 89 89 GLN HB2 H 1 1.99 0.03 . 2 . . . . 399 GLN HB2 . 15275 1 738 . 1 1 89 89 GLN HB3 H 1 2.15 0.03 . 2 . . . . 399 GLN HB3 . 15275 1 739 . 1 1 89 89 GLN HE21 H 1 7.63 0.03 . 1 . . . . 399 GLN HE21 . 15275 1 740 . 1 1 89 89 GLN HE22 H 1 6.86 0.03 . 1 . . . . 399 GLN HE22 . 15275 1 741 . 1 1 89 89 GLN HG2 H 1 2.41 0.03 . 1 . . . . 399 GLN HG2 . 15275 1 742 . 1 1 89 89 GLN HG3 H 1 2.51 0.03 . 1 . . . . 399 GLN HG3 . 15275 1 743 . 1 1 89 89 GLN C C 13 178.68 0.1 . 1 . . . . 399 GLN C . 15275 1 744 . 1 1 89 89 GLN CA C 13 59.60 0.1 . 1 . . . . 399 GLN CA . 15275 1 745 . 1 1 89 89 GLN CB C 13 27.91 0.1 . 1 . . . . 399 GLN CB . 15275 1 746 . 1 1 89 89 GLN CG C 13 33.71 0.1 . 1 . . . . 399 GLN CG . 15275 1 747 . 1 1 89 89 GLN N N 15 115.47 0.1 . 1 . . . . 399 GLN N . 15275 1 748 . 1 1 89 89 GLN NE2 N 15 112.19 0.1 . 1 . . . . 399 GLN NE2 . 15275 1 749 . 1 1 90 90 GLU H H 1 7.84 0.03 . 1 . . . . 400 GLU H . 15275 1 750 . 1 1 90 90 GLU HA H 1 4.14 0.03 . 1 . . . . 400 GLU HA . 15275 1 751 . 1 1 90 90 GLU HB2 H 1 2.00 0.03 . 2 . . . . 400 GLU HB2 . 15275 1 752 . 1 1 90 90 GLU HB3 H 1 2.41 0.03 . 2 . . . . 400 GLU HB3 . 15275 1 753 . 1 1 90 90 GLU HG2 H 1 2.29 0.03 . 2 . . . . 400 GLU HG2 . 15275 1 754 . 1 1 90 90 GLU HG3 H 1 2.29 0.03 . 2 . . . . 400 GLU HG3 . 15275 1 755 . 1 1 90 90 GLU C C 13 178.58 0.1 . 1 . . . . 400 GLU C . 15275 1 756 . 1 1 90 90 GLU CA C 13 59.62 0.1 . 1 . . . . 400 GLU CA . 15275 1 757 . 1 1 90 90 GLU CB C 13 30.03 0.1 . 1 . . . . 400 GLU CB . 15275 1 758 . 1 1 90 90 GLU CG C 13 38.39 0.1 . 1 . . . . 400 GLU CG . 15275 1 759 . 1 1 90 90 GLU N N 15 120.81 0.1 . 1 . . . . 400 GLU N . 15275 1 760 . 1 1 91 91 VAL H H 1 7.68 0.03 . 1 . . . . 401 VAL H . 15275 1 761 . 1 1 91 91 VAL HA H 1 3.59 0.03 . 1 . . . . 401 VAL HA . 15275 1 762 . 1 1 91 91 VAL HB H 1 2.26 0.03 . 1 . . . . 401 VAL HB . 15275 1 763 . 1 1 91 91 VAL HG11 H 1 0.82 0.03 . 2 . . . . 401 VAL HG1 . 15275 1 764 . 1 1 91 91 VAL HG12 H 1 0.82 0.03 . 2 . . . . 401 VAL HG1 . 15275 1 765 . 1 1 91 91 VAL HG13 H 1 0.82 0.03 . 2 . . . . 401 VAL HG1 . 15275 1 766 . 1 1 91 91 VAL HG21 H 1 0.96 0.03 . 2 . . . . 401 VAL HG2 . 15275 1 767 . 1 1 91 91 VAL HG22 H 1 0.96 0.03 . 2 . . . . 401 VAL HG2 . 15275 1 768 . 1 1 91 91 VAL HG23 H 1 0.96 0.03 . 2 . . . . 401 VAL HG2 . 15275 1 769 . 1 1 91 91 VAL C C 13 178.35 0.1 . 1 . . . . 401 VAL C . 15275 1 770 . 1 1 91 91 VAL CA C 13 66.91 0.1 . 1 . . . . 401 VAL CA . 15275 1 771 . 1 1 91 91 VAL CB C 13 31.70 0.1 . 1 . . . . 401 VAL CB . 15275 1 772 . 1 1 91 91 VAL CG1 C 13 21.61 0.1 . 2 . . . . 401 VAL CG1 . 15275 1 773 . 1 1 91 91 VAL CG2 C 13 21.91 0.1 . 2 . . . . 401 VAL CG2 . 15275 1 774 . 1 1 91 91 VAL N N 15 119.73 0.1 . 1 . . . . 401 VAL N . 15275 1 775 . 1 1 92 92 LYS H H 1 8.31 0.03 . 1 . . . . 402 LYS H . 15275 1 776 . 1 1 92 92 LYS HA H 1 3.82 0.03 . 1 . . . . 402 LYS HA . 15275 1 777 . 1 1 92 92 LYS HB2 H 1 1.90 0.03 . 2 . . . . 402 LYS HB2 . 15275 1 778 . 1 1 92 92 LYS HB3 H 1 1.90 0.03 . 2 . . . . 402 LYS HB3 . 15275 1 779 . 1 1 92 92 LYS HD2 H 1 1.63 0.03 . 2 . . . . 402 LYS HD2 . 15275 1 780 . 1 1 92 92 LYS HE2 H 1 2.88 0.03 . 2 . . . . 402 LYS HE2 . 15275 1 781 . 1 1 92 92 LYS HG2 H 1 1.42 0.03 . 2 . . . . 402 LYS HG2 . 15275 1 782 . 1 1 92 92 LYS C C 13 178.59 0.1 . 1 . . . . 402 LYS C . 15275 1 783 . 1 1 92 92 LYS CA C 13 60.30 0.1 . 1 . . . . 402 LYS CA . 15275 1 784 . 1 1 92 92 LYS CB C 13 31.94 0.1 . 1 . . . . 402 LYS CB . 15275 1 785 . 1 1 92 92 LYS CD C 13 29.53 0.1 . 1 . . . . 402 LYS CD . 15275 1 786 . 1 1 92 92 LYS CE C 13 42.06 0.1 . 1 . . . . 402 LYS CE . 15275 1 787 . 1 1 92 92 LYS CG C 13 26.28 0.1 . 1 . . . . 402 LYS CG . 15275 1 788 . 1 1 92 92 LYS N N 15 118.44 0.1 . 1 . . . . 402 LYS N . 15275 1 789 . 1 1 93 93 GLU H H 1 8.07 0.03 . 1 . . . . 403 GLU H . 15275 1 790 . 1 1 93 93 GLU HA H 1 4.14 0.03 . 1 . . . . 403 GLU HA . 15275 1 791 . 1 1 93 93 GLU HB2 H 1 2.33 0.03 . 1 . . . . 403 GLU HB2 . 15275 1 792 . 1 1 93 93 GLU HB3 H 1 2.40 0.03 . 1 . . . . 403 GLU HB3 . 15275 1 793 . 1 1 93 93 GLU HG2 H 1 2.62 0.03 . 2 . . . . 403 GLU HG2 . 15275 1 794 . 1 1 93 93 GLU HG3 H 1 2.35 0.03 . 2 . . . . 403 GLU HG3 . 15275 1 795 . 1 1 93 93 GLU C C 13 179.52 0.1 . 1 . . . . 403 GLU C . 15275 1 796 . 1 1 93 93 GLU CA C 13 59.94 0.1 . 1 . . . . 403 GLU CA . 15275 1 797 . 1 1 93 93 GLU CB C 13 29.56 0.1 . 1 . . . . 403 GLU CB . 15275 1 798 . 1 1 93 93 GLU CG C 13 36.71 0.1 . 1 . . . . 403 GLU CG . 15275 1 799 . 1 1 93 93 GLU N N 15 120.72 0.1 . 1 . . . . 403 GLU N . 15275 1 800 . 1 1 94 94 LEU H H 1 7.34 0.03 . 1 . . . . 404 LEU H . 15275 1 801 . 1 1 94 94 LEU HA H 1 3.45 0.03 . 1 . . . . 404 LEU HA . 15275 1 802 . 1 1 94 94 LEU HB2 H 1 2.02 0.03 . 2 . . . . 404 LEU HB2 . 15275 1 803 . 1 1 94 94 LEU HB3 H 1 0.88 0.03 . 2 . . . . 404 LEU HB3 . 15275 1 804 . 1 1 94 94 LEU HD11 H 1 0.41 0.03 . 2 . . . . 404 LEU HD1 . 15275 1 805 . 1 1 94 94 LEU HD12 H 1 0.41 0.03 . 2 . . . . 404 LEU HD1 . 15275 1 806 . 1 1 94 94 LEU HD13 H 1 0.41 0.03 . 2 . . . . 404 LEU HD1 . 15275 1 807 . 1 1 94 94 LEU HD21 H 1 0.79 0.03 . 2 . . . . 404 LEU HD2 . 15275 1 808 . 1 1 94 94 LEU HD22 H 1 0.79 0.03 . 2 . . . . 404 LEU HD2 . 15275 1 809 . 1 1 94 94 LEU HD23 H 1 0.79 0.03 . 2 . . . . 404 LEU HD2 . 15275 1 810 . 1 1 94 94 LEU HG H 1 1.18 0.03 . 1 . . . . 404 LEU HG . 15275 1 811 . 1 1 94 94 LEU C C 13 178.22 0.1 . 1 . . . . 404 LEU C . 15275 1 812 . 1 1 94 94 LEU CA C 13 57.97 0.1 . 1 . . . . 404 LEU CA . 15275 1 813 . 1 1 94 94 LEU CB C 13 39.75 0.1 . 1 . . . . 404 LEU CB . 15275 1 814 . 1 1 94 94 LEU CD1 C 13 22.01 0.1 . 1 . . . . 404 LEU CD1 . 15275 1 815 . 1 1 94 94 LEU CD2 C 13 26.59 0.1 . 1 . . . . 404 LEU CD2 . 15275 1 816 . 1 1 94 94 LEU CG C 13 27.67 0.1 . 1 . . . . 404 LEU CG . 15275 1 817 . 1 1 94 94 LEU N N 15 122.05 0.1 . 1 . . . . 404 LEU N . 15275 1 818 . 1 1 95 95 LEU H H 1 7.88 0.03 . 1 . . . . 405 LEU H . 15275 1 819 . 1 1 95 95 LEU HA H 1 4.03 0.03 . 1 . . . . 405 LEU HA . 15275 1 820 . 1 1 95 95 LEU HB2 H 1 1.58 0.03 . 2 . . . . 405 LEU HB2 . 15275 1 821 . 1 1 95 95 LEU HB3 H 1 1.99 0.03 . 2 . . . . 405 LEU HB3 . 15275 1 822 . 1 1 95 95 LEU HD11 H 1 0.85 0.03 . 2 . . . . 405 LEU HD1 . 15275 1 823 . 1 1 95 95 LEU HD12 H 1 0.85 0.03 . 2 . . . . 405 LEU HD1 . 15275 1 824 . 1 1 95 95 LEU HD13 H 1 0.85 0.03 . 2 . . . . 405 LEU HD1 . 15275 1 825 . 1 1 95 95 LEU HD21 H 1 0.77 0.03 . 2 . . . . 405 LEU HD2 . 15275 1 826 . 1 1 95 95 LEU HD22 H 1 0.77 0.03 . 2 . . . . 405 LEU HD2 . 15275 1 827 . 1 1 95 95 LEU HD23 H 1 0.77 0.03 . 2 . . . . 405 LEU HD2 . 15275 1 828 . 1 1 95 95 LEU HG H 1 1.85 0.03 . 1 . . . . 405 LEU HG . 15275 1 829 . 1 1 95 95 LEU C C 13 179.73 0.1 . 1 . . . . 405 LEU C . 15275 1 830 . 1 1 95 95 LEU CA C 13 58.17 0.1 . 1 . . . . 405 LEU CA . 15275 1 831 . 1 1 95 95 LEU CB C 13 40.14 0.1 . 1 . . . . 405 LEU CB . 15275 1 832 . 1 1 95 95 LEU CD1 C 13 25.27 0.1 . 1 . . . . 405 LEU CD1 . 15275 1 833 . 1 1 95 95 LEU CD2 C 13 22.18 0.1 . 1 . . . . 405 LEU CD2 . 15275 1 834 . 1 1 95 95 LEU CG C 13 26.94 0.1 . 1 . . . . 405 LEU CG . 15275 1 835 . 1 1 95 95 LEU N N 15 119.00 0.1 . 1 . . . . 405 LEU N . 15275 1 836 . 1 1 96 96 ASN H H 1 8.78 0.03 . 1 . . . . 406 ASN H . 15275 1 837 . 1 1 96 96 ASN HA H 1 4.60 0.03 . 1 . . . . 406 ASN HA . 15275 1 838 . 1 1 96 96 ASN HB2 H 1 2.94 0.03 . 2 . . . . 406 ASN HB2 . 15275 1 839 . 1 1 96 96 ASN HB3 H 1 2.94 0.03 . 2 . . . . 406 ASN HB3 . 15275 1 840 . 1 1 96 96 ASN HD21 H 1 7.76 0.03 . 1 . . . . 406 ASN HD21 . 15275 1 841 . 1 1 96 96 ASN HD22 H 1 6.95 0.03 . 1 . . . . 406 ASN HD22 . 15275 1 842 . 1 1 96 96 ASN C C 13 177.86 0.1 . 1 . . . . 406 ASN C . 15275 1 843 . 1 1 96 96 ASN CA C 13 56.14 0.1 . 1 . . . . 406 ASN CA . 15275 1 844 . 1 1 96 96 ASN CB C 13 38.19 0.1 . 1 . . . . 406 ASN CB . 15275 1 845 . 1 1 96 96 ASN N N 15 119.69 0.1 . 1 . . . . 406 ASN N . 15275 1 846 . 1 1 96 96 ASN ND2 N 15 112.73 0.1 . 1 . . . . 406 ASN ND2 . 15275 1 847 . 1 1 97 97 TYR H H 1 8.48 0.03 . 1 . . . . 407 TYR H . 15275 1 848 . 1 1 97 97 TYR HA H 1 4.24 0.03 . 1 . . . . 407 TYR HA . 15275 1 849 . 1 1 97 97 TYR HB2 H 1 3.34 0.03 . 1 . . . . 407 TYR HB2 . 15275 1 850 . 1 1 97 97 TYR HB3 H 1 3.28 0.03 . 1 . . . . 407 TYR HB3 . 15275 1 851 . 1 1 97 97 TYR HD1 H 1 6.95 0.03 . 3 . . . . 407 TYR HD1 . 15275 1 852 . 1 1 97 97 TYR HD2 H 1 6.95 0.03 . 3 . . . . 407 TYR HD2 . 15275 1 853 . 1 1 97 97 TYR HE1 H 1 6.91 0.03 . 3 . . . . 407 TYR HE1 . 15275 1 854 . 1 1 97 97 TYR HE2 H 1 6.91 0.03 . 3 . . . . 407 TYR HE2 . 15275 1 855 . 1 1 97 97 TYR C C 13 177.18 0.1 . 1 . . . . 407 TYR C . 15275 1 856 . 1 1 97 97 TYR CA C 13 62.02 0.1 . 1 . . . . 407 TYR CA . 15275 1 857 . 1 1 97 97 TYR CB C 13 38.22 0.1 . 1 . . . . 407 TYR CB . 15275 1 858 . 1 1 97 97 TYR CE1 C 13 119.30 0.1 . 3 . . . . 407 TYR CE1 . 15275 1 859 . 1 1 97 97 TYR CE2 C 13 119.30 0.1 . 3 . . . . 407 TYR CE2 . 15275 1 860 . 1 1 97 97 TYR N N 15 125.97 0.1 . 1 . . . . 407 TYR N . 15275 1 861 . 1 1 98 98 TYR H H 1 8.63 0.03 . 1 . . . . 408 TYR H . 15275 1 862 . 1 1 98 98 TYR HA H 1 3.98 0.03 . 1 . . . . 408 TYR HA . 15275 1 863 . 1 1 98 98 TYR HB2 H 1 3.27 0.03 . 2 . . . . 408 TYR HB2 . 15275 1 864 . 1 1 98 98 TYR HB3 H 1 3.07 0.03 . 2 . . . . 408 TYR HB3 . 15275 1 865 . 1 1 98 98 TYR HD1 H 1 6.84 0.03 . 3 . . . . 408 TYR HD1 . 15275 1 866 . 1 1 98 98 TYR HD2 H 1 6.84 0.03 . 3 . . . . 408 TYR HD2 . 15275 1 867 . 1 1 98 98 TYR HE1 H 1 6.54 0.03 . 3 . . . . 408 TYR HE1 . 15275 1 868 . 1 1 98 98 TYR HE2 H 1 6.54 0.03 . 3 . . . . 408 TYR HE2 . 15275 1 869 . 1 1 98 98 TYR C C 13 175.81 0.1 . 1 . . . . 408 TYR C . 15275 1 870 . 1 1 98 98 TYR CA C 13 61.63 0.1 . 1 . . . . 408 TYR CA . 15275 1 871 . 1 1 98 98 TYR CB C 13 38.06 0.1 . 1 . . . . 408 TYR CB . 15275 1 872 . 1 1 98 98 TYR CE1 C 13 118.15 0.1 . 1 . . . . 408 TYR CE1 . 15275 1 873 . 1 1 98 98 TYR CE2 C 13 118.15 0.1 . 1 . . . . 408 TYR CE2 . 15275 1 874 . 1 1 98 98 TYR N N 15 119.22 0.1 . 1 . . . . 408 TYR N . 15275 1 875 . 1 1 99 99 LYS H H 1 8.15 0.03 . 1 . . . . 409 LYS H . 15275 1 876 . 1 1 99 99 LYS HA H 1 3.43 0.03 . 1 . . . . 409 LYS HA . 15275 1 877 . 1 1 99 99 LYS HB2 H 1 1.94 0.03 . 2 . . . . 409 LYS HB2 . 15275 1 878 . 1 1 99 99 LYS HB3 H 1 1.98 0.03 . 2 . . . . 409 LYS HB3 . 15275 1 879 . 1 1 99 99 LYS HD2 H 1 1.72 0.03 . 1 . . . . 409 LYS HD2 . 15275 1 880 . 1 1 99 99 LYS HD3 H 1 1.68 0.03 . 1 . . . . 409 LYS HD3 . 15275 1 881 . 1 1 99 99 LYS HE2 H 1 2.98 0.03 . 2 . . . . 409 LYS HE2 . 15275 1 882 . 1 1 99 99 LYS HE3 H 1 2.98 0.03 . 2 . . . . 409 LYS HE3 . 15275 1 883 . 1 1 99 99 LYS HG2 H 1 1.41 0.03 . 1 . . . . 409 LYS HG2 . 15275 1 884 . 1 1 99 99 LYS HG3 H 1 1.41 0.03 . 1 . . . . 409 LYS HG3 . 15275 1 885 . 1 1 99 99 LYS C C 13 178.83 0.1 . 1 . . . . 409 LYS C . 15275 1 886 . 1 1 99 99 LYS CA C 13 60.10 0.1 . 1 . . . . 409 LYS CA . 15275 1 887 . 1 1 99 99 LYS CB C 13 32.33 0.1 . 1 . . . . 409 LYS CB . 15275 1 888 . 1 1 99 99 LYS CD C 13 29.60 0.1 . 1 . . . . 409 LYS CD . 15275 1 889 . 1 1 99 99 LYS CE C 13 42.06 0.1 . 1 . . . . 409 LYS CE . 15275 1 890 . 1 1 99 99 LYS CG C 13 25.42 0.1 . 1 . . . . 409 LYS CG . 15275 1 891 . 1 1 99 99 LYS N N 15 119.63 0.1 . 1 . . . . 409 LYS N . 15275 1 892 . 1 1 100 100 THR H H 1 8.20 0.03 . 1 . . . . 410 THR H . 15275 1 893 . 1 1 100 100 THR HA H 1 3.85 0.03 . 1 . . . . 410 THR HA . 15275 1 894 . 1 1 100 100 THR HB H 1 4.22 0.03 . 1 . . . . 410 THR HB . 15275 1 895 . 1 1 100 100 THR HG21 H 1 1.16 0.03 . 1 . . . . 410 THR HG2 . 15275 1 896 . 1 1 100 100 THR HG22 H 1 1.16 0.03 . 1 . . . . 410 THR HG2 . 15275 1 897 . 1 1 100 100 THR HG23 H 1 1.16 0.03 . 1 . . . . 410 THR HG2 . 15275 1 898 . 1 1 100 100 THR C C 13 176.73 0.1 . 1 . . . . 410 THR C . 15275 1 899 . 1 1 100 100 THR CA C 13 66.76 0.1 . 1 . . . . 410 THR CA . 15275 1 900 . 1 1 100 100 THR CB C 13 68.70 0.1 . 1 . . . . 410 THR CB . 15275 1 901 . 1 1 100 100 THR CG2 C 13 21.63 0.1 . 1 . . . . 410 THR CG2 . 15275 1 902 . 1 1 100 100 THR N N 15 116.82 0.1 . 1 . . . . 410 THR N . 15275 1 903 . 1 1 101 101 MET H H 1 8.29 0.03 . 1 . . . . 411 MET H . 15275 1 904 . 1 1 101 101 MET HA H 1 4.07 0.03 . 1 . . . . 411 MET HA . 15275 1 905 . 1 1 101 101 MET HB2 H 1 1.65 0.03 . 1 . . . . 411 MET HB2 . 15275 1 906 . 1 1 101 101 MET HB3 H 1 1.93 0.03 . 1 . . . . 411 MET HB3 . 15275 1 907 . 1 1 101 101 MET CA C 13 57.24 0.1 . 1 . . . . 411 MET CA . 15275 1 908 . 1 1 101 101 MET CB C 13 31.51 0.1 . 1 . . . . 411 MET CB . 15275 1 909 . 1 1 101 101 MET CG C 13 33.13 0.1 . 1 . . . . 411 MET CG . 15275 1 910 . 1 1 101 101 MET N N 15 121.29 0.1 . 1 . . . . 411 MET N . 15275 1 911 . 1 1 102 102 LYS H H 1 8.56 0.03 . 1 . . . . 412 LYS H . 15275 1 912 . 1 1 102 102 LYS HA H 1 3.30 0.03 . 1 . . . . 412 LYS HA . 15275 1 913 . 1 1 102 102 LYS HB2 H 1 1.36 0.03 . 1 . . . . 412 LYS HB2 . 15275 1 914 . 1 1 102 102 LYS HB3 H 1 1.60 0.03 . 1 . . . . 412 LYS HB3 . 15275 1 915 . 1 1 102 102 LYS HE2 H 1 2.96 0.03 . 2 . . . . 412 LYS HE2 . 15275 1 916 . 1 1 102 102 LYS HE3 H 1 3.00 0.03 . 2 . . . . 412 LYS HE3 . 15275 1 917 . 1 1 102 102 LYS HG2 H 1 1.23 0.03 . 2 . . . . 412 LYS HG2 . 15275 1 918 . 1 1 102 102 LYS HG3 H 1 1.23 0.03 . 2 . . . . 412 LYS HG3 . 15275 1 919 . 1 1 102 102 LYS C C 13 178.79 0.1 . 1 . . . . 412 LYS C . 15275 1 920 . 1 1 102 102 LYS CA C 13 59.69 0.1 . 1 . . . . 412 LYS CA . 15275 1 921 . 1 1 102 102 LYS CB C 13 32.02 0.1 . 1 . . . . 412 LYS CB . 15275 1 922 . 1 1 102 102 LYS CD C 13 29.67 0.1 . 1 . . . . 412 LYS CD . 15275 1 923 . 1 1 102 102 LYS CE C 13 42.14 0.1 . 1 . . . . 412 LYS CE . 15275 1 924 . 1 1 102 102 LYS CG C 13 24.84 0.1 . 1 . . . . 412 LYS CG . 15275 1 925 . 1 1 102 102 LYS N N 15 120.47 0.1 . 1 . . . . 412 LYS N . 15275 1 926 . 1 1 103 103 ASN H H 1 7.64 0.03 . 1 . . . . 413 ASN H . 15275 1 927 . 1 1 103 103 ASN HA H 1 4.40 0.03 . 1 . . . . 413 ASN HA . 15275 1 928 . 1 1 103 103 ASN HB2 H 1 2.76 0.03 . 1 . . . . 413 ASN HB2 . 15275 1 929 . 1 1 103 103 ASN HB3 H 1 2.85 0.03 . 1 . . . . 413 ASN HB3 . 15275 1 930 . 1 1 103 103 ASN HD21 H 1 7.64 0.03 . 1 . . . . 413 ASN HD21 . 15275 1 931 . 1 1 103 103 ASN HD22 H 1 6.95 0.03 . 1 . . . . 413 ASN HD22 . 15275 1 932 . 1 1 103 103 ASN C C 13 177.80 0.1 . 1 . . . . 413 ASN C . 15275 1 933 . 1 1 103 103 ASN CA C 13 55.88 0.1 . 1 . . . . 413 ASN CA . 15275 1 934 . 1 1 103 103 ASN CB C 13 38.29 0.1 . 1 . . . . 413 ASN CB . 15275 1 935 . 1 1 103 103 ASN N N 15 116.95 0.1 . 1 . . . . 413 ASN N . 15275 1 936 . 1 1 103 103 ASN ND2 N 15 112.79 0.1 . 1 . . . . 413 ASN ND2 . 15275 1 937 . 1 1 104 104 LEU H H 1 7.93 0.03 . 1 . . . . 414 LEU H . 15275 1 938 . 1 1 104 104 LEU HA H 1 4.00 0.03 . 1 . . . . 414 LEU HA . 15275 1 939 . 1 1 104 104 LEU HB2 H 1 1.51 0.03 . 1 . . . . 414 LEU HB2 . 15275 1 940 . 1 1 104 104 LEU HB3 H 1 1.74 0.03 . 1 . . . . 414 LEU HB3 . 15275 1 941 . 1 1 104 104 LEU HD11 H 1 0.82 0.03 . 2 . . . . 414 LEU HD1 . 15275 1 942 . 1 1 104 104 LEU HD12 H 1 0.82 0.03 . 2 . . . . 414 LEU HD1 . 15275 1 943 . 1 1 104 104 LEU HD13 H 1 0.82 0.03 . 2 . . . . 414 LEU HD1 . 15275 1 944 . 1 1 104 104 LEU HD21 H 1 0.79 0.03 . 2 . . . . 414 LEU HD2 . 15275 1 945 . 1 1 104 104 LEU HD22 H 1 0.79 0.03 . 2 . . . . 414 LEU HD2 . 15275 1 946 . 1 1 104 104 LEU HD23 H 1 0.79 0.03 . 2 . . . . 414 LEU HD2 . 15275 1 947 . 1 1 104 104 LEU C C 13 178.98 0.1 . 1 . . . . 414 LEU C . 15275 1 948 . 1 1 104 104 LEU CA C 13 57.89 0.1 . 1 . . . . 414 LEU CA . 15275 1 949 . 1 1 104 104 LEU CB C 13 41.95 0.1 . 1 . . . . 414 LEU CB . 15275 1 950 . 1 1 104 104 LEU CD1 C 13 25.20 0.1 . 1 . . . . 414 LEU CD1 . 15275 1 951 . 1 1 104 104 LEU CD2 C 13 24.05 0.1 . 1 . . . . 414 LEU CD2 . 15275 1 952 . 1 1 104 104 LEU N N 15 121.90 0.1 . 1 . . . . 414 LEU N . 15275 1 953 . 1 1 105 105 MET H H 1 8.05 0.03 . 1 . . . . 415 MET H . 15275 1 954 . 1 1 105 105 MET HA H 1 4.04 0.03 . 1 . . . . 415 MET HA . 15275 1 955 . 1 1 105 105 MET HB2 H 1 2.09 0.03 . 2 . . . . 415 MET HB2 . 15275 1 956 . 1 1 105 105 MET HB3 H 1 2.09 0.03 . 2 . . . . 415 MET HB3 . 15275 1 957 . 1 1 105 105 MET HG2 H 1 2.20 0.03 . 2 . . . . 415 MET HG2 . 15275 1 958 . 1 1 105 105 MET HG3 H 1 2.20 0.03 . 2 . . . . 415 MET HG3 . 15275 1 959 . 1 1 105 105 MET C C 13 178.44 0.1 . 1 . . . . 415 MET C . 15275 1 960 . 1 1 105 105 MET CA C 13 57.62 0.1 . 1 . . . . 415 MET CA . 15275 1 961 . 1 1 105 105 MET CB C 13 31.64 0.1 . 1 . . . . 415 MET CB . 15275 1 962 . 1 1 105 105 MET CG C 13 32.12 0.1 . 1 . . . . 415 MET CG . 15275 1 963 . 1 1 105 105 MET N N 15 117.53 0.1 . 1 . . . . 415 MET N . 15275 1 964 . 1 1 106 106 LYS H H 1 7.52 0.03 . 1 . . . . 416 LYS H . 15275 1 965 . 1 1 106 106 LYS HA H 1 4.03 0.03 . 1 . . . . 416 LYS HA . 15275 1 966 . 1 1 106 106 LYS HB2 H 1 1.87 0.03 . 2 . . . . 416 LYS HB2 . 15275 1 967 . 1 1 106 106 LYS HB3 H 1 1.87 0.03 . 2 . . . . 416 LYS HB3 . 15275 1 968 . 1 1 106 106 LYS C C 13 178.29 0.1 . 1 . . . . 416 LYS C . 15275 1 969 . 1 1 106 106 LYS CA C 13 58.70 0.1 . 1 . . . . 416 LYS CA . 15275 1 970 . 1 1 106 106 LYS CB C 13 32.55 0.1 . 1 . . . . 416 LYS CB . 15275 1 971 . 1 1 106 106 LYS CD C 13 29.53 0.1 . 1 . . . . 416 LYS CD . 15275 1 972 . 1 1 106 106 LYS CE C 13 42.14 0.1 . 1 . . . . 416 LYS CE . 15275 1 973 . 1 1 106 106 LYS CG C 13 25.20 0.1 . 1 . . . . 416 LYS CG . 15275 1 974 . 1 1 106 106 LYS N N 15 118.70 0.1 . 1 . . . . 416 LYS N . 15275 1 975 . 1 1 107 107 LYS H H 1 7.66 0.03 . 1 . . . . 417 LYS H . 15275 1 976 . 1 1 107 107 LYS HA H 1 4.13 0.03 . 1 . . . . 417 LYS HA . 15275 1 977 . 1 1 107 107 LYS HB2 H 1 1.90 0.03 . 2 . . . . 417 LYS HB2 . 15275 1 978 . 1 1 107 107 LYS HB3 H 1 1.90 0.03 . 2 . . . . 417 LYS HB3 . 15275 1 979 . 1 1 107 107 LYS C C 13 177.63 0.1 . 1 . . . . 417 LYS C . 15275 1 980 . 1 1 107 107 LYS CA C 13 57.72 0.1 . 1 . . . . 417 LYS CA . 15275 1 981 . 1 1 107 107 LYS CB C 13 32.70 0.1 . 1 . . . . 417 LYS CB . 15275 1 982 . 1 1 107 107 LYS CD C 13 29.24 0.1 . 1 . . . . 417 LYS CD . 15275 1 983 . 1 1 107 107 LYS CE C 13 42.14 0.1 . 1 . . . . 417 LYS CE . 15275 1 984 . 1 1 107 107 LYS CG C 13 25.20 0.1 . 1 . . . . 417 LYS CG . 15275 1 985 . 1 1 107 107 LYS N N 15 118.70 0.1 . 1 . . . . 417 LYS N . 15275 1 986 . 1 1 108 108 MET H H 1 7.83 0.03 . 1 . . . . 418 MET H . 15275 1 987 . 1 1 108 108 MET HA H 1 4.29 0.03 . 1 . . . . 418 MET HA . 15275 1 988 . 1 1 108 108 MET HB2 H 1 2.06 0.03 . 2 . . . . 418 MET HB2 . 15275 1 989 . 1 1 108 108 MET HB3 H 1 2.02 0.03 . 2 . . . . 418 MET HB3 . 15275 1 990 . 1 1 108 108 MET C C 13 176.52 0.1 . 1 . . . . 418 MET C . 15275 1 991 . 1 1 108 108 MET CA C 13 56.55 0.1 . 1 . . . . 418 MET CA . 15275 1 992 . 1 1 108 108 MET CB C 13 32.98 0.1 . 1 . . . . 418 MET CB . 15275 1 993 . 1 1 108 108 MET CG C 13 32.19 0.1 . 1 . . . . 418 MET CG . 15275 1 994 . 1 1 108 108 MET N N 15 118.30 0.1 . 1 . . . . 418 MET N . 15275 1 995 . 1 1 109 109 LYS H H 1 7.95 0.03 . 1 . . . . 419 LYS H . 15275 1 996 . 1 1 109 109 LYS HA H 1 4.18 0.03 . 1 . . . . 419 LYS HA . 15275 1 997 . 1 1 109 109 LYS HB2 H 1 1.84 0.03 . 2 . . . . 419 LYS HB2 . 15275 1 998 . 1 1 109 109 LYS HB3 H 1 1.84 0.03 . 2 . . . . 419 LYS HB3 . 15275 1 999 . 1 1 109 109 LYS C C 13 176.75 0.1 . 1 . . . . 419 LYS C . 15275 1 1000 . 1 1 109 109 LYS CA C 13 56.97 0.1 . 1 . . . . 419 LYS CA . 15275 1 1001 . 1 1 109 109 LYS CB C 13 32.47 0.1 . 1 . . . . 419 LYS CB . 15275 1 1002 . 1 1 109 109 LYS CD C 13 29.24 0.1 . 1 . . . . 419 LYS CD . 15275 1 1003 . 1 1 109 109 LYS CE C 13 42.14 0.1 . 1 . . . . 419 LYS CE . 15275 1 1004 . 1 1 109 109 LYS CG C 13 24.99 0.1 . 1 . . . . 419 LYS CG . 15275 1 1005 . 1 1 109 109 LYS N N 15 120.53 0.1 . 1 . . . . 419 LYS N . 15275 1 1006 . 1 1 110 110 LYS H H 1 8.09 0.03 . 1 . . . . 420 LYS H . 15275 1 1007 . 1 1 110 110 LYS HA H 1 4.29 0.03 . 1 . . . . 420 LYS HA . 15275 1 1008 . 1 1 110 110 LYS C C 13 176.33 0.1 . 1 . . . . 420 LYS C . 15275 1 1009 . 1 1 110 110 LYS CA C 13 56.53 0.1 . 1 . . . . 420 LYS CA . 15275 1 1010 . 1 1 110 110 LYS CB C 13 33.04 0.1 . 1 . . . . 420 LYS CB . 15275 1 1011 . 1 1 110 110 LYS CD C 13 29.02 0.1 . 1 . . . . 420 LYS CD . 15275 1 1012 . 1 1 110 110 LYS CE C 13 42.21 0.1 . 1 . . . . 420 LYS CE . 15275 1 1013 . 1 1 110 110 LYS CG C 13 24.84 0.1 . 1 . . . . 420 LYS CG . 15275 1 1014 . 1 1 110 110 LYS N N 15 121.01 0.1 . 1 . . . . 420 LYS N . 15275 1 1015 . 1 1 111 111 ASN H H 1 8.27 0.03 . 1 . . . . 421 ASN H . 15275 1 1016 . 1 1 111 111 ASN HA H 1 4.64 0.03 . 1 . . . . 421 ASN HA . 15275 1 1017 . 1 1 111 111 ASN HB2 H 1 2.74 0.03 . 1 . . . . 421 ASN HB2 . 15275 1 1018 . 1 1 111 111 ASN HB3 H 1 2.81 0.03 . 1 . . . . 421 ASN HB3 . 15275 1 1019 . 1 1 111 111 ASN HD21 H 1 7.58 0.03 . 1 . . . . 421 ASN HD21 . 15275 1 1020 . 1 1 111 111 ASN HD22 H 1 6.91 0.03 . 1 . . . . 421 ASN HD22 . 15275 1 1021 . 1 1 111 111 ASN C C 13 174.68 0.1 . 1 . . . . 421 ASN C . 15275 1 1022 . 1 1 111 111 ASN CA C 13 53.42 0.1 . 1 . . . . 421 ASN CA . 15275 1 1023 . 1 1 111 111 ASN CB C 13 39.05 0.1 . 1 . . . . 421 ASN CB . 15275 1 1024 . 1 1 111 111 ASN N N 15 119.00 0.1 . 1 . . . . 421 ASN N . 15275 1 1025 . 1 1 111 111 ASN ND2 N 15 112.81 0.1 . 1 . . . . 421 ASN ND2 . 15275 1 1026 . 1 1 112 112 LYS H H 1 8.07 0.03 . 1 . . . . 422 LYS H . 15275 1 1027 . 1 1 112 112 LYS HA H 1 4.31 0.03 . 1 . . . . 422 LYS HA . 15275 1 1028 . 1 1 112 112 LYS C C 13 176.01 0.1 . 1 . . . . 422 LYS C . 15275 1 1029 . 1 1 112 112 LYS CA C 13 56.09 0.1 . 1 . . . . 422 LYS CA . 15275 1 1030 . 1 1 112 112 LYS CB C 13 33.17 0.1 . 1 . . . . 422 LYS CB . 15275 1 1031 . 1 1 112 112 LYS CD C 13 29.09 0.1 . 1 . . . . 422 LYS CD . 15275 1 1032 . 1 1 112 112 LYS CE C 13 42.06 0.1 . 1 . . . . 422 LYS CE . 15275 1 1033 . 1 1 112 112 LYS CG C 13 24.63 0.1 . 1 . . . . 422 LYS CG . 15275 1 1034 . 1 1 112 112 LYS N N 15 120.73 0.1 . 1 . . . . 422 LYS N . 15275 1 1035 . 1 1 113 113 LEU H H 1 8.23 0.03 . 1 . . . . 423 LEU H . 15275 1 1036 . 1 1 113 113 LEU HA H 1 4.59 0.03 . 1 . . . . 423 LEU HA . 15275 1 1037 . 1 1 113 113 LEU HB2 H 1 1.52 0.03 . 1 . . . . 423 LEU HB2 . 15275 1 1038 . 1 1 113 113 LEU HB3 H 1 1.63 0.03 . 1 . . . . 423 LEU HB3 . 15275 1 1039 . 1 1 113 113 LEU HD11 H 1 0.94 0.03 . 2 . . . . 423 LEU HD1 . 15275 1 1040 . 1 1 113 113 LEU HD12 H 1 0.94 0.03 . 2 . . . . 423 LEU HD1 . 15275 1 1041 . 1 1 113 113 LEU HD13 H 1 0.94 0.03 . 2 . . . . 423 LEU HD1 . 15275 1 1042 . 1 1 113 113 LEU HD21 H 1 0.90 0.03 . 2 . . . . 423 LEU HD2 . 15275 1 1043 . 1 1 113 113 LEU HD22 H 1 0.90 0.03 . 2 . . . . 423 LEU HD2 . 15275 1 1044 . 1 1 113 113 LEU HD23 H 1 0.90 0.03 . 2 . . . . 423 LEU HD2 . 15275 1 1045 . 1 1 113 113 LEU HG H 1 1.65 0.03 . 1 . . . . 423 LEU HG . 15275 1 1046 . 1 1 113 113 LEU C C 13 175.39 0.1 . 1 . . . . 423 LEU C . 15275 1 1047 . 1 1 113 113 LEU CA C 13 53.08 0.1 . 1 . . . . 423 LEU CA . 15275 1 1048 . 1 1 113 113 LEU CB C 13 41.89 0.1 . 1 . . . . 423 LEU CB . 15275 1 1049 . 1 1 113 113 LEU CD1 C 13 25.39 0.1 . 2 . . . . 423 LEU CD1 . 15275 1 1050 . 1 1 113 113 LEU CD2 C 13 23.50 0.1 . 2 . . . . 423 LEU CD2 . 15275 1 1051 . 1 1 113 113 LEU N N 15 124.52 0.1 . 1 . . . . 423 LEU N . 15275 1 1052 . 1 1 114 114 PRO HA H 1 4.47 0.03 . 1 . . . . 424 PRO HA . 15275 1 1053 . 1 1 114 114 PRO HB2 H 1 2.19 0.03 . 2 . . . . 424 PRO HB2 . 15275 1 1054 . 1 1 114 114 PRO HB3 H 1 2.19 0.03 . 2 . . . . 424 PRO HB3 . 15275 1 1055 . 1 1 114 114 PRO HD2 H 1 3.79 0.03 . 1 . . . . 424 PRO HD2 . 15275 1 1056 . 1 1 114 114 PRO HD3 H 1 3.61 0.03 . 1 . . . . 424 PRO HD3 . 15275 1 1057 . 1 1 114 114 PRO HG2 H 1 1.99 0.03 . 2 . . . . 424 PRO HG2 . 15275 1 1058 . 1 1 114 114 PRO HG3 H 1 1.99 0.03 . 2 . . . . 424 PRO HG3 . 15275 1 1059 . 1 1 114 114 PRO C C 13 175.65 0.1 . 1 . . . . 424 PRO C . 15275 1 1060 . 1 1 114 114 PRO CA C 13 63.31 0.1 . 1 . . . . 424 PRO CA . 15275 1 1061 . 1 1 114 114 PRO CB C 13 31.46 0.1 . 1 . . . . 424 PRO CB . 15275 1 1062 . 1 1 114 114 PRO CD C 13 50.49 0.1 . 1 . . . . 424 PRO CD . 15275 1 1063 . 1 1 114 114 PRO CG C 13 27.36 0.1 . 1 . . . . 424 PRO CG . 15275 1 1064 . 1 1 115 115 ILE H H 1 7.57 0.03 . 1 . . . . 425 ILE H . 15275 1 1065 . 1 1 115 115 ILE HA H 1 4.05 0.03 . 1 . . . . 425 ILE HA . 15275 1 1066 . 1 1 115 115 ILE HB H 1 1.80 0.03 . 1 . . . . 425 ILE HB . 15275 1 1067 . 1 1 115 115 ILE HD11 H 1 0.85 0.03 . 1 . . . . 425 ILE HD11 . 15275 1 1068 . 1 1 115 115 ILE HD12 H 1 0.85 0.03 . 1 . . . . 425 ILE HD11 . 15275 1 1069 . 1 1 115 115 ILE HD13 H 1 0.85 0.03 . 1 . . . . 425 ILE HD11 . 15275 1 1070 . 1 1 115 115 ILE HG12 H 1 1.40 0.03 . 2 . . . . 425 ILE HG12 . 15275 1 1071 . 1 1 115 115 ILE HG13 H 1 1.10 0.03 . 2 . . . . 425 ILE HG13 . 15275 1 1072 . 1 1 115 115 ILE HG21 H 1 0.86 0.03 . 1 . . . . 425 ILE HG21 . 15275 1 1073 . 1 1 115 115 ILE HG22 H 1 0.86 0.03 . 1 . . . . 425 ILE HG21 . 15275 1 1074 . 1 1 115 115 ILE HG23 H 1 0.86 0.03 . 1 . . . . 425 ILE HG21 . 15275 1 1075 . 1 1 115 115 ILE C C 13 180.91 0.1 . 1 . . . . 425 ILE C . 15275 1 1076 . 1 1 115 115 ILE CA C 13 62.87 0.1 . 1 . . . . 425 ILE CA . 15275 1 1077 . 1 1 115 115 ILE CB C 13 40.02 0.1 . 1 . . . . 425 ILE CB . 15275 1 1078 . 1 1 115 115 ILE CD1 C 13 13.79 0.1 . 1 . . . . 425 ILE CD1 . 15275 1 1079 . 1 1 115 115 ILE CG1 C 13 27.37 0.1 . 1 . . . . 425 ILE CG1 . 15275 1 1080 . 1 1 115 115 ILE CG2 C 13 18.39 0.1 . 1 . . . . 425 ILE CG2 . 15275 1 1081 . 1 1 115 115 ILE N N 15 124.58 0.1 . 1 . . . . 425 ILE N . 15275 1 stop_ save_