data_30410 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30410 _Entry.Title ; Solution structure of the four-helix bundle region of human J-protein Zuotin, a component of ribosome-associated complex (RAC) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-02-20 _Entry.Accession_date 2018-02-20 _Entry.Last_release_date 2018-04-05 _Entry.Original_release_date 2018-04-05 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 30410 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 O. Shrestha O. K. . . 30410 2 W. Lee W. . . . 30410 3 M. Tonelli M. . . . 30410 4 G. Cornilescu G. . . . 30410 5 J. Markley J. L. . . 30410 6 S. Ciesielski S. J. . . 30410 7 E. Craig E. A. . . 30410 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID CHAPERONE . 30410 DNAJC2 . 30410 Hsp40 . 30410 Hsp70 . 30410 J-protein . 30410 Mpp11 . 30410 'Ribosome-Associated Complex (RAC)' . 30410 Zuotin . 30410 'molecular chaperone' . 30410 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30410 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 268 30410 '15N chemical shifts' 85 30410 '1H chemical shifts' 521 30410 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 . . 2020-05-22 2019-03-01 update BMRB 'update entry citation' 30410 1 . . 2019-06-07 2019-03-01 original author 'original release' 30410 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6CGH . 30410 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30410 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 31091298 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structure and Evolution of the 4-helix Bundle Domain of Zuotin, a J-domain Protein Co-Chaperone of Hsp70 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'PLoS ONE' _Citation.Journal_name_full 'PloS one' _Citation.Journal_volume 14 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1932-6203 _Citation.Journal_CSD 0353 _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 e0217098 _Citation.Page_last e0217098 _Citation.Year 2019 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 'Om Kumar' Shrestha O. K. . . 30410 1 2 Ruchika Sharma R. . . . 30410 1 3 Bartlomiej Tomiczek B. . . . 30410 1 4 Woonghee Lee W. . . . 30410 1 5 Marco Tonelli M. . . . 30410 1 6 Gabriel Cornilescu G. . . . 30410 1 7 Milena Stolarska M. . . . 30410 1 8 Lukasz Nierzwicki L. . . . 30410 1 9 Jacek Czub J. . . . 30410 1 10 John Markley J. L. . . 30410 1 11 Jaroslaw Marszalek J. . . . 30410 1 12 Szymon Ciesielski S. J. . . 30410 1 13 Elizabeth Craig E. A. . . 30410 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30410 _Assembly.ID 1 _Assembly.Name 'DnaJ homolog subfamily C member 2' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 30410 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30410 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSKKAIKKERQKLRNSCKTW NHFSDNEAERVKMMEEVEKL CDRLELASLQCLNETLTSCT KEVGKAALEKQIEEINEQIR KEKEEAEAR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 89 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'UNP residues 346-432' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10401.884 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'M-phase phosphoprotein 11' na 30410 1 'Zuotin-related factor 1' na 30410 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 1 344 GLY . 30410 1 2 345 SER . 30410 1 3 346 LYS . 30410 1 4 347 LYS . 30410 1 5 348 ALA . 30410 1 6 349 ILE . 30410 1 7 350 LYS . 30410 1 8 351 LYS . 30410 1 9 352 GLU . 30410 1 10 353 ARG . 30410 1 11 354 GLN . 30410 1 12 355 LYS . 30410 1 13 356 LEU . 30410 1 14 357 ARG . 30410 1 15 358 ASN . 30410 1 16 359 SER . 30410 1 17 360 CYS . 30410 1 18 361 LYS . 30410 1 19 362 THR . 30410 1 20 363 TRP . 30410 1 21 364 ASN . 30410 1 22 365 HIS . 30410 1 23 366 PHE . 30410 1 24 367 SER . 30410 1 25 368 ASP . 30410 1 26 369 ASN . 30410 1 27 370 GLU . 30410 1 28 371 ALA . 30410 1 29 372 GLU . 30410 1 30 373 ARG . 30410 1 31 374 VAL . 30410 1 32 375 LYS . 30410 1 33 376 MET . 30410 1 34 377 MET . 30410 1 35 378 GLU . 30410 1 36 379 GLU . 30410 1 37 380 VAL . 30410 1 38 381 GLU . 30410 1 39 382 LYS . 30410 1 40 383 LEU . 30410 1 41 384 CYS . 30410 1 42 385 ASP . 30410 1 43 386 ARG . 30410 1 44 387 LEU . 30410 1 45 388 GLU . 30410 1 46 389 LEU . 30410 1 47 390 ALA . 30410 1 48 391 SER . 30410 1 49 392 LEU . 30410 1 50 393 GLN . 30410 1 51 394 CYS . 30410 1 52 395 LEU . 30410 1 53 396 ASN . 30410 1 54 397 GLU . 30410 1 55 398 THR . 30410 1 56 399 LEU . 30410 1 57 400 THR . 30410 1 58 401 SER . 30410 1 59 402 CYS . 30410 1 60 403 THR . 30410 1 61 404 LYS . 30410 1 62 405 GLU . 30410 1 63 406 VAL . 30410 1 64 407 GLY . 30410 1 65 408 LYS . 30410 1 66 409 ALA . 30410 1 67 410 ALA . 30410 1 68 411 LEU . 30410 1 69 412 GLU . 30410 1 70 413 LYS . 30410 1 71 414 GLN . 30410 1 72 415 ILE . 30410 1 73 416 GLU . 30410 1 74 417 GLU . 30410 1 75 418 ILE . 30410 1 76 419 ASN . 30410 1 77 420 GLU . 30410 1 78 421 GLN . 30410 1 79 422 ILE . 30410 1 80 423 ARG . 30410 1 81 424 LYS . 30410 1 82 425 GLU . 30410 1 83 426 LYS . 30410 1 84 427 GLU . 30410 1 85 428 GLU . 30410 1 86 429 ALA . 30410 1 87 430 GLU . 30410 1 88 431 ALA . 30410 1 89 432 ARG . 30410 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 30410 1 . SER 2 2 30410 1 . LYS 3 3 30410 1 . LYS 4 4 30410 1 . ALA 5 5 30410 1 . ILE 6 6 30410 1 . LYS 7 7 30410 1 . LYS 8 8 30410 1 . GLU 9 9 30410 1 . ARG 10 10 30410 1 . GLN 11 11 30410 1 . LYS 12 12 30410 1 . LEU 13 13 30410 1 . ARG 14 14 30410 1 . ASN 15 15 30410 1 . SER 16 16 30410 1 . CYS 17 17 30410 1 . LYS 18 18 30410 1 . THR 19 19 30410 1 . TRP 20 20 30410 1 . ASN 21 21 30410 1 . HIS 22 22 30410 1 . PHE 23 23 30410 1 . SER 24 24 30410 1 . ASP 25 25 30410 1 . ASN 26 26 30410 1 . GLU 27 27 30410 1 . ALA 28 28 30410 1 . GLU 29 29 30410 1 . ARG 30 30 30410 1 . VAL 31 31 30410 1 . LYS 32 32 30410 1 . MET 33 33 30410 1 . MET 34 34 30410 1 . GLU 35 35 30410 1 . GLU 36 36 30410 1 . VAL 37 37 30410 1 . GLU 38 38 30410 1 . LYS 39 39 30410 1 . LEU 40 40 30410 1 . CYS 41 41 30410 1 . ASP 42 42 30410 1 . ARG 43 43 30410 1 . LEU 44 44 30410 1 . GLU 45 45 30410 1 . LEU 46 46 30410 1 . ALA 47 47 30410 1 . SER 48 48 30410 1 . LEU 49 49 30410 1 . GLN 50 50 30410 1 . CYS 51 51 30410 1 . LEU 52 52 30410 1 . ASN 53 53 30410 1 . GLU 54 54 30410 1 . THR 55 55 30410 1 . LEU 56 56 30410 1 . THR 57 57 30410 1 . SER 58 58 30410 1 . CYS 59 59 30410 1 . THR 60 60 30410 1 . LYS 61 61 30410 1 . GLU 62 62 30410 1 . VAL 63 63 30410 1 . GLY 64 64 30410 1 . LYS 65 65 30410 1 . ALA 66 66 30410 1 . ALA 67 67 30410 1 . LEU 68 68 30410 1 . GLU 69 69 30410 1 . LYS 70 70 30410 1 . GLN 71 71 30410 1 . ILE 72 72 30410 1 . GLU 73 73 30410 1 . GLU 74 74 30410 1 . ILE 75 75 30410 1 . ASN 76 76 30410 1 . GLU 77 77 30410 1 . GLN 78 78 30410 1 . ILE 79 79 30410 1 . ARG 80 80 30410 1 . LYS 81 81 30410 1 . GLU 82 82 30410 1 . LYS 83 83 30410 1 . GLU 84 84 30410 1 . GLU 85 85 30410 1 . ALA 86 86 30410 1 . GLU 87 87 30410 1 . ALA 88 88 30410 1 . ARG 89 89 30410 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 30410 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'DNAJC2, MPHOSPH11, MPP11, ZRF1' . 30410 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 30410 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30410 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30410 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '300 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'Mpp11 (346-432)' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 300 . . uM . . . . 30410 1 2 NaCl 'natural abundance' . . . . . . 250 . . mM . . . . 30410 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30410 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30410 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '300 uM [U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'Mpp11 (346-432)' '[U-100% 15N]' . . 1 $entity_1 . . 300 . . uM . . . . 30410 2 2 NaCl 'natural abundance' . . . . . . 250 . . mM . . . . 30410 2 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30410 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 30410 _Sample.ID 3 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details '200 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'Mpp11 (346-432)' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 200 . . uM . . . . 30410 3 2 NaCl 'natural abundance' . . . . . . 250 . . mM . . . . 30410 3 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30410 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 30410 _Sample.ID 4 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details '150 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'Mpp11 (346-432)' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 150 . . uM . . . . 30410 4 2 NaCl 'natural abundance' . . . . . . 250 . . mM . . . . 30410 4 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30410 4 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 30410 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 270 . mM 30410 1 pH 7.5 . pH 30410 1 pressure 1 . Pa 30410 1 temperature 278 . K 30410 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30410 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30410 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 30410 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30410 _Software.ID 2 _Software.Type . _Software.Name VNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 30410 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 30410 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30410 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30410 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 30410 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30410 _Software.ID 4 _Software.Type . _Software.Name APES _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Shin, Lee and Lee' . . 30410 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'peak picking' 30410 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30410 _Software.ID 5 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee, Tonelli and Markley' . . 30410 5 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'peak picking' 30410 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 30410 _Software.ID 6 _Software.Type . _Software.Name PINE _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 30410 6 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 30410 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 30410 _Software.ID 7 _Software.Type . _Software.Name PINE-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee, Westler, Bahrami, Eghbalnia and Markley' . . 30410 7 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 30410 7 stop_ save_ save_software_8 _Software.Sf_category software _Software.Sf_framecode software_8 _Software.Entry_ID 30410 _Software.ID 8 _Software.Type . _Software.Name PONDEROSA-C/S _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee, Stark and Markley' . . 30410 8 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 30410 8 . 'structure calculation' 30410 8 stop_ save_ save_software_9 _Software.Sf_category software _Software.Sf_framecode software_9 _Software.Entry_ID 30410 _Software.ID 9 _Software.Type . _Software.Name AUDANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee, Petit, Cornilescu, Stark and Markley' . . 30410 9 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 30410 9 stop_ save_ save_software_10 _Software.Sf_category software _Software.Sf_framecode software_10 _Software.Entry_ID 30410 _Software.ID 10 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 30410 10 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 30410 10 . 'structure calculation' 30410 10 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30410 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30410 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 30410 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_4 _NMR_spectrometer.Entry_ID 30410 _NMR_spectrometer.ID 4 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 30410 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Varian VNS . 600 . . . 30410 1 2 NMR_spectrometer_2 Bruker Avance . 750 . . . 30410 1 3 NMR_spectrometer_3 Bruker Avance . 600 . . . 30410 1 4 NMR_spectrometer_4 Varian VNS . 900 . . . 30410 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 30410 _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 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 4 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 5 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 7 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 9 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 10 '1H-15N IPAP HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30410 1 11 '1H-15N IPAP HSQC' no . . . . . . . . . . 3 $sample_3 anisotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30410 1 12 '1H-15N IPAP HSQC' no . . . . . . . . . . 4 $sample_4 anisotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30410 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30410 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . 30410 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30410 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 30410 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30410 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30410 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30410 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30410 1 2 '3D HNCACB' . . . 30410 1 3 '3D CBCA(CO)NH' . . . 30410 1 4 '3D HBHA(CO)NH' . . . 30410 1 5 '2D 1H-13C HSQC aliphatic' . . . 30410 1 6 '3D 1H-15N NOESY' . . . 30410 1 7 '3D 1H-13C NOESY' . . . 30410 1 8 '3D H(CCO)NH' . . . 30410 1 9 '3D C(CO)NH' . . . 30410 1 10 '1H-15N IPAP HSQC' . . . 30410 1 11 '1H-15N IPAP HSQC' . . . 30410 1 12 '1H-15N IPAP HSQC' . . . 30410 1 13 '2D 1H-15N HSQC' . . . 30410 1 14 '3D 1H-13C NOESY aromatic' . . . 30410 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 LYS H H 1 7.690 0.00 . . . . . . A 347 LYS H . 30410 1 2 . 1 . 1 4 4 LYS N N 15 115.764 0.00 . . . . . . A 347 LYS N . 30410 1 3 . 1 . 1 5 5 ALA H H 1 8.303 0.00 . . . . . . A 348 ALA H . 30410 1 4 . 1 . 1 5 5 ALA HA H 1 4.176 0.00 . . . . . . A 348 ALA HA . 30410 1 5 . 1 . 1 5 5 ALA HB1 H 1 1.511 0.00 . . . . . . A 348 ALA HB1 . 30410 1 6 . 1 . 1 5 5 ALA HB2 H 1 1.511 0.00 . . . . . . A 348 ALA HB2 . 30410 1 7 . 1 . 1 5 5 ALA HB3 H 1 1.511 0.00 . . . . . . A 348 ALA HB3 . 30410 1 8 . 1 . 1 5 5 ALA CA C 13 55.096 0.00 . . . . . . A 348 ALA CA . 30410 1 9 . 1 . 1 5 5 ALA CB C 13 18.473 0.00 . . . . . . A 348 ALA CB . 30410 1 10 . 1 . 1 5 5 ALA N N 15 121.604 0.00 . . . . . . A 348 ALA N . 30410 1 11 . 1 . 1 6 6 ILE H H 1 8.373 0.00 . . . . . . A 349 ILE H . 30410 1 12 . 1 . 1 6 6 ILE HA H 1 3.870 0.00 . . . . . . A 349 ILE HA . 30410 1 13 . 1 . 1 6 6 ILE HB H 1 1.874 0.00 . . . . . . A 349 ILE HB . 30410 1 14 . 1 . 1 6 6 ILE HG12 H 1 1.205 0.00 . . . . . . A 349 ILE HG12 . 30410 1 15 . 1 . 1 6 6 ILE HG13 H 1 1.495 0.00 . . . . . . A 349 ILE HG13 . 30410 1 16 . 1 . 1 6 6 ILE HG21 H 1 1.035 0.00 . . . . . . A 349 ILE HG21 . 30410 1 17 . 1 . 1 6 6 ILE HG22 H 1 1.035 0.00 . . . . . . A 349 ILE HG22 . 30410 1 18 . 1 . 1 6 6 ILE HG23 H 1 1.035 0.00 . . . . . . A 349 ILE HG23 . 30410 1 19 . 1 . 1 6 6 ILE HD11 H 1 0.957 0.00 . . . . . . A 349 ILE HD11 . 30410 1 20 . 1 . 1 6 6 ILE HD12 H 1 0.957 0.00 . . . . . . A 349 ILE HD12 . 30410 1 21 . 1 . 1 6 6 ILE HD13 H 1 0.957 0.00 . . . . . . A 349 ILE HD13 . 30410 1 22 . 1 . 1 6 6 ILE CA C 13 65.075 0.00 . . . . . . A 349 ILE CA . 30410 1 23 . 1 . 1 6 6 ILE CB C 13 38.319 0.00 . . . . . . A 349 ILE CB . 30410 1 24 . 1 . 1 6 6 ILE CG1 C 13 31.244 0.00 . . . . . . A 349 ILE CG1 . 30410 1 25 . 1 . 1 6 6 ILE CG2 C 13 16.724 0.00 . . . . . . A 349 ILE CG2 . 30410 1 26 . 1 . 1 6 6 ILE CD1 C 13 14.223 0.00 . . . . . . A 349 ILE CD1 . 30410 1 27 . 1 . 1 6 6 ILE N N 15 119.035 0.00 . . . . . . A 349 ILE N . 30410 1 28 . 1 . 1 7 7 LYS H H 1 7.809 0.00 . . . . . . A 350 LYS H . 30410 1 29 . 1 . 1 7 7 LYS HA H 1 3.985 0.00 . . . . . . A 350 LYS HA . 30410 1 30 . 1 . 1 7 7 LYS HB2 H 1 1.961 0.00 . . . . . . A 350 LYS HB2 . 30410 1 31 . 1 . 1 7 7 LYS HB3 H 1 1.961 0.00 . . . . . . A 350 LYS HB3 . 30410 1 32 . 1 . 1 7 7 LYS HG2 H 1 1.409 0.00 . . . . . . A 350 LYS HG2 . 30410 1 33 . 1 . 1 7 7 LYS HG3 H 1 1.409 0.00 . . . . . . A 350 LYS HG3 . 30410 1 34 . 1 . 1 7 7 LYS HD2 H 1 1.694 0.00 . . . . . . A 350 LYS HD2 . 30410 1 35 . 1 . 1 7 7 LYS HD3 H 1 1.694 0.00 . . . . . . A 350 LYS HD3 . 30410 1 36 . 1 . 1 7 7 LYS HE2 H 1 2.962 0.00 . . . . . . A 350 LYS HE2 . 30410 1 37 . 1 . 1 7 7 LYS HE3 H 1 2.962 0.00 . . . . . . A 350 LYS HE3 . 30410 1 38 . 1 . 1 7 7 LYS CA C 13 60.611 0.00 . . . . . . A 350 LYS CA . 30410 1 39 . 1 . 1 7 7 LYS CB C 13 32.283 0.00 . . . . . . A 350 LYS CB . 30410 1 40 . 1 . 1 7 7 LYS CG C 13 25.655 0.00 . . . . . . A 350 LYS CG . 30410 1 41 . 1 . 1 7 7 LYS CD C 13 29.779 0.00 . . . . . . A 350 LYS CD . 30410 1 42 . 1 . 1 7 7 LYS CE C 13 42.086 0.00 . . . . . . A 350 LYS CE . 30410 1 43 . 1 . 1 7 7 LYS N N 15 122.648 0.00 . . . . . . A 350 LYS N . 30410 1 44 . 1 . 1 8 8 LYS H H 1 7.699 0.00 . . . . . . A 351 LYS H . 30410 1 45 . 1 . 1 8 8 LYS HA H 1 3.993 0.00 . . . . . . A 351 LYS HA . 30410 1 46 . 1 . 1 8 8 LYS HB2 H 1 1.927 0.00 . . . . . . A 351 LYS HB2 . 30410 1 47 . 1 . 1 8 8 LYS HB3 H 1 1.927 0.00 . . . . . . A 351 LYS HB3 . 30410 1 48 . 1 . 1 8 8 LYS HG2 H 1 1.425 0.00 . . . . . . A 351 LYS HG2 . 30410 1 49 . 1 . 1 8 8 LYS HG3 H 1 1.425 0.00 . . . . . . A 351 LYS HG3 . 30410 1 50 . 1 . 1 8 8 LYS HD2 H 1 1.671 0.00 . . . . . . A 351 LYS HD2 . 30410 1 51 . 1 . 1 8 8 LYS HD3 H 1 1.671 0.00 . . . . . . A 351 LYS HD3 . 30410 1 52 . 1 . 1 8 8 LYS HE2 H 1 2.967 0.00 . . . . . . A 351 LYS HE2 . 30410 1 53 . 1 . 1 8 8 LYS HE3 H 1 2.967 0.00 . . . . . . A 351 LYS HE3 . 30410 1 54 . 1 . 1 8 8 LYS CA C 13 59.327 0.00 . . . . . . A 351 LYS CA . 30410 1 55 . 1 . 1 8 8 LYS CB C 13 32.342 0.00 . . . . . . A 351 LYS CB . 30410 1 56 . 1 . 1 8 8 LYS CG C 13 25.224 0.00 . . . . . . A 351 LYS CG . 30410 1 57 . 1 . 1 8 8 LYS CD C 13 29.304 0.00 . . . . . . A 351 LYS CD . 30410 1 58 . 1 . 1 8 8 LYS CE C 13 42.135 0.00 . . . . . . A 351 LYS CE . 30410 1 59 . 1 . 1 8 8 LYS N N 15 118.973 0.00 . . . . . . A 351 LYS N . 30410 1 60 . 1 . 1 9 9 GLU H H 1 8.072 0.00 . . . . . . A 352 GLU H . 30410 1 61 . 1 . 1 9 9 GLU HA H 1 3.985 0.00 . . . . . . A 352 GLU HA . 30410 1 62 . 1 . 1 9 9 GLU HB2 H 1 2.000 0.00 . . . . . . A 352 GLU HB2 . 30410 1 63 . 1 . 1 9 9 GLU HB3 H 1 2.000 0.00 . . . . . . A 352 GLU HB3 . 30410 1 64 . 1 . 1 9 9 GLU HG2 H 1 2.122 0.00 . . . . . . A 352 GLU HG2 . 30410 1 65 . 1 . 1 9 9 GLU HG3 H 1 2.432 0.00 . . . . . . A 352 GLU HG3 . 30410 1 66 . 1 . 1 9 9 GLU CA C 13 58.690 0.00 . . . . . . A 352 GLU CA . 30410 1 67 . 1 . 1 9 9 GLU CB C 13 29.638 0.00 . . . . . . A 352 GLU CB . 30410 1 68 . 1 . 1 9 9 GLU CG C 13 36.395 0.00 . . . . . . A 352 GLU CG . 30410 1 69 . 1 . 1 9 9 GLU N N 15 119.530 0.00 . . . . . . A 352 GLU N . 30410 1 70 . 1 . 1 10 10 ARG H H 1 8.502 0.00 . . . . . . A 353 ARG H . 30410 1 71 . 1 . 1 10 10 ARG HA H 1 4.069 0.00 . . . . . . A 353 ARG HA . 30410 1 72 . 1 . 1 10 10 ARG HB2 H 1 1.947 0.00 . . . . . . A 353 ARG HB2 . 30410 1 73 . 1 . 1 10 10 ARG HB3 H 1 1.947 0.00 . . . . . . A 353 ARG HB3 . 30410 1 74 . 1 . 1 10 10 ARG HG2 H 1 1.480 0.00 . . . . . . A 353 ARG HG2 . 30410 1 75 . 1 . 1 10 10 ARG HG3 H 1 1.480 0.00 . . . . . . A 353 ARG HG3 . 30410 1 76 . 1 . 1 10 10 ARG HD2 H 1 3.090 0.00 . . . . . . A 353 ARG HD2 . 30410 1 77 . 1 . 1 10 10 ARG HD3 H 1 3.090 0.00 . . . . . . A 353 ARG HD3 . 30410 1 78 . 1 . 1 10 10 ARG CA C 13 60.025 0.00 . . . . . . A 353 ARG CA . 30410 1 79 . 1 . 1 10 10 ARG CB C 13 30.864 0.00 . . . . . . A 353 ARG CB . 30410 1 80 . 1 . 1 10 10 ARG CG C 13 28.845 0.00 . . . . . . A 353 ARG CG . 30410 1 81 . 1 . 1 10 10 ARG CD C 13 44.569 0.00 . . . . . . A 353 ARG CD . 30410 1 82 . 1 . 1 10 10 ARG N N 15 120.570 0.00 . . . . . . A 353 ARG N . 30410 1 83 . 1 . 1 11 11 GLN H H 1 7.584 0.00 . . . . . . A 354 GLN H . 30410 1 84 . 1 . 1 11 11 GLN HA H 1 3.976 0.00 . . . . . . A 354 GLN HA . 30410 1 85 . 1 . 1 11 11 GLN HB2 H 1 2.121 0.00 . . . . . . A 354 GLN HB2 . 30410 1 86 . 1 . 1 11 11 GLN HB3 H 1 2.212 0.00 . . . . . . A 354 GLN HB3 . 30410 1 87 . 1 . 1 11 11 GLN HG2 H 1 2.451 0.00 . . . . . . A 354 GLN HG2 . 30410 1 88 . 1 . 1 11 11 GLN HG3 H 1 2.451 0.00 . . . . . . A 354 GLN HG3 . 30410 1 89 . 1 . 1 11 11 GLN CA C 13 58.654 0.00 . . . . . . A 354 GLN CA . 30410 1 90 . 1 . 1 11 11 GLN CB C 13 28.169 0.00 . . . . . . A 354 GLN CB . 30410 1 91 . 1 . 1 11 11 GLN CG C 13 33.584 0.00 . . . . . . A 354 GLN CG . 30410 1 92 . 1 . 1 11 11 GLN N N 15 117.364 0.00 . . . . . . A 354 GLN N . 30410 1 93 . 1 . 1 12 12 LYS H H 1 8.157 0.00 . . . . . . A 355 LYS H . 30410 1 94 . 1 . 1 12 12 LYS HA H 1 3.975 0.00 . . . . . . A 355 LYS HA . 30410 1 95 . 1 . 1 12 12 LYS HB2 H 1 1.842 0.00 . . . . . . A 355 LYS HB2 . 30410 1 96 . 1 . 1 12 12 LYS HB3 H 1 1.842 0.00 . . . . . . A 355 LYS HB3 . 30410 1 97 . 1 . 1 12 12 LYS HG2 H 1 1.341 0.00 . . . . . . A 355 LYS HG2 . 30410 1 98 . 1 . 1 12 12 LYS HG3 H 1 1.341 0.00 . . . . . . A 355 LYS HG3 . 30410 1 99 . 1 . 1 12 12 LYS HD2 H 1 1.618 0.00 . . . . . . A 355 LYS HD2 . 30410 1 100 . 1 . 1 12 12 LYS HD3 H 1 1.618 0.00 . . . . . . A 355 LYS HD3 . 30410 1 101 . 1 . 1 12 12 LYS HE2 H 1 2.816 0.00 . . . . . . A 355 LYS HE2 . 30410 1 102 . 1 . 1 12 12 LYS HE3 H 1 2.816 0.00 . . . . . . A 355 LYS HE3 . 30410 1 103 . 1 . 1 12 12 LYS CA C 13 59.936 0.00 . . . . . . A 355 LYS CA . 30410 1 104 . 1 . 1 12 12 LYS CB C 13 32.524 0.00 . . . . . . A 355 LYS CB . 30410 1 105 . 1 . 1 12 12 LYS CG C 13 25.262 0.00 . . . . . . A 355 LYS CG . 30410 1 106 . 1 . 1 12 12 LYS CD C 13 30.015 0.00 . . . . . . A 355 LYS CD . 30410 1 107 . 1 . 1 12 12 LYS CE C 13 41.972 0.00 . . . . . . A 355 LYS CE . 30410 1 108 . 1 . 1 12 12 LYS N N 15 120.018 0.00 . . . . . . A 355 LYS N . 30410 1 109 . 1 . 1 13 13 LEU H H 1 7.818 0.00 . . . . . . A 356 LEU H . 30410 1 110 . 1 . 1 13 13 LEU HA H 1 4.449 0.00 . . . . . . A 356 LEU HA . 30410 1 111 . 1 . 1 13 13 LEU HB2 H 1 1.743 0.00 . . . . . . A 356 LEU HB2 . 30410 1 112 . 1 . 1 13 13 LEU HB3 H 1 2.083 0.00 . . . . . . A 356 LEU HB3 . 30410 1 113 . 1 . 1 13 13 LEU HG H 1 1.417 0.00 . . . . . . A 356 LEU HG . 30410 1 114 . 1 . 1 13 13 LEU HD11 H 1 0.831 0.00 . . . . . . A 356 LEU HD11 . 30410 1 115 . 1 . 1 13 13 LEU HD12 H 1 0.831 0.00 . . . . . . A 356 LEU HD12 . 30410 1 116 . 1 . 1 13 13 LEU HD13 H 1 0.831 0.00 . . . . . . A 356 LEU HD13 . 30410 1 117 . 1 . 1 13 13 LEU HD21 H 1 0.898 0.00 . . . . . . A 356 LEU HD21 . 30410 1 118 . 1 . 1 13 13 LEU HD22 H 1 0.898 0.00 . . . . . . A 356 LEU HD22 . 30410 1 119 . 1 . 1 13 13 LEU HD23 H 1 0.898 0.00 . . . . . . A 356 LEU HD23 . 30410 1 120 . 1 . 1 13 13 LEU CA C 13 58.672 0.00 . . . . . . A 356 LEU CA . 30410 1 121 . 1 . 1 13 13 LEU CB C 13 40.667 0.00 . . . . . . A 356 LEU CB . 30410 1 122 . 1 . 1 13 13 LEU CG C 13 27.590 0.00 . . . . . . A 356 LEU CG . 30410 1 123 . 1 . 1 13 13 LEU CD1 C 13 24.419 0.00 . . . . . . A 356 LEU CD1 . 30410 1 124 . 1 . 1 13 13 LEU CD2 C 13 27.032 0.00 . . . . . . A 356 LEU CD2 . 30410 1 125 . 1 . 1 13 13 LEU N N 15 122.984 0.00 . . . . . . A 356 LEU N . 30410 1 126 . 1 . 1 14 14 ARG H H 1 7.952 0.00 . . . . . . A 357 ARG H . 30410 1 127 . 1 . 1 14 14 ARG HA H 1 3.949 0.00 . . . . . . A 357 ARG HA . 30410 1 128 . 1 . 1 14 14 ARG HB2 H 1 1.865 0.00 . . . . . . A 357 ARG HB2 . 30410 1 129 . 1 . 1 14 14 ARG HB3 H 1 1.865 0.00 . . . . . . A 357 ARG HB3 . 30410 1 130 . 1 . 1 14 14 ARG HG2 H 1 1.470 0.00 . . . . . . A 357 ARG HG2 . 30410 1 131 . 1 . 1 14 14 ARG HG3 H 1 1.470 0.00 . . . . . . A 357 ARG HG3 . 30410 1 132 . 1 . 1 14 14 ARG HD2 H 1 3.139 0.00 . . . . . . A 357 ARG HD2 . 30410 1 133 . 1 . 1 14 14 ARG HD3 H 1 3.139 0.00 . . . . . . A 357 ARG HD3 . 30410 1 134 . 1 . 1 14 14 ARG CA C 13 60.333 0.00 . . . . . . A 357 ARG CA . 30410 1 135 . 1 . 1 14 14 ARG CB C 13 30.226 0.00 . . . . . . A 357 ARG CB . 30410 1 136 . 1 . 1 14 14 ARG CG C 13 28.940 0.00 . . . . . . A 357 ARG CG . 30410 1 137 . 1 . 1 14 14 ARG CD C 13 43.627 0.00 . . . . . . A 357 ARG CD . 30410 1 138 . 1 . 1 14 14 ARG N N 15 118.707 0.00 . . . . . . A 357 ARG N . 30410 1 139 . 1 . 1 15 15 ASN H H 1 8.615 0.00 . . . . . . A 358 ASN H . 30410 1 140 . 1 . 1 15 15 ASN HA H 1 4.398 0.00 . . . . . . A 358 ASN HA . 30410 1 141 . 1 . 1 15 15 ASN HB2 H 1 2.866 0.00 . . . . . . A 358 ASN HB2 . 30410 1 142 . 1 . 1 15 15 ASN HB3 H 1 2.931 0.00 . . . . . . A 358 ASN HB3 . 30410 1 143 . 1 . 1 15 15 ASN CA C 13 56.139 0.00 . . . . . . A 358 ASN CA . 30410 1 144 . 1 . 1 15 15 ASN CB C 13 37.770 0.00 . . . . . . A 358 ASN CB . 30410 1 145 . 1 . 1 15 15 ASN N N 15 118.218 0.00 . . . . . . A 358 ASN N . 30410 1 146 . 1 . 1 16 16 SER H H 1 8.954 0.00 . . . . . . A 359 SER H . 30410 1 147 . 1 . 1 16 16 SER HA H 1 4.217 0.00 . . . . . . A 359 SER HA . 30410 1 148 . 1 . 1 16 16 SER HB2 H 1 3.883 0.00 . . . . . . A 359 SER HB2 . 30410 1 149 . 1 . 1 16 16 SER HB3 H 1 3.883 0.00 . . . . . . A 359 SER HB3 . 30410 1 150 . 1 . 1 16 16 SER CA C 13 62.337 0.00 . . . . . . A 359 SER CA . 30410 1 151 . 1 . 1 16 16 SER CB C 13 63.116 0.00 . . . . . . A 359 SER CB . 30410 1 152 . 1 . 1 16 16 SER N N 15 119.777 0.00 . . . . . . A 359 SER N . 30410 1 153 . 1 . 1 17 17 CYS H H 1 8.261 0.00 . . . . . . A 360 CYS H . 30410 1 154 . 1 . 1 17 17 CYS HA H 1 3.889 0.00 . . . . . . A 360 CYS HA . 30410 1 155 . 1 . 1 17 17 CYS HB2 H 1 1.874 0.00 . . . . . . A 360 CYS HB2 . 30410 1 156 . 1 . 1 17 17 CYS HB3 H 1 2.954 0.00 . . . . . . A 360 CYS HB3 . 30410 1 157 . 1 . 1 17 17 CYS CA C 13 65.462 0.00 . . . . . . A 360 CYS CA . 30410 1 158 . 1 . 1 17 17 CYS CB C 13 26.258 0.00 . . . . . . A 360 CYS CB . 30410 1 159 . 1 . 1 17 17 CYS N N 15 118.531 0.00 . . . . . . A 360 CYS N . 30410 1 160 . 1 . 1 18 18 LYS H H 1 8.069 0.00 . . . . . . A 361 LYS H . 30410 1 161 . 1 . 1 18 18 LYS CA C 13 60.074 0.00 . . . . . . A 361 LYS CA . 30410 1 162 . 1 . 1 18 18 LYS CB C 13 31.913 0.00 . . . . . . A 361 LYS CB . 30410 1 163 . 1 . 1 18 18 LYS N N 15 121.394 0.00 . . . . . . A 361 LYS N . 30410 1 164 . 1 . 1 19 19 THR H H 1 8.231 0.00 . . . . . . A 362 THR H . 30410 1 165 . 1 . 1 19 19 THR HA H 1 4.085 0.00 . . . . . . A 362 THR HA . 30410 1 166 . 1 . 1 19 19 THR HB H 1 3.770 0.00 . . . . . . A 362 THR HB . 30410 1 167 . 1 . 1 19 19 THR HG21 H 1 0.806 0.00 . . . . . . A 362 THR HG21 . 30410 1 168 . 1 . 1 19 19 THR HG22 H 1 0.806 0.00 . . . . . . A 362 THR HG22 . 30410 1 169 . 1 . 1 19 19 THR HG23 H 1 0.806 0.00 . . . . . . A 362 THR HG23 . 30410 1 170 . 1 . 1 19 19 THR CA C 13 67.233 0.00 . . . . . . A 362 THR CA . 30410 1 171 . 1 . 1 19 19 THR CB C 13 67.837 0.00 . . . . . . A 362 THR CB . 30410 1 172 . 1 . 1 19 19 THR CG2 C 13 21.406 0.00 . . . . . . A 362 THR CG2 . 30410 1 173 . 1 . 1 19 19 THR N N 15 119.801 0.00 . . . . . . A 362 THR N . 30410 1 174 . 1 . 1 20 20 TRP H H 1 6.987 0.00 . . . . . . A 363 TRP H . 30410 1 175 . 1 . 1 20 20 TRP HA H 1 4.540 0.00 . . . . . . A 363 TRP HA . 30410 1 176 . 1 . 1 20 20 TRP HB2 H 1 1.953 0.00 . . . . . . A 363 TRP HB2 . 30410 1 177 . 1 . 1 20 20 TRP HB3 H 1 2.369 0.00 . . . . . . A 363 TRP HB3 . 30410 1 178 . 1 . 1 20 20 TRP HD1 H 1 7.039 0.00 . . . . . . A 363 TRP HD1 . 30410 1 179 . 1 . 1 20 20 TRP HE3 H 1 7.390 0.00 . . . . . . A 363 TRP HE3 . 30410 1 180 . 1 . 1 20 20 TRP HZ2 H 1 7.622 0.00 . . . . . . A 363 TRP HZ2 . 30410 1 181 . 1 . 1 20 20 TRP HZ3 H 1 7.109 0.00 . . . . . . A 363 TRP HZ3 . 30410 1 182 . 1 . 1 20 20 TRP HH2 H 1 7.256 0.00 . . . . . . A 363 TRP HH2 . 30410 1 183 . 1 . 1 20 20 TRP CA C 13 56.544 0.00 . . . . . . A 363 TRP CA . 30410 1 184 . 1 . 1 20 20 TRP CB C 13 28.989 0.00 . . . . . . A 363 TRP CB . 30410 1 185 . 1 . 1 20 20 TRP CD1 C 13 127.312 0.00 . . . . . . A 363 TRP CD1 . 30410 1 186 . 1 . 1 20 20 TRP CE3 C 13 120.243 0.00 . . . . . . A 363 TRP CE3 . 30410 1 187 . 1 . 1 20 20 TRP CZ2 C 13 115.736 0.00 . . . . . . A 363 TRP CZ2 . 30410 1 188 . 1 . 1 20 20 TRP CZ3 C 13 121.171 0.00 . . . . . . A 363 TRP CZ3 . 30410 1 189 . 1 . 1 20 20 TRP CH2 C 13 124.221 0.00 . . . . . . A 363 TRP CH2 . 30410 1 190 . 1 . 1 20 20 TRP N N 15 119.181 0.00 . . . . . . A 363 TRP N . 30410 1 191 . 1 . 1 21 21 ASN H H 1 8.382 0.00 . . . . . . A 364 ASN H . 30410 1 192 . 1 . 1 21 21 ASN HA H 1 4.494 0.00 . . . . . . A 364 ASN HA . 30410 1 193 . 1 . 1 21 21 ASN HB2 H 1 2.713 0.00 . . . . . . A 364 ASN HB2 . 30410 1 194 . 1 . 1 21 21 ASN HB3 H 1 3.248 0.00 . . . . . . A 364 ASN HB3 . 30410 1 195 . 1 . 1 21 21 ASN CA C 13 54.495 0.00 . . . . . . A 364 ASN CA . 30410 1 196 . 1 . 1 21 21 ASN CB C 13 37.605 0.00 . . . . . . A 364 ASN CB . 30410 1 197 . 1 . 1 21 21 ASN N N 15 122.954 0.00 . . . . . . A 364 ASN N . 30410 1 198 . 1 . 1 22 22 HIS H H 1 8.731 0.00 . . . . . . A 365 HIS H . 30410 1 199 . 1 . 1 22 22 HIS HE1 H 1 7.613 0.00 . . . . . . A 365 HIS HE1 . 30410 1 200 . 1 . 1 22 22 HIS CE1 C 13 138.620 0.00 . . . . . . A 365 HIS CE1 . 30410 1 201 . 1 . 1 22 22 HIS N N 15 108.895 0.00 . . . . . . A 365 HIS N . 30410 1 202 . 1 . 1 23 23 PHE H H 1 7.697 0.00 . . . . . . A 366 PHE H . 30410 1 203 . 1 . 1 23 23 PHE HD1 H 1 6.824 0.00 . . . . . . A 366 PHE HD1 . 30410 1 204 . 1 . 1 23 23 PHE HD2 H 1 6.824 0.00 . . . . . . A 366 PHE HD2 . 30410 1 205 . 1 . 1 23 23 PHE HE1 H 1 6.622 0.00 . . . . . . A 366 PHE HE1 . 30410 1 206 . 1 . 1 23 23 PHE HE2 H 1 6.622 0.00 . . . . . . A 366 PHE HE2 . 30410 1 207 . 1 . 1 23 23 PHE HZ H 1 6.331 0.00 . . . . . . A 366 PHE HZ . 30410 1 208 . 1 . 1 23 23 PHE CA C 13 60.037 0.00 . . . . . . A 366 PHE CA . 30410 1 209 . 1 . 1 23 23 PHE CB C 13 36.294 0.00 . . . . . . A 366 PHE CB . 30410 1 210 . 1 . 1 23 23 PHE CD1 C 13 130.976 0.00 . . . . . . A 366 PHE CD1 . 30410 1 211 . 1 . 1 23 23 PHE CE1 C 13 131.059 0.00 . . . . . . A 366 PHE CE1 . 30410 1 212 . 1 . 1 23 23 PHE CZ C 13 129.202 0.00 . . . . . . A 366 PHE CZ . 30410 1 213 . 1 . 1 23 23 PHE N N 15 107.710 0.00 . . . . . . A 366 PHE N . 30410 1 214 . 1 . 1 24 24 SER H H 1 7.457 0.00 . . . . . . A 367 SER H . 30410 1 215 . 1 . 1 24 24 SER CA C 13 58.320 0.00 . . . . . . A 367 SER CA . 30410 1 216 . 1 . 1 24 24 SER CB C 13 65.799 0.00 . . . . . . A 367 SER CB . 30410 1 217 . 1 . 1 24 24 SER N N 15 110.992 0.00 . . . . . . A 367 SER N . 30410 1 218 . 1 . 1 25 25 ASP H H 1 9.088 0.00 . . . . . . A 368 ASP H . 30410 1 219 . 1 . 1 25 25 ASP HA H 1 4.824 0.00 . . . . . . A 368 ASP HA . 30410 1 220 . 1 . 1 25 25 ASP HB2 H 1 2.637 0.00 . . . . . . A 368 ASP HB2 . 30410 1 221 . 1 . 1 25 25 ASP HB3 H 1 2.842 0.00 . . . . . . A 368 ASP HB3 . 30410 1 222 . 1 . 1 25 25 ASP CA C 13 54.649 0.00 . . . . . . A 368 ASP CA . 30410 1 223 . 1 . 1 25 25 ASP CB C 13 41.994 0.00 . . . . . . A 368 ASP CB . 30410 1 224 . 1 . 1 25 25 ASP N N 15 123.051 0.00 . . . . . . A 368 ASP N . 30410 1 225 . 1 . 1 26 26 ASN H H 1 8.196 0.00 . . . . . . A 369 ASN H . 30410 1 226 . 1 . 1 26 26 ASN CA C 13 52.350 0.00 . . . . . . A 369 ASN CA . 30410 1 227 . 1 . 1 26 26 ASN CB C 13 40.689 0.00 . . . . . . A 369 ASN CB . 30410 1 228 . 1 . 1 26 26 ASN N N 15 117.033 0.00 . . . . . . A 369 ASN N . 30410 1 229 . 1 . 1 27 27 GLU H H 1 9.044 0.00 . . . . . . A 370 GLU H . 30410 1 230 . 1 . 1 27 27 GLU HA H 1 3.997 0.00 . . . . . . A 370 GLU HA . 30410 1 231 . 1 . 1 27 27 GLU HB2 H 1 1.984 0.00 . . . . . . A 370 GLU HB2 . 30410 1 232 . 1 . 1 27 27 GLU HB3 H 1 2.077 0.00 . . . . . . A 370 GLU HB3 . 30410 1 233 . 1 . 1 27 27 GLU HG2 H 1 2.304 0.00 . . . . . . A 370 GLU HG2 . 30410 1 234 . 1 . 1 27 27 GLU HG3 H 1 2.304 0.00 . . . . . . A 370 GLU HG3 . 30410 1 235 . 1 . 1 27 27 GLU CA C 13 59.845 0.00 . . . . . . A 370 GLU CA . 30410 1 236 . 1 . 1 27 27 GLU CB C 13 29.653 0.00 . . . . . . A 370 GLU CB . 30410 1 237 . 1 . 1 27 27 GLU CG C 13 35.483 0.00 . . . . . . A 370 GLU CG . 30410 1 238 . 1 . 1 27 27 GLU N N 15 124.652 0.00 . . . . . . A 370 GLU N . 30410 1 239 . 1 . 1 28 28 ALA H H 1 8.293 0.00 . . . . . . A 371 ALA H . 30410 1 240 . 1 . 1 28 28 ALA HA H 1 4.117 0.00 . . . . . . A 371 ALA HA . 30410 1 241 . 1 . 1 28 28 ALA HB1 H 1 1.455 0.00 . . . . . . A 371 ALA HB1 . 30410 1 242 . 1 . 1 28 28 ALA HB2 H 1 1.455 0.00 . . . . . . A 371 ALA HB2 . 30410 1 243 . 1 . 1 28 28 ALA HB3 H 1 1.455 0.00 . . . . . . A 371 ALA HB3 . 30410 1 244 . 1 . 1 28 28 ALA CA C 13 55.392 0.00 . . . . . . A 371 ALA CA . 30410 1 245 . 1 . 1 28 28 ALA CB C 13 17.737 0.00 . . . . . . A 371 ALA CB . 30410 1 246 . 1 . 1 28 28 ALA N N 15 121.195 0.00 . . . . . . A 371 ALA N . 30410 1 247 . 1 . 1 29 29 GLU H H 1 8.024 0.00 . . . . . . A 372 GLU H . 30410 1 248 . 1 . 1 29 29 GLU HA H 1 4.083 0.00 . . . . . . A 372 GLU HA . 30410 1 249 . 1 . 1 29 29 GLU HB2 H 1 2.205 0.00 . . . . . . A 372 GLU HB2 . 30410 1 250 . 1 . 1 29 29 GLU HB3 H 1 2.205 0.00 . . . . . . A 372 GLU HB3 . 30410 1 251 . 1 . 1 29 29 GLU HG2 H 1 2.402 0.00 . . . . . . A 372 GLU HG2 . 30410 1 252 . 1 . 1 29 29 GLU HG3 H 1 2.458 0.00 . . . . . . A 372 GLU HG3 . 30410 1 253 . 1 . 1 29 29 GLU CA C 13 58.979 0.00 . . . . . . A 372 GLU CA . 30410 1 254 . 1 . 1 29 29 GLU CB C 13 29.786 0.00 . . . . . . A 372 GLU CB . 30410 1 255 . 1 . 1 29 29 GLU CG C 13 36.923 0.00 . . . . . . A 372 GLU CG . 30410 1 256 . 1 . 1 29 29 GLU N N 15 118.252 0.00 . . . . . . A 372 GLU N . 30410 1 257 . 1 . 1 30 30 ARG H H 1 8.165 0.00 . . . . . . A 373 ARG H . 30410 1 258 . 1 . 1 30 30 ARG HA H 1 3.935 0.00 . . . . . . A 373 ARG HA . 30410 1 259 . 1 . 1 30 30 ARG HB2 H 1 1.813 0.00 . . . . . . A 373 ARG HB2 . 30410 1 260 . 1 . 1 30 30 ARG HB3 H 1 2.034 0.00 . . . . . . A 373 ARG HB3 . 30410 1 261 . 1 . 1 30 30 ARG HG2 H 1 1.504 0.00 . . . . . . A 373 ARG HG2 . 30410 1 262 . 1 . 1 30 30 ARG HG3 H 1 1.656 0.00 . . . . . . A 373 ARG HG3 . 30410 1 263 . 1 . 1 30 30 ARG HD2 H 1 3.146 0.00 . . . . . . A 373 ARG HD2 . 30410 1 264 . 1 . 1 30 30 ARG HD3 H 1 3.301 0.00 . . . . . . A 373 ARG HD3 . 30410 1 265 . 1 . 1 30 30 ARG CA C 13 60.764 0.00 . . . . . . A 373 ARG CA . 30410 1 266 . 1 . 1 30 30 ARG CB C 13 30.745 0.00 . . . . . . A 373 ARG CB . 30410 1 267 . 1 . 1 30 30 ARG CG C 13 28.327 0.00 . . . . . . A 373 ARG CG . 30410 1 268 . 1 . 1 30 30 ARG CD C 13 43.934 0.00 . . . . . . A 373 ARG CD . 30410 1 269 . 1 . 1 30 30 ARG N N 15 121.852 0.00 . . . . . . A 373 ARG N . 30410 1 270 . 1 . 1 31 31 VAL H H 1 8.207 0.00 . . . . . . A 374 VAL H . 30410 1 271 . 1 . 1 31 31 VAL HA H 1 3.636 0.00 . . . . . . A 374 VAL HA . 30410 1 272 . 1 . 1 31 31 VAL HB H 1 2.089 0.00 . . . . . . A 374 VAL HB . 30410 1 273 . 1 . 1 31 31 VAL HG11 H 1 1.062 0.00 . . . . . . A 374 VAL HG11 . 30410 1 274 . 1 . 1 31 31 VAL HG12 H 1 1.062 0.00 . . . . . . A 374 VAL HG12 . 30410 1 275 . 1 . 1 31 31 VAL HG13 H 1 1.062 0.00 . . . . . . A 374 VAL HG13 . 30410 1 276 . 1 . 1 31 31 VAL HG21 H 1 0.938 0.00 . . . . . . A 374 VAL HG21 . 30410 1 277 . 1 . 1 31 31 VAL HG22 H 1 0.938 0.00 . . . . . . A 374 VAL HG22 . 30410 1 278 . 1 . 1 31 31 VAL HG23 H 1 0.938 0.00 . . . . . . A 374 VAL HG23 . 30410 1 279 . 1 . 1 31 31 VAL CA C 13 66.484 0.00 . . . . . . A 374 VAL CA . 30410 1 280 . 1 . 1 31 31 VAL CB C 13 31.909 0.00 . . . . . . A 374 VAL CB . 30410 1 281 . 1 . 1 31 31 VAL CG1 C 13 22.669 0.00 . . . . . . A 374 VAL CG1 . 30410 1 282 . 1 . 1 31 31 VAL CG2 C 13 21.150 0.00 . . . . . . A 374 VAL CG2 . 30410 1 283 . 1 . 1 31 31 VAL N N 15 117.933 0.00 . . . . . . A 374 VAL N . 30410 1 284 . 1 . 1 32 32 LYS H H 1 7.379 0.00 . . . . . . A 375 LYS H . 30410 1 285 . 1 . 1 32 32 LYS HA H 1 4.202 0.00 . . . . . . A 375 LYS HA . 30410 1 286 . 1 . 1 32 32 LYS HB2 H 1 1.929 0.00 . . . . . . A 375 LYS HB2 . 30410 1 287 . 1 . 1 32 32 LYS HB3 H 1 2.006 0.00 . . . . . . A 375 LYS HB3 . 30410 1 288 . 1 . 1 32 32 LYS HG2 H 1 1.532 0.00 . . . . . . A 375 LYS HG2 . 30410 1 289 . 1 . 1 32 32 LYS HG3 H 1 1.532 0.00 . . . . . . A 375 LYS HG3 . 30410 1 290 . 1 . 1 32 32 LYS HD2 H 1 1.750 0.00 . . . . . . A 375 LYS HD2 . 30410 1 291 . 1 . 1 32 32 LYS HD3 H 1 1.750 0.00 . . . . . . A 375 LYS HD3 . 30410 1 292 . 1 . 1 32 32 LYS HE2 H 1 2.972 0.00 . . . . . . A 375 LYS HE2 . 30410 1 293 . 1 . 1 32 32 LYS HE3 H 1 2.972 0.00 . . . . . . A 375 LYS HE3 . 30410 1 294 . 1 . 1 32 32 LYS CA C 13 58.967 0.00 . . . . . . A 375 LYS CA . 30410 1 295 . 1 . 1 32 32 LYS CB C 13 32.132 0.00 . . . . . . A 375 LYS CB . 30410 1 296 . 1 . 1 32 32 LYS CG C 13 24.732 0.00 . . . . . . A 375 LYS CG . 30410 1 297 . 1 . 1 32 32 LYS CD C 13 28.995 0.00 . . . . . . A 375 LYS CD . 30410 1 298 . 1 . 1 32 32 LYS CE C 13 42.188 0.00 . . . . . . A 375 LYS CE . 30410 1 299 . 1 . 1 32 32 LYS N N 15 120.320 0.00 . . . . . . A 375 LYS N . 30410 1 300 . 1 . 1 33 33 MET H H 1 8.405 0.00 . . . . . . A 376 MET H . 30410 1 301 . 1 . 1 33 33 MET HA H 1 4.430 0.00 . . . . . . A 376 MET HA . 30410 1 302 . 1 . 1 33 33 MET HB2 H 1 2.302 0.00 . . . . . . A 376 MET HB2 . 30410 1 303 . 1 . 1 33 33 MET HB3 H 1 2.470 0.00 . . . . . . A 376 MET HB3 . 30410 1 304 . 1 . 1 33 33 MET HG2 H 1 2.849 0.00 . . . . . . A 376 MET HG2 . 30410 1 305 . 1 . 1 33 33 MET HG3 H 1 2.989 0.00 . . . . . . A 376 MET HG3 . 30410 1 306 . 1 . 1 33 33 MET CA C 13 57.484 0.00 . . . . . . A 376 MET CA . 30410 1 307 . 1 . 1 33 33 MET CB C 13 32.178 0.00 . . . . . . A 376 MET CB . 30410 1 308 . 1 . 1 33 33 MET CG C 13 32.507 0.00 . . . . . . A 376 MET CG . 30410 1 309 . 1 . 1 33 33 MET N N 15 118.653 0.00 . . . . . . A 376 MET N . 30410 1 310 . 1 . 1 34 34 MET H H 1 8.520 0.00 . . . . . . A 377 MET H . 30410 1 311 . 1 . 1 34 34 MET HA H 1 3.760 0.00 . . . . . . A 377 MET HA . 30410 1 312 . 1 . 1 34 34 MET HB2 H 1 2.003 0.00 . . . . . . A 377 MET HB2 . 30410 1 313 . 1 . 1 34 34 MET HB3 H 1 2.003 0.00 . . . . . . A 377 MET HB3 . 30410 1 314 . 1 . 1 34 34 MET HG2 H 1 1.786 0.00 . . . . . . A 377 MET HG2 . 30410 1 315 . 1 . 1 34 34 MET HG3 H 1 2.128 0.00 . . . . . . A 377 MET HG3 . 30410 1 316 . 1 . 1 34 34 MET CA C 13 60.483 0.00 . . . . . . A 377 MET CA . 30410 1 317 . 1 . 1 34 34 MET CB C 13 32.865 0.00 . . . . . . A 377 MET CB . 30410 1 318 . 1 . 1 34 34 MET CG C 13 31.480 0.00 . . . . . . A 377 MET CG . 30410 1 319 . 1 . 1 34 34 MET N N 15 119.177 0.00 . . . . . . A 377 MET N . 30410 1 320 . 1 . 1 35 35 GLU H H 1 7.648 0.00 . . . . . . A 378 GLU H . 30410 1 321 . 1 . 1 35 35 GLU HA H 1 4.076 0.00 . . . . . . A 378 GLU HA . 30410 1 322 . 1 . 1 35 35 GLU HB2 H 1 2.175 0.00 . . . . . . A 378 GLU HB2 . 30410 1 323 . 1 . 1 35 35 GLU HB3 H 1 2.339 0.00 . . . . . . A 378 GLU HB3 . 30410 1 324 . 1 . 1 35 35 GLU HG2 H 1 2.500 0.00 . . . . . . A 378 GLU HG2 . 30410 1 325 . 1 . 1 35 35 GLU HG3 H 1 2.500 0.00 . . . . . . A 378 GLU HG3 . 30410 1 326 . 1 . 1 35 35 GLU CA C 13 59.496 0.00 . . . . . . A 378 GLU CA . 30410 1 327 . 1 . 1 35 35 GLU CB C 13 29.476 0.00 . . . . . . A 378 GLU CB . 30410 1 328 . 1 . 1 35 35 GLU CG C 13 36.398 0.00 . . . . . . A 378 GLU CG . 30410 1 329 . 1 . 1 35 35 GLU N N 15 119.809 0.00 . . . . . . A 378 GLU N . 30410 1 330 . 1 . 1 36 36 GLU H H 1 8.332 0.00 . . . . . . A 379 GLU H . 30410 1 331 . 1 . 1 36 36 GLU HA H 1 4.562 0.00 . . . . . . A 379 GLU HA . 30410 1 332 . 1 . 1 36 36 GLU HB2 H 1 2.141 0.00 . . . . . . A 379 GLU HB2 . 30410 1 333 . 1 . 1 36 36 GLU HB3 H 1 2.242 0.00 . . . . . . A 379 GLU HB3 . 30410 1 334 . 1 . 1 36 36 GLU HG2 H 1 2.356 0.00 . . . . . . A 379 GLU HG2 . 30410 1 335 . 1 . 1 36 36 GLU HG3 H 1 2.700 0.00 . . . . . . A 379 GLU HG3 . 30410 1 336 . 1 . 1 36 36 GLU CA C 13 58.404 0.00 . . . . . . A 379 GLU CA . 30410 1 337 . 1 . 1 36 36 GLU CB C 13 28.618 0.00 . . . . . . A 379 GLU CB . 30410 1 338 . 1 . 1 36 36 GLU CG C 13 34.446 0.00 . . . . . . A 379 GLU CG . 30410 1 339 . 1 . 1 36 36 GLU N N 15 120.417 0.00 . . . . . . A 379 GLU N . 30410 1 340 . 1 . 1 37 37 VAL H H 1 8.821 0.00 . . . . . . A 380 VAL H . 30410 1 341 . 1 . 1 37 37 VAL HA H 1 3.573 0.00 . . . . . . A 380 VAL HA . 30410 1 342 . 1 . 1 37 37 VAL HB H 1 2.428 0.00 . . . . . . A 380 VAL HB . 30410 1 343 . 1 . 1 37 37 VAL HG11 H 1 1.330 0.00 . . . . . . A 380 VAL HG11 . 30410 1 344 . 1 . 1 37 37 VAL HG12 H 1 1.330 0.00 . . . . . . A 380 VAL HG12 . 30410 1 345 . 1 . 1 37 37 VAL HG13 H 1 1.330 0.00 . . . . . . A 380 VAL HG13 . 30410 1 346 . 1 . 1 37 37 VAL HG21 H 1 1.024 0.00 . . . . . . A 380 VAL HG21 . 30410 1 347 . 1 . 1 37 37 VAL HG22 H 1 1.024 0.00 . . . . . . A 380 VAL HG22 . 30410 1 348 . 1 . 1 37 37 VAL HG23 H 1 1.024 0.00 . . . . . . A 380 VAL HG23 . 30410 1 349 . 1 . 1 37 37 VAL CA C 13 67.458 0.00 . . . . . . A 380 VAL CA . 30410 1 350 . 1 . 1 37 37 VAL CB C 13 31.976 0.00 . . . . . . A 380 VAL CB . 30410 1 351 . 1 . 1 37 37 VAL CG1 C 13 25.623 0.00 . . . . . . A 380 VAL CG1 . 30410 1 352 . 1 . 1 37 37 VAL CG2 C 13 21.809 0.00 . . . . . . A 380 VAL CG2 . 30410 1 353 . 1 . 1 37 37 VAL N N 15 119.982 0.00 . . . . . . A 380 VAL N . 30410 1 354 . 1 . 1 38 38 GLU H H 1 7.664 0.00 . . . . . . A 381 GLU H . 30410 1 355 . 1 . 1 38 38 GLU HA H 1 4.049 0.00 . . . . . . A 381 GLU HA . 30410 1 356 . 1 . 1 38 38 GLU HB2 H 1 2.155 0.00 . . . . . . A 381 GLU HB2 . 30410 1 357 . 1 . 1 38 38 GLU HB3 H 1 2.155 0.00 . . . . . . A 381 GLU HB3 . 30410 1 358 . 1 . 1 38 38 GLU HG2 H 1 2.479 0.00 . . . . . . A 381 GLU HG2 . 30410 1 359 . 1 . 1 38 38 GLU HG3 H 1 2.479 0.00 . . . . . . A 381 GLU HG3 . 30410 1 360 . 1 . 1 38 38 GLU CA C 13 59.314 0.00 . . . . . . A 381 GLU CA . 30410 1 361 . 1 . 1 38 38 GLU CB C 13 28.486 0.00 . . . . . . A 381 GLU CB . 30410 1 362 . 1 . 1 38 38 GLU CG C 13 35.615 0.00 . . . . . . A 381 GLU CG . 30410 1 363 . 1 . 1 38 38 GLU N N 15 119.255 0.00 . . . . . . A 381 GLU N . 30410 1 364 . 1 . 1 39 39 LYS H H 1 7.431 0.00 . . . . . . A 382 LYS H . 30410 1 365 . 1 . 1 39 39 LYS HA H 1 4.147 0.00 . . . . . . A 382 LYS HA . 30410 1 366 . 1 . 1 39 39 LYS HB2 H 1 1.910 0.00 . . . . . . A 382 LYS HB2 . 30410 1 367 . 1 . 1 39 39 LYS HB3 H 1 2.144 0.00 . . . . . . A 382 LYS HB3 . 30410 1 368 . 1 . 1 39 39 LYS HG2 H 1 1.597 0.00 . . . . . . A 382 LYS HG2 . 30410 1 369 . 1 . 1 39 39 LYS HG3 H 1 1.597 0.00 . . . . . . A 382 LYS HG3 . 30410 1 370 . 1 . 1 39 39 LYS HE2 H 1 2.797 0.00 . . . . . . A 382 LYS HE2 . 30410 1 371 . 1 . 1 39 39 LYS HE3 H 1 2.885 0.00 . . . . . . A 382 LYS HE3 . 30410 1 372 . 1 . 1 39 39 LYS CA C 13 59.758 0.00 . . . . . . A 382 LYS CA . 30410 1 373 . 1 . 1 39 39 LYS CB C 13 32.507 0.00 . . . . . . A 382 LYS CB . 30410 1 374 . 1 . 1 39 39 LYS CG C 13 24.782 0.00 . . . . . . A 382 LYS CG . 30410 1 375 . 1 . 1 39 39 LYS CD C 13 30.073 0.00 . . . . . . A 382 LYS CD . 30410 1 376 . 1 . 1 39 39 LYS CE C 13 41.478 0.00 . . . . . . A 382 LYS CE . 30410 1 377 . 1 . 1 39 39 LYS N N 15 119.847 0.00 . . . . . . A 382 LYS N . 30410 1 378 . 1 . 1 40 40 LEU H H 1 7.996 0.00 . . . . . . A 383 LEU H . 30410 1 379 . 1 . 1 40 40 LEU HA H 1 3.908 0.00 . . . . . . A 383 LEU HA . 30410 1 380 . 1 . 1 40 40 LEU HB2 H 1 1.263 0.00 . . . . . . A 383 LEU HB2 . 30410 1 381 . 1 . 1 40 40 LEU HB3 H 1 2.277 0.00 . . . . . . A 383 LEU HB3 . 30410 1 382 . 1 . 1 40 40 LEU HG H 1 1.976 0.00 . . . . . . A 383 LEU HG . 30410 1 383 . 1 . 1 40 40 LEU HD11 H 1 0.735 0.00 . . . . . . A 383 LEU HD11 . 30410 1 384 . 1 . 1 40 40 LEU HD12 H 1 0.735 0.00 . . . . . . A 383 LEU HD12 . 30410 1 385 . 1 . 1 40 40 LEU HD13 H 1 0.735 0.00 . . . . . . A 383 LEU HD13 . 30410 1 386 . 1 . 1 40 40 LEU HD21 H 1 0.827 0.00 . . . . . . A 383 LEU HD21 . 30410 1 387 . 1 . 1 40 40 LEU HD22 H 1 0.827 0.00 . . . . . . A 383 LEU HD22 . 30410 1 388 . 1 . 1 40 40 LEU HD23 H 1 0.827 0.00 . . . . . . A 383 LEU HD23 . 30410 1 389 . 1 . 1 40 40 LEU CA C 13 58.307 0.00 . . . . . . A 383 LEU CA . 30410 1 390 . 1 . 1 40 40 LEU CB C 13 41.009 0.00 . . . . . . A 383 LEU CB . 30410 1 391 . 1 . 1 40 40 LEU CG C 13 26.666 0.00 . . . . . . A 383 LEU CG . 30410 1 392 . 1 . 1 40 40 LEU CD1 C 13 23.487 0.00 . . . . . . A 383 LEU CD1 . 30410 1 393 . 1 . 1 40 40 LEU CD2 C 13 26.136 0.00 . . . . . . A 383 LEU CD2 . 30410 1 394 . 1 . 1 40 40 LEU N N 15 118.125 0.00 . . . . . . A 383 LEU N . 30410 1 395 . 1 . 1 41 41 CYS H H 1 8.490 0.00 . . . . . . A 384 CYS H . 30410 1 396 . 1 . 1 41 41 CYS HA H 1 3.931 0.00 . . . . . . A 384 CYS HA . 30410 1 397 . 1 . 1 41 41 CYS HB2 H 1 2.504 0.00 . . . . . . A 384 CYS HB2 . 30410 1 398 . 1 . 1 41 41 CYS HB3 H 1 3.281 0.00 . . . . . . A 384 CYS HB3 . 30410 1 399 . 1 . 1 41 41 CYS CA C 13 65.069 0.00 . . . . . . A 384 CYS CA . 30410 1 400 . 1 . 1 41 41 CYS CB C 13 27.271 0.00 . . . . . . A 384 CYS CB . 30410 1 401 . 1 . 1 41 41 CYS N N 15 115.930 0.00 . . . . . . A 384 CYS N . 30410 1 402 . 1 . 1 42 42 ASP H H 1 7.868 0.00 . . . . . . A 385 ASP H . 30410 1 403 . 1 . 1 42 42 ASP HA H 1 4.501 0.00 . . . . . . A 385 ASP HA . 30410 1 404 . 1 . 1 42 42 ASP HB2 H 1 2.670 0.00 . . . . . . A 385 ASP HB2 . 30410 1 405 . 1 . 1 42 42 ASP HB3 H 1 2.780 0.00 . . . . . . A 385 ASP HB3 . 30410 1 406 . 1 . 1 42 42 ASP CA C 13 56.566 0.00 . . . . . . A 385 ASP CA . 30410 1 407 . 1 . 1 42 42 ASP CB C 13 42.157 0.00 . . . . . . A 385 ASP CB . 30410 1 408 . 1 . 1 42 42 ASP N N 15 117.376 0.00 . . . . . . A 385 ASP N . 30410 1 409 . 1 . 1 43 43 ARG H H 1 7.711 0.00 . . . . . . A 386 ARG H . 30410 1 410 . 1 . 1 43 43 ARG HA H 1 4.428 0.00 . . . . . . A 386 ARG HA . 30410 1 411 . 1 . 1 43 43 ARG HB2 H 1 1.707 0.00 . . . . . . A 386 ARG HB2 . 30410 1 412 . 1 . 1 43 43 ARG HB3 H 1 1.927 0.00 . . . . . . A 386 ARG HB3 . 30410 1 413 . 1 . 1 43 43 ARG HD2 H 1 3.069 0.00 . . . . . . A 386 ARG HD2 . 30410 1 414 . 1 . 1 43 43 ARG HD3 H 1 3.093 0.00 . . . . . . A 386 ARG HD3 . 30410 1 415 . 1 . 1 43 43 ARG CA C 13 56.824 0.00 . . . . . . A 386 ARG CA . 30410 1 416 . 1 . 1 43 43 ARG CB C 13 33.309 0.00 . . . . . . A 386 ARG CB . 30410 1 417 . 1 . 1 43 43 ARG CG C 13 28.341 0.00 . . . . . . A 386 ARG CG . 30410 1 418 . 1 . 1 43 43 ARG CD C 13 42.788 0.00 . . . . . . A 386 ARG CD . 30410 1 419 . 1 . 1 43 43 ARG N N 15 115.033 0.00 . . . . . . A 386 ARG N . 30410 1 420 . 1 . 1 44 44 LEU H H 1 8.361 0.00 . . . . . . A 387 LEU H . 30410 1 421 . 1 . 1 44 44 LEU HA H 1 4.367 0.00 . . . . . . A 387 LEU HA . 30410 1 422 . 1 . 1 44 44 LEU HB2 H 1 1.442 0.00 . . . . . . A 387 LEU HB2 . 30410 1 423 . 1 . 1 44 44 LEU HB3 H 1 1.793 0.00 . . . . . . A 387 LEU HB3 . 30410 1 424 . 1 . 1 44 44 LEU HG H 1 1.897 0.00 . . . . . . A 387 LEU HG . 30410 1 425 . 1 . 1 44 44 LEU HD11 H 1 0.907 0.00 . . . . . . A 387 LEU HD11 . 30410 1 426 . 1 . 1 44 44 LEU HD12 H 1 0.907 0.00 . . . . . . A 387 LEU HD12 . 30410 1 427 . 1 . 1 44 44 LEU HD13 H 1 0.907 0.00 . . . . . . A 387 LEU HD13 . 30410 1 428 . 1 . 1 44 44 LEU HD21 H 1 0.788 0.00 . . . . . . A 387 LEU HD21 . 30410 1 429 . 1 . 1 44 44 LEU HD22 H 1 0.788 0.00 . . . . . . A 387 LEU HD22 . 30410 1 430 . 1 . 1 44 44 LEU HD23 H 1 0.788 0.00 . . . . . . A 387 LEU HD23 . 30410 1 431 . 1 . 1 44 44 LEU CA C 13 55.829 0.00 . . . . . . A 387 LEU CA . 30410 1 432 . 1 . 1 44 44 LEU CB C 13 42.642 0.00 . . . . . . A 387 LEU CB . 30410 1 433 . 1 . 1 44 44 LEU CG C 13 27.165 0.00 . . . . . . A 387 LEU CG . 30410 1 434 . 1 . 1 44 44 LEU CD1 C 13 23.331 0.00 . . . . . . A 387 LEU CD1 . 30410 1 435 . 1 . 1 44 44 LEU CD2 C 13 26.270 0.00 . . . . . . A 387 LEU CD2 . 30410 1 436 . 1 . 1 44 44 LEU N N 15 120.059 0.00 . . . . . . A 387 LEU N . 30410 1 437 . 1 . 1 45 45 GLU H H 1 8.424 0.00 . . . . . . A 388 GLU H . 30410 1 438 . 1 . 1 45 45 GLU HA H 1 4.306 0.00 . . . . . . A 388 GLU HA . 30410 1 439 . 1 . 1 45 45 GLU HB2 H 1 2.056 0.00 . . . . . . A 388 GLU HB2 . 30410 1 440 . 1 . 1 45 45 GLU HB3 H 1 2.304 0.00 . . . . . . A 388 GLU HB3 . 30410 1 441 . 1 . 1 45 45 GLU HG2 H 1 2.436 0.00 . . . . . . A 388 GLU HG2 . 30410 1 442 . 1 . 1 45 45 GLU HG3 H 1 2.436 0.00 . . . . . . A 388 GLU HG3 . 30410 1 443 . 1 . 1 45 45 GLU CA C 13 55.590 0.00 . . . . . . A 388 GLU CA . 30410 1 444 . 1 . 1 45 45 GLU CB C 13 30.568 0.00 . . . . . . A 388 GLU CB . 30410 1 445 . 1 . 1 45 45 GLU CG C 13 36.942 0.00 . . . . . . A 388 GLU CG . 30410 1 446 . 1 . 1 45 45 GLU N N 15 119.532 0.00 . . . . . . A 388 GLU N . 30410 1 447 . 1 . 1 46 46 LEU H H 1 8.817 0.00 . . . . . . A 389 LEU H . 30410 1 448 . 1 . 1 46 46 LEU HA H 1 3.892 0.00 . . . . . . A 389 LEU HA . 30410 1 449 . 1 . 1 46 46 LEU HB2 H 1 1.528 0.00 . . . . . . A 389 LEU HB2 . 30410 1 450 . 1 . 1 46 46 LEU HB3 H 1 1.885 0.00 . . . . . . A 389 LEU HB3 . 30410 1 451 . 1 . 1 46 46 LEU HG H 1 1.569 0.00 . . . . . . A 389 LEU HG . 30410 1 452 . 1 . 1 46 46 LEU HD11 H 1 0.836 0.00 . . . . . . A 389 LEU HD11 . 30410 1 453 . 1 . 1 46 46 LEU HD12 H 1 0.836 0.00 . . . . . . A 389 LEU HD12 . 30410 1 454 . 1 . 1 46 46 LEU HD13 H 1 0.836 0.00 . . . . . . A 389 LEU HD13 . 30410 1 455 . 1 . 1 46 46 LEU HD21 H 1 0.924 0.00 . . . . . . A 389 LEU HD21 . 30410 1 456 . 1 . 1 46 46 LEU HD22 H 1 0.924 0.00 . . . . . . A 389 LEU HD22 . 30410 1 457 . 1 . 1 46 46 LEU HD23 H 1 0.924 0.00 . . . . . . A 389 LEU HD23 . 30410 1 458 . 1 . 1 46 46 LEU CA C 13 59.509 0.00 . . . . . . A 389 LEU CA . 30410 1 459 . 1 . 1 46 46 LEU CB C 13 41.660 0.00 . . . . . . A 389 LEU CB . 30410 1 460 . 1 . 1 46 46 LEU CG C 13 27.002 0.00 . . . . . . A 389 LEU CG . 30410 1 461 . 1 . 1 46 46 LEU CD1 C 13 23.577 0.00 . . . . . . A 389 LEU CD1 . 30410 1 462 . 1 . 1 46 46 LEU CD2 C 13 26.008 0.00 . . . . . . A 389 LEU CD2 . 30410 1 463 . 1 . 1 46 46 LEU N N 15 122.148 0.00 . . . . . . A 389 LEU N . 30410 1 464 . 1 . 1 47 47 ALA H H 1 8.909 0.00 . . . . . . A 390 ALA H . 30410 1 465 . 1 . 1 47 47 ALA HA H 1 4.323 0.00 . . . . . . A 390 ALA HA . 30410 1 466 . 1 . 1 47 47 ALA HB1 H 1 1.454 0.00 . . . . . . A 390 ALA HB1 . 30410 1 467 . 1 . 1 47 47 ALA HB2 H 1 1.454 0.00 . . . . . . A 390 ALA HB2 . 30410 1 468 . 1 . 1 47 47 ALA HB3 H 1 1.454 0.00 . . . . . . A 390 ALA HB3 . 30410 1 469 . 1 . 1 47 47 ALA CA C 13 55.391 0.00 . . . . . . A 390 ALA CA . 30410 1 470 . 1 . 1 47 47 ALA CB C 13 17.965 0.00 . . . . . . A 390 ALA CB . 30410 1 471 . 1 . 1 47 47 ALA N N 15 118.160 0.00 . . . . . . A 390 ALA N . 30410 1 472 . 1 . 1 48 48 SER H H 1 7.232 0.00 . . . . . . A 391 SER H . 30410 1 473 . 1 . 1 48 48 SER HA H 1 4.353 0.00 . . . . . . A 391 SER HA . 30410 1 474 . 1 . 1 48 48 SER HB2 H 1 3.929 0.00 . . . . . . A 391 SER HB2 . 30410 1 475 . 1 . 1 48 48 SER HB3 H 1 4.000 0.00 . . . . . . A 391 SER HB3 . 30410 1 476 . 1 . 1 48 48 SER CA C 13 61.664 0.00 . . . . . . A 391 SER CA . 30410 1 477 . 1 . 1 48 48 SER CB C 13 63.162 0.00 . . . . . . A 391 SER CB . 30410 1 478 . 1 . 1 48 48 SER N N 15 113.626 0.00 . . . . . . A 391 SER N . 30410 1 479 . 1 . 1 49 49 LEU H H 1 8.238 0.00 . . . . . . A 392 LEU H . 30410 1 480 . 1 . 1 49 49 LEU HA H 1 3.922 0.00 . . . . . . A 392 LEU HA . 30410 1 481 . 1 . 1 49 49 LEU HB2 H 1 1.468 0.00 . . . . . . A 392 LEU HB2 . 30410 1 482 . 1 . 1 49 49 LEU HB3 H 1 1.894 0.00 . . . . . . A 392 LEU HB3 . 30410 1 483 . 1 . 1 49 49 LEU HD11 H 1 0.790 0.00 . . . . . . A 392 LEU HD11 . 30410 1 484 . 1 . 1 49 49 LEU HD12 H 1 0.790 0.00 . . . . . . A 392 LEU HD12 . 30410 1 485 . 1 . 1 49 49 LEU HD13 H 1 0.790 0.00 . . . . . . A 392 LEU HD13 . 30410 1 486 . 1 . 1 49 49 LEU HD21 H 1 0.883 0.00 . . . . . . A 392 LEU HD21 . 30410 1 487 . 1 . 1 49 49 LEU HD22 H 1 0.883 0.00 . . . . . . A 392 LEU HD22 . 30410 1 488 . 1 . 1 49 49 LEU HD23 H 1 0.883 0.00 . . . . . . A 392 LEU HD23 . 30410 1 489 . 1 . 1 49 49 LEU CA C 13 58.504 0.00 . . . . . . A 392 LEU CA . 30410 1 490 . 1 . 1 49 49 LEU CB C 13 42.687 0.00 . . . . . . A 392 LEU CB . 30410 1 491 . 1 . 1 49 49 LEU CD1 C 13 25.715 0.00 . . . . . . A 392 LEU CD1 . 30410 1 492 . 1 . 1 49 49 LEU CD2 C 13 26.604 0.00 . . . . . . A 392 LEU CD2 . 30410 1 493 . 1 . 1 49 49 LEU N N 15 124.634 0.00 . . . . . . A 392 LEU N . 30410 1 494 . 1 . 1 50 50 GLN H H 1 8.751 0.00 . . . . . . A 393 GLN H . 30410 1 495 . 1 . 1 50 50 GLN HA H 1 4.136 0.00 . . . . . . A 393 GLN HA . 30410 1 496 . 1 . 1 50 50 GLN HB2 H 1 1.972 0.00 . . . . . . A 393 GLN HB2 . 30410 1 497 . 1 . 1 50 50 GLN HB3 H 1 2.251 0.00 . . . . . . A 393 GLN HB3 . 30410 1 498 . 1 . 1 50 50 GLN HG2 H 1 2.473 0.00 . . . . . . A 393 GLN HG2 . 30410 1 499 . 1 . 1 50 50 GLN HG3 H 1 2.473 0.00 . . . . . . A 393 GLN HG3 . 30410 1 500 . 1 . 1 50 50 GLN CA C 13 59.429 0.00 . . . . . . A 393 GLN CA . 30410 1 501 . 1 . 1 50 50 GLN CB C 13 28.417 0.00 . . . . . . A 393 GLN CB . 30410 1 502 . 1 . 1 50 50 GLN CG C 13 34.453 0.00 . . . . . . A 393 GLN CG . 30410 1 503 . 1 . 1 50 50 GLN N N 15 117.336 0.00 . . . . . . A 393 GLN N . 30410 1 504 . 1 . 1 51 51 CYS H H 1 7.757 0.00 . . . . . . A 394 CYS H . 30410 1 505 . 1 . 1 51 51 CYS HA H 1 4.170 0.00 . . . . . . A 394 CYS HA . 30410 1 506 . 1 . 1 51 51 CYS HB2 H 1 2.984 0.00 . . . . . . A 394 CYS HB2 . 30410 1 507 . 1 . 1 51 51 CYS HB3 H 1 3.062 0.00 . . . . . . A 394 CYS HB3 . 30410 1 508 . 1 . 1 51 51 CYS CA C 13 62.527 0.00 . . . . . . A 394 CYS CA . 30410 1 509 . 1 . 1 51 51 CYS CB C 13 26.610 0.00 . . . . . . A 394 CYS CB . 30410 1 510 . 1 . 1 51 51 CYS N N 15 117.872 0.00 . . . . . . A 394 CYS N . 30410 1 511 . 1 . 1 52 52 LEU H H 1 7.856 0.00 . . . . . . A 395 LEU H . 30410 1 512 . 1 . 1 52 52 LEU HA H 1 4.167 0.00 . . . . . . A 395 LEU HA . 30410 1 513 . 1 . 1 52 52 LEU HB2 H 1 1.639 0.00 . . . . . . A 395 LEU HB2 . 30410 1 514 . 1 . 1 52 52 LEU HB3 H 1 1.813 0.00 . . . . . . A 395 LEU HB3 . 30410 1 515 . 1 . 1 52 52 LEU HG H 1 1.518 0.00 . . . . . . A 395 LEU HG . 30410 1 516 . 1 . 1 52 52 LEU HD11 H 1 0.802 0.00 . . . . . . A 395 LEU HD11 . 30410 1 517 . 1 . 1 52 52 LEU HD12 H 1 0.802 0.00 . . . . . . A 395 LEU HD12 . 30410 1 518 . 1 . 1 52 52 LEU HD13 H 1 0.802 0.00 . . . . . . A 395 LEU HD13 . 30410 1 519 . 1 . 1 52 52 LEU HD21 H 1 0.792 0.00 . . . . . . A 395 LEU HD21 . 30410 1 520 . 1 . 1 52 52 LEU HD22 H 1 0.792 0.00 . . . . . . A 395 LEU HD22 . 30410 1 521 . 1 . 1 52 52 LEU HD23 H 1 0.792 0.00 . . . . . . A 395 LEU HD23 . 30410 1 522 . 1 . 1 52 52 LEU CA C 13 57.941 0.00 . . . . . . A 395 LEU CA . 30410 1 523 . 1 . 1 52 52 LEU CB C 13 41.883 0.00 . . . . . . A 395 LEU CB . 30410 1 524 . 1 . 1 52 52 LEU CG C 13 26.683 0.00 . . . . . . A 395 LEU CG . 30410 1 525 . 1 . 1 52 52 LEU CD1 C 13 22.652 0.00 . . . . . . A 395 LEU CD1 . 30410 1 526 . 1 . 1 52 52 LEU CD2 C 13 26.608 0.00 . . . . . . A 395 LEU CD2 . 30410 1 527 . 1 . 1 52 52 LEU N N 15 122.197 0.00 . . . . . . A 395 LEU N . 30410 1 528 . 1 . 1 53 53 ASN H H 1 8.728 0.00 . . . . . . A 396 ASN H . 30410 1 529 . 1 . 1 53 53 ASN HA H 1 4.554 0.00 . . . . . . A 396 ASN HA . 30410 1 530 . 1 . 1 53 53 ASN HB2 H 1 2.461 0.00 . . . . . . A 396 ASN HB2 . 30410 1 531 . 1 . 1 53 53 ASN HB3 H 1 2.988 0.00 . . . . . . A 396 ASN HB3 . 30410 1 532 . 1 . 1 53 53 ASN CA C 13 56.089 0.00 . . . . . . A 396 ASN CA . 30410 1 533 . 1 . 1 53 53 ASN CB C 13 38.111 0.00 . . . . . . A 396 ASN CB . 30410 1 534 . 1 . 1 53 53 ASN N N 15 117.012 0.00 . . . . . . A 396 ASN N . 30410 1 535 . 1 . 1 54 54 GLU H H 1 8.193 0.00 . . . . . . A 397 GLU H . 30410 1 536 . 1 . 1 54 54 GLU HA H 1 4.072 0.00 . . . . . . A 397 GLU HA . 30410 1 537 . 1 . 1 54 54 GLU HB2 H 1 2.171 0.00 . . . . . . A 397 GLU HB2 . 30410 1 538 . 1 . 1 54 54 GLU HB3 H 1 2.171 0.00 . . . . . . A 397 GLU HB3 . 30410 1 539 . 1 . 1 54 54 GLU HG2 H 1 2.349 0.00 . . . . . . A 397 GLU HG2 . 30410 1 540 . 1 . 1 54 54 GLU HG3 H 1 2.349 0.00 . . . . . . A 397 GLU HG3 . 30410 1 541 . 1 . 1 54 54 GLU CA C 13 59.552 0.00 . . . . . . A 397 GLU CA . 30410 1 542 . 1 . 1 54 54 GLU CB C 13 29.045 0.00 . . . . . . A 397 GLU CB . 30410 1 543 . 1 . 1 54 54 GLU CG C 13 36.216 0.00 . . . . . . A 397 GLU CG . 30410 1 544 . 1 . 1 54 54 GLU N N 15 121.478 0.00 . . . . . . A 397 GLU N . 30410 1 545 . 1 . 1 55 55 THR H H 1 8.032 0.00 . . . . . . A 398 THR H . 30410 1 546 . 1 . 1 55 55 THR HA H 1 3.934 0.00 . . . . . . A 398 THR HA . 30410 1 547 . 1 . 1 55 55 THR HB H 1 4.408 0.00 . . . . . . A 398 THR HB . 30410 1 548 . 1 . 1 55 55 THR HG21 H 1 1.076 0.00 . . . . . . A 398 THR HG21 . 30410 1 549 . 1 . 1 55 55 THR HG22 H 1 1.076 0.00 . . . . . . A 398 THR HG22 . 30410 1 550 . 1 . 1 55 55 THR HG23 H 1 1.076 0.00 . . . . . . A 398 THR HG23 . 30410 1 551 . 1 . 1 55 55 THR CA C 13 66.909 0.00 . . . . . . A 398 THR CA . 30410 1 552 . 1 . 1 55 55 THR CB C 13 68.649 0.00 . . . . . . A 398 THR CB . 30410 1 553 . 1 . 1 55 55 THR CG2 C 13 21.231 0.00 . . . . . . A 398 THR CG2 . 30410 1 554 . 1 . 1 55 55 THR N N 15 119.086 0.00 . . . . . . A 398 THR N . 30410 1 555 . 1 . 1 56 56 LEU H H 1 8.314 0.00 . . . . . . A 399 LEU H . 30410 1 556 . 1 . 1 56 56 LEU HA H 1 4.599 0.00 . . . . . . A 399 LEU HA . 30410 1 557 . 1 . 1 56 56 LEU HB2 H 1 1.708 0.00 . . . . . . A 399 LEU HB2 . 30410 1 558 . 1 . 1 56 56 LEU HB3 H 1 2.114 0.00 . . . . . . A 399 LEU HB3 . 30410 1 559 . 1 . 1 56 56 LEU HG H 1 1.973 0.00 . . . . . . A 399 LEU HG . 30410 1 560 . 1 . 1 56 56 LEU HD11 H 1 0.800 0.00 . . . . . . A 399 LEU HD11 . 30410 1 561 . 1 . 1 56 56 LEU HD12 H 1 0.800 0.00 . . . . . . A 399 LEU HD12 . 30410 1 562 . 1 . 1 56 56 LEU HD13 H 1 0.800 0.00 . . . . . . A 399 LEU HD13 . 30410 1 563 . 1 . 1 56 56 LEU HD21 H 1 0.886 0.00 . . . . . . A 399 LEU HD21 . 30410 1 564 . 1 . 1 56 56 LEU HD22 H 1 0.886 0.00 . . . . . . A 399 LEU HD22 . 30410 1 565 . 1 . 1 56 56 LEU HD23 H 1 0.886 0.00 . . . . . . A 399 LEU HD23 . 30410 1 566 . 1 . 1 56 56 LEU CA C 13 57.241 0.00 . . . . . . A 399 LEU CA . 30410 1 567 . 1 . 1 56 56 LEU CB C 13 42.065 0.00 . . . . . . A 399 LEU CB . 30410 1 568 . 1 . 1 56 56 LEU CG C 13 27.221 0.00 . . . . . . A 399 LEU CG . 30410 1 569 . 1 . 1 56 56 LEU CD1 C 13 23.534 0.00 . . . . . . A 399 LEU CD1 . 30410 1 570 . 1 . 1 56 56 LEU CD2 C 13 26.737 0.00 . . . . . . A 399 LEU CD2 . 30410 1 571 . 1 . 1 56 56 LEU N N 15 118.024 0.00 . . . . . . A 399 LEU N . 30410 1 572 . 1 . 1 57 57 THR H H 1 7.717 0.00 . . . . . . A 400 THR H . 30410 1 573 . 1 . 1 57 57 THR HA H 1 4.379 0.00 . . . . . . A 400 THR HA . 30410 1 574 . 1 . 1 57 57 THR HB H 1 4.416 0.00 . . . . . . A 400 THR HB . 30410 1 575 . 1 . 1 57 57 THR HG21 H 1 1.325 0.00 . . . . . . A 400 THR HG21 . 30410 1 576 . 1 . 1 57 57 THR HG22 H 1 1.325 0.00 . . . . . . A 400 THR HG22 . 30410 1 577 . 1 . 1 57 57 THR HG23 H 1 1.325 0.00 . . . . . . A 400 THR HG23 . 30410 1 578 . 1 . 1 57 57 THR CA C 13 64.340 0.00 . . . . . . A 400 THR CA . 30410 1 579 . 1 . 1 57 57 THR CB C 13 69.769 0.00 . . . . . . A 400 THR CB . 30410 1 580 . 1 . 1 57 57 THR CG2 C 13 21.607 0.00 . . . . . . A 400 THR CG2 . 30410 1 581 . 1 . 1 57 57 THR N N 15 110.348 0.00 . . . . . . A 400 THR N . 30410 1 582 . 1 . 1 58 58 SER H H 1 7.733 0.00 . . . . . . A 401 SER H . 30410 1 583 . 1 . 1 58 58 SER HA H 1 4.886 0.00 . . . . . . A 401 SER HA . 30410 1 584 . 1 . 1 58 58 SER HB2 H 1 3.936 0.00 . . . . . . A 401 SER HB2 . 30410 1 585 . 1 . 1 58 58 SER HB3 H 1 4.017 0.00 . . . . . . A 401 SER HB3 . 30410 1 586 . 1 . 1 58 58 SER CA C 13 58.067 0.00 . . . . . . A 401 SER CA . 30410 1 587 . 1 . 1 58 58 SER CB C 13 64.593 0.00 . . . . . . A 401 SER CB . 30410 1 588 . 1 . 1 58 58 SER N N 15 114.044 0.00 . . . . . . A 401 SER N . 30410 1 589 . 1 . 1 59 59 CYS H H 1 7.735 0.00 . . . . . . A 402 CYS H . 30410 1 590 . 1 . 1 59 59 CYS HA H 1 5.086 0.00 . . . . . . A 402 CYS HA . 30410 1 591 . 1 . 1 59 59 CYS HB2 H 1 3.095 0.00 . . . . . . A 402 CYS HB2 . 30410 1 592 . 1 . 1 59 59 CYS HB3 H 1 3.095 0.00 . . . . . . A 402 CYS HB3 . 30410 1 593 . 1 . 1 59 59 CYS CA C 13 56.744 0.00 . . . . . . A 402 CYS CA . 30410 1 594 . 1 . 1 59 59 CYS CB C 13 31.094 0.00 . . . . . . A 402 CYS CB . 30410 1 595 . 1 . 1 59 59 CYS N N 15 118.372 0.00 . . . . . . A 402 CYS N . 30410 1 596 . 1 . 1 60 60 THR H H 1 7.528 0.00 . . . . . . A 403 THR H . 30410 1 597 . 1 . 1 60 60 THR HA H 1 4.626 0.00 . . . . . . A 403 THR HA . 30410 1 598 . 1 . 1 60 60 THR HB H 1 4.719 0.00 . . . . . . A 403 THR HB . 30410 1 599 . 1 . 1 60 60 THR HG21 H 1 1.401 0.00 . . . . . . A 403 THR HG21 . 30410 1 600 . 1 . 1 60 60 THR HG22 H 1 1.401 0.00 . . . . . . A 403 THR HG22 . 30410 1 601 . 1 . 1 60 60 THR HG23 H 1 1.401 0.00 . . . . . . A 403 THR HG23 . 30410 1 602 . 1 . 1 60 60 THR CA C 13 60.732 0.00 . . . . . . A 403 THR CA . 30410 1 603 . 1 . 1 60 60 THR CB C 13 71.190 0.00 . . . . . . A 403 THR CB . 30410 1 604 . 1 . 1 60 60 THR CG2 C 13 22.424 0.00 . . . . . . A 403 THR CG2 . 30410 1 605 . 1 . 1 60 60 THR N N 15 108.252 0.00 . . . . . . A 403 THR N . 30410 1 606 . 1 . 1 61 61 LYS H H 1 9.004 0.00 . . . . . . A 404 LYS H . 30410 1 607 . 1 . 1 61 61 LYS HA H 1 2.990 0.00 . . . . . . A 404 LYS HA . 30410 1 608 . 1 . 1 61 61 LYS HB2 H 1 1.706 0.00 . . . . . . A 404 LYS HB2 . 30410 1 609 . 1 . 1 61 61 LYS HB3 H 1 1.895 0.00 . . . . . . A 404 LYS HB3 . 30410 1 610 . 1 . 1 61 61 LYS HG2 H 1 1.323 0.00 . . . . . . A 404 LYS HG2 . 30410 1 611 . 1 . 1 61 61 LYS HG3 H 1 1.323 0.00 . . . . . . A 404 LYS HG3 . 30410 1 612 . 1 . 1 61 61 LYS CA C 13 60.341 0.00 . . . . . . A 404 LYS CA . 30410 1 613 . 1 . 1 61 61 LYS CB C 13 32.703 0.00 . . . . . . A 404 LYS CB . 30410 1 614 . 1 . 1 61 61 LYS CG C 13 24.878 0.00 . . . . . . A 404 LYS CG . 30410 1 615 . 1 . 1 61 61 LYS CD C 13 30.051 0.00 . . . . . . A 404 LYS CD . 30410 1 616 . 1 . 1 61 61 LYS CE C 13 42.135 0.00 . . . . . . A 404 LYS CE . 30410 1 617 . 1 . 1 61 61 LYS N N 15 123.125 0.00 . . . . . . A 404 LYS N . 30410 1 618 . 1 . 1 62 62 GLU H H 1 8.825 0.00 . . . . . . A 405 GLU H . 30410 1 619 . 1 . 1 62 62 GLU HA H 1 3.827 0.00 . . . . . . A 405 GLU HA . 30410 1 620 . 1 . 1 62 62 GLU HB2 H 1 1.908 0.00 . . . . . . A 405 GLU HB2 . 30410 1 621 . 1 . 1 62 62 GLU HB3 H 1 1.995 0.00 . . . . . . A 405 GLU HB3 . 30410 1 622 . 1 . 1 62 62 GLU HG2 H 1 2.256 0.00 . . . . . . A 405 GLU HG2 . 30410 1 623 . 1 . 1 62 62 GLU HG3 H 1 2.439 0.00 . . . . . . A 405 GLU HG3 . 30410 1 624 . 1 . 1 62 62 GLU CA C 13 60.213 0.00 . . . . . . A 405 GLU CA . 30410 1 625 . 1 . 1 62 62 GLU CB C 13 28.697 0.00 . . . . . . A 405 GLU CB . 30410 1 626 . 1 . 1 62 62 GLU CG C 13 36.993 0.00 . . . . . . A 405 GLU CG . 30410 1 627 . 1 . 1 62 62 GLU N N 15 115.565 0.00 . . . . . . A 405 GLU N . 30410 1 628 . 1 . 1 63 63 VAL H H 1 7.153 0.00 . . . . . . A 406 VAL H . 30410 1 629 . 1 . 1 63 63 VAL HA H 1 3.599 0.00 . . . . . . A 406 VAL HA . 30410 1 630 . 1 . 1 63 63 VAL HB H 1 1.908 0.00 . . . . . . A 406 VAL HB . 30410 1 631 . 1 . 1 63 63 VAL HG11 H 1 0.932 0.00 . . . . . . A 406 VAL HG11 . 30410 1 632 . 1 . 1 63 63 VAL HG12 H 1 0.932 0.00 . . . . . . A 406 VAL HG12 . 30410 1 633 . 1 . 1 63 63 VAL HG13 H 1 0.932 0.00 . . . . . . A 406 VAL HG13 . 30410 1 634 . 1 . 1 63 63 VAL HG21 H 1 0.925 0.00 . . . . . . A 406 VAL HG21 . 30410 1 635 . 1 . 1 63 63 VAL HG22 H 1 0.925 0.00 . . . . . . A 406 VAL HG22 . 30410 1 636 . 1 . 1 63 63 VAL HG23 H 1 0.925 0.00 . . . . . . A 406 VAL HG23 . 30410 1 637 . 1 . 1 63 63 VAL CA C 13 65.863 0.00 . . . . . . A 406 VAL CA . 30410 1 638 . 1 . 1 63 63 VAL CB C 13 32.374 0.00 . . . . . . A 406 VAL CB . 30410 1 639 . 1 . 1 63 63 VAL CG1 C 13 21.992 0.00 . . . . . . A 406 VAL CG1 . 30410 1 640 . 1 . 1 63 63 VAL CG2 C 13 21.991 0.00 . . . . . . A 406 VAL CG2 . 30410 1 641 . 1 . 1 63 63 VAL N N 15 121.808 0.00 . . . . . . A 406 VAL N . 30410 1 642 . 1 . 1 64 64 GLY H H 1 8.317 0.00 . . . . . . A 407 GLY H . 30410 1 643 . 1 . 1 64 64 GLY HA2 H 1 3.263 0.00 . . . . . . A 407 GLY HA2 . 30410 1 644 . 1 . 1 64 64 GLY HA3 H 1 3.263 0.00 . . . . . . A 407 GLY HA3 . 30410 1 645 . 1 . 1 64 64 GLY CA C 13 48.398 0.00 . . . . . . A 407 GLY CA . 30410 1 646 . 1 . 1 64 64 GLY N N 15 109.820 0.00 . . . . . . A 407 GLY N . 30410 1 647 . 1 . 1 65 65 LYS H H 1 7.801 0.00 . . . . . . A 408 LYS H . 30410 1 648 . 1 . 1 65 65 LYS HA H 1 2.695 0.00 . . . . . . A 408 LYS HA . 30410 1 649 . 1 . 1 65 65 LYS HB2 H 1 1.392 0.00 . . . . . . A 408 LYS HB2 . 30410 1 650 . 1 . 1 65 65 LYS HB3 H 1 1.562 0.00 . . . . . . A 408 LYS HB3 . 30410 1 651 . 1 . 1 65 65 LYS HG2 H 1 0.849 0.00 . . . . . . A 408 LYS HG2 . 30410 1 652 . 1 . 1 65 65 LYS HG3 H 1 1.206 0.00 . . . . . . A 408 LYS HG3 . 30410 1 653 . 1 . 1 65 65 LYS HD2 H 1 1.626 0.00 . . . . . . A 408 LYS HD2 . 30410 1 654 . 1 . 1 65 65 LYS HD3 H 1 1.626 0.00 . . . . . . A 408 LYS HD3 . 30410 1 655 . 1 . 1 65 65 LYS HE2 H 1 2.962 0.00 . . . . . . A 408 LYS HE2 . 30410 1 656 . 1 . 1 65 65 LYS HE3 H 1 2.962 0.00 . . . . . . A 408 LYS HE3 . 30410 1 657 . 1 . 1 65 65 LYS CA C 13 59.718 0.00 . . . . . . A 408 LYS CA . 30410 1 658 . 1 . 1 65 65 LYS CB C 13 33.172 0.00 . . . . . . A 408 LYS CB . 30410 1 659 . 1 . 1 65 65 LYS CG C 13 25.122 0.00 . . . . . . A 408 LYS CG . 30410 1 660 . 1 . 1 65 65 LYS CD C 13 30.045 0.00 . . . . . . A 408 LYS CD . 30410 1 661 . 1 . 1 65 65 LYS CE C 13 42.369 0.00 . . . . . . A 408 LYS CE . 30410 1 662 . 1 . 1 65 65 LYS N N 15 121.367 0.00 . . . . . . A 408 LYS N . 30410 1 663 . 1 . 1 66 66 ALA H H 1 7.151 0.00 . . . . . . A 409 ALA H . 30410 1 664 . 1 . 1 66 66 ALA HA H 1 4.090 0.00 . . . . . . A 409 ALA HA . 30410 1 665 . 1 . 1 66 66 ALA HB1 H 1 1.376 0.00 . . . . . . A 409 ALA HB1 . 30410 1 666 . 1 . 1 66 66 ALA HB2 H 1 1.376 0.00 . . . . . . A 409 ALA HB2 . 30410 1 667 . 1 . 1 66 66 ALA HB3 H 1 1.376 0.00 . . . . . . A 409 ALA HB3 . 30410 1 668 . 1 . 1 66 66 ALA CA C 13 54.630 0.00 . . . . . . A 409 ALA CA . 30410 1 669 . 1 . 1 66 66 ALA CB C 13 17.877 0.00 . . . . . . A 409 ALA CB . 30410 1 670 . 1 . 1 66 66 ALA N N 15 118.071 0.00 . . . . . . A 409 ALA N . 30410 1 671 . 1 . 1 67 67 ALA H H 1 7.909 0.00 . . . . . . A 410 ALA H . 30410 1 672 . 1 . 1 67 67 ALA HA H 1 4.064 0.00 . . . . . . A 410 ALA HA . 30410 1 673 . 1 . 1 67 67 ALA HB1 H 1 1.380 0.00 . . . . . . A 410 ALA HB1 . 30410 1 674 . 1 . 1 67 67 ALA HB2 H 1 1.380 0.00 . . . . . . A 410 ALA HB2 . 30410 1 675 . 1 . 1 67 67 ALA HB3 H 1 1.380 0.00 . . . . . . A 410 ALA HB3 . 30410 1 676 . 1 . 1 67 67 ALA CA C 13 54.821 0.00 . . . . . . A 410 ALA CA . 30410 1 677 . 1 . 1 67 67 ALA CB C 13 17.652 0.00 . . . . . . A 410 ALA CB . 30410 1 678 . 1 . 1 67 67 ALA N N 15 121.636 0.00 . . . . . . A 410 ALA N . 30410 1 679 . 1 . 1 68 68 LEU H H 1 8.028 0.00 . . . . . . A 411 LEU H . 30410 1 680 . 1 . 1 68 68 LEU HA H 1 3.843 0.00 . . . . . . A 411 LEU HA . 30410 1 681 . 1 . 1 68 68 LEU HB2 H 1 1.513 0.00 . . . . . . A 411 LEU HB2 . 30410 1 682 . 1 . 1 68 68 LEU HB3 H 1 1.513 0.00 . . . . . . A 411 LEU HB3 . 30410 1 683 . 1 . 1 68 68 LEU HG H 1 1.555 0.00 . . . . . . A 411 LEU HG . 30410 1 684 . 1 . 1 68 68 LEU HD11 H 1 0.832 0.00 . . . . . . A 411 LEU HD11 . 30410 1 685 . 1 . 1 68 68 LEU HD12 H 1 0.832 0.00 . . . . . . A 411 LEU HD12 . 30410 1 686 . 1 . 1 68 68 LEU HD13 H 1 0.832 0.00 . . . . . . A 411 LEU HD13 . 30410 1 687 . 1 . 1 68 68 LEU CA C 13 58.248 0.00 . . . . . . A 411 LEU CA . 30410 1 688 . 1 . 1 68 68 LEU CB C 13 42.237 0.00 . . . . . . A 411 LEU CB . 30410 1 689 . 1 . 1 68 68 LEU CG C 13 27.242 0.00 . . . . . . A 411 LEU CG . 30410 1 690 . 1 . 1 68 68 LEU CD1 C 13 25.788 0.00 . . . . . . A 411 LEU CD1 . 30410 1 691 . 1 . 1 68 68 LEU N N 15 120.071 0.00 . . . . . . A 411 LEU N . 30410 1 692 . 1 . 1 69 69 GLU H H 1 8.613 0.00 . . . . . . A 412 GLU H . 30410 1 693 . 1 . 1 69 69 GLU HA H 1 3.811 0.00 . . . . . . A 412 GLU HA . 30410 1 694 . 1 . 1 69 69 GLU HB2 H 1 1.928 0.00 . . . . . . A 412 GLU HB2 . 30410 1 695 . 1 . 1 69 69 GLU HB3 H 1 2.087 0.00 . . . . . . A 412 GLU HB3 . 30410 1 696 . 1 . 1 69 69 GLU HG2 H 1 2.101 0.00 . . . . . . A 412 GLU HG2 . 30410 1 697 . 1 . 1 69 69 GLU HG3 H 1 2.448 0.00 . . . . . . A 412 GLU HG3 . 30410 1 698 . 1 . 1 69 69 GLU CA C 13 60.181 0.00 . . . . . . A 412 GLU CA . 30410 1 699 . 1 . 1 69 69 GLU CB C 13 29.362 0.00 . . . . . . A 412 GLU CB . 30410 1 700 . 1 . 1 69 69 GLU CG C 13 37.423 0.00 . . . . . . A 412 GLU CG . 30410 1 701 . 1 . 1 69 69 GLU N N 15 117.376 0.00 . . . . . . A 412 GLU N . 30410 1 702 . 1 . 1 70 70 LYS H H 1 7.960 0.00 . . . . . . A 413 LYS H . 30410 1 703 . 1 . 1 70 70 LYS HA H 1 4.144 0.00 . . . . . . A 413 LYS HA . 30410 1 704 . 1 . 1 70 70 LYS HB2 H 1 1.919 0.00 . . . . . . A 413 LYS HB2 . 30410 1 705 . 1 . 1 70 70 LYS HB3 H 1 1.919 0.00 . . . . . . A 413 LYS HB3 . 30410 1 706 . 1 . 1 70 70 LYS HG2 H 1 1.457 0.00 . . . . . . A 413 LYS HG2 . 30410 1 707 . 1 . 1 70 70 LYS HG3 H 1 1.457 0.00 . . . . . . A 413 LYS HG3 . 30410 1 708 . 1 . 1 70 70 LYS HD2 H 1 1.692 0.00 . . . . . . A 413 LYS HD2 . 30410 1 709 . 1 . 1 70 70 LYS HD3 H 1 1.692 0.00 . . . . . . A 413 LYS HD3 . 30410 1 710 . 1 . 1 70 70 LYS HE2 H 1 2.957 0.00 . . . . . . A 413 LYS HE2 . 30410 1 711 . 1 . 1 70 70 LYS HE3 H 1 2.957 0.00 . . . . . . A 413 LYS HE3 . 30410 1 712 . 1 . 1 70 70 LYS CA C 13 59.024 0.00 . . . . . . A 413 LYS CA . 30410 1 713 . 1 . 1 70 70 LYS CB C 13 32.153 0.00 . . . . . . A 413 LYS CB . 30410 1 714 . 1 . 1 70 70 LYS CG C 13 24.602 0.00 . . . . . . A 413 LYS CG . 30410 1 715 . 1 . 1 70 70 LYS CD C 13 28.953 0.00 . . . . . . A 413 LYS CD . 30410 1 716 . 1 . 1 70 70 LYS CE C 13 42.240 0.00 . . . . . . A 413 LYS CE . 30410 1 717 . 1 . 1 70 70 LYS N N 15 119.670 0.00 . . . . . . A 413 LYS N . 30410 1 718 . 1 . 1 71 71 GLN H H 1 7.377 0.00 . . . . . . A 414 GLN H . 30410 1 719 . 1 . 1 71 71 GLN HA H 1 4.174 0.00 . . . . . . A 414 GLN HA . 30410 1 720 . 1 . 1 71 71 GLN HB2 H 1 2.123 0.00 . . . . . . A 414 GLN HB2 . 30410 1 721 . 1 . 1 71 71 GLN HB3 H 1 2.248 0.00 . . . . . . A 414 GLN HB3 . 30410 1 722 . 1 . 1 71 71 GLN HG2 H 1 2.507 0.00 . . . . . . A 414 GLN HG2 . 30410 1 723 . 1 . 1 71 71 GLN HG3 H 1 2.507 0.00 . . . . . . A 414 GLN HG3 . 30410 1 724 . 1 . 1 71 71 GLN CA C 13 57.862 0.00 . . . . . . A 414 GLN CA . 30410 1 725 . 1 . 1 71 71 GLN CB C 13 28.370 0.00 . . . . . . A 414 GLN CB . 30410 1 726 . 1 . 1 71 71 GLN CG C 13 34.442 0.00 . . . . . . A 414 GLN CG . 30410 1 727 . 1 . 1 71 71 GLN N N 15 116.973 0.00 . . . . . . A 414 GLN N . 30410 1 728 . 1 . 1 72 72 ILE H H 1 8.608 0.00 . . . . . . A 415 ILE H . 30410 1 729 . 1 . 1 72 72 ILE HA H 1 3.547 0.00 . . . . . . A 415 ILE HA . 30410 1 730 . 1 . 1 72 72 ILE HB H 1 1.869 0.00 . . . . . . A 415 ILE HB . 30410 1 731 . 1 . 1 72 72 ILE HG21 H 1 0.877 0.00 . . . . . . A 415 ILE HG21 . 30410 1 732 . 1 . 1 72 72 ILE HG22 H 1 0.877 0.00 . . . . . . A 415 ILE HG22 . 30410 1 733 . 1 . 1 72 72 ILE HG23 H 1 0.877 0.00 . . . . . . A 415 ILE HG23 . 30410 1 734 . 1 . 1 72 72 ILE HD11 H 1 0.795 0.00 . . . . . . A 415 ILE HD11 . 30410 1 735 . 1 . 1 72 72 ILE HD12 H 1 0.795 0.00 . . . . . . A 415 ILE HD12 . 30410 1 736 . 1 . 1 72 72 ILE HD13 H 1 0.795 0.00 . . . . . . A 415 ILE HD13 . 30410 1 737 . 1 . 1 72 72 ILE CA C 13 65.896 0.00 . . . . . . A 415 ILE CA . 30410 1 738 . 1 . 1 72 72 ILE CB C 13 38.604 0.00 . . . . . . A 415 ILE CB . 30410 1 739 . 1 . 1 72 72 ILE CG1 C 13 30.310 0.00 . . . . . . A 415 ILE CG1 . 30410 1 740 . 1 . 1 72 72 ILE CG2 C 13 17.321 0.00 . . . . . . A 415 ILE CG2 . 30410 1 741 . 1 . 1 72 72 ILE CD1 C 13 14.723 0.00 . . . . . . A 415 ILE CD1 . 30410 1 742 . 1 . 1 72 72 ILE N N 15 121.347 0.00 . . . . . . A 415 ILE N . 30410 1 743 . 1 . 1 73 73 GLU H H 1 8.162 0.00 . . . . . . A 416 GLU H . 30410 1 744 . 1 . 1 73 73 GLU HA H 1 4.096 0.00 . . . . . . A 416 GLU HA . 30410 1 745 . 1 . 1 73 73 GLU HB2 H 1 2.172 0.00 . . . . . . A 416 GLU HB2 . 30410 1 746 . 1 . 1 73 73 GLU HB3 H 1 2.172 0.00 . . . . . . A 416 GLU HB3 . 30410 1 747 . 1 . 1 73 73 GLU HG2 H 1 2.268 0.00 . . . . . . A 416 GLU HG2 . 30410 1 748 . 1 . 1 73 73 GLU HG3 H 1 2.388 0.00 . . . . . . A 416 GLU HG3 . 30410 1 749 . 1 . 1 73 73 GLU CA C 13 59.729 0.00 . . . . . . A 416 GLU CA . 30410 1 750 . 1 . 1 73 73 GLU CB C 13 29.374 0.00 . . . . . . A 416 GLU CB . 30410 1 751 . 1 . 1 73 73 GLU CG C 13 36.210 0.00 . . . . . . A 416 GLU CG . 30410 1 752 . 1 . 1 73 73 GLU N N 15 120.142 0.00 . . . . . . A 416 GLU N . 30410 1 753 . 1 . 1 74 74 GLU H H 1 7.870 0.00 . . . . . . A 417 GLU H . 30410 1 754 . 1 . 1 74 74 GLU HA H 1 4.058 0.00 . . . . . . A 417 GLU HA . 30410 1 755 . 1 . 1 74 74 GLU HB2 H 1 2.083 0.00 . . . . . . A 417 GLU HB2 . 30410 1 756 . 1 . 1 74 74 GLU HB3 H 1 2.177 0.00 . . . . . . A 417 GLU HB3 . 30410 1 757 . 1 . 1 74 74 GLU HG2 H 1 2.465 0.00 . . . . . . A 417 GLU HG2 . 30410 1 758 . 1 . 1 74 74 GLU HG3 H 1 2.465 0.00 . . . . . . A 417 GLU HG3 . 30410 1 759 . 1 . 1 74 74 GLU CA C 13 59.765 0.00 . . . . . . A 417 GLU CA . 30410 1 760 . 1 . 1 74 74 GLU CB C 13 29.599 0.00 . . . . . . A 417 GLU CB . 30410 1 761 . 1 . 1 74 74 GLU CG C 13 36.533 0.00 . . . . . . A 417 GLU CG . 30410 1 762 . 1 . 1 74 74 GLU N N 15 119.174 0.00 . . . . . . A 417 GLU N . 30410 1 763 . 1 . 1 75 75 ILE H H 1 8.398 0.00 . . . . . . A 418 ILE H . 30410 1 764 . 1 . 1 75 75 ILE HA H 1 4.026 0.00 . . . . . . A 418 ILE HA . 30410 1 765 . 1 . 1 75 75 ILE HB H 1 2.030 0.00 . . . . . . A 418 ILE HB . 30410 1 766 . 1 . 1 75 75 ILE HG12 H 1 1.356 0.00 . . . . . . A 418 ILE HG12 . 30410 1 767 . 1 . 1 75 75 ILE HG13 H 1 1.515 0.00 . . . . . . A 418 ILE HG13 . 30410 1 768 . 1 . 1 75 75 ILE HG21 H 1 0.907 0.00 . . . . . . A 418 ILE HG21 . 30410 1 769 . 1 . 1 75 75 ILE HG22 H 1 0.907 0.00 . . . . . . A 418 ILE HG22 . 30410 1 770 . 1 . 1 75 75 ILE HG23 H 1 0.907 0.00 . . . . . . A 418 ILE HG23 . 30410 1 771 . 1 . 1 75 75 ILE HD11 H 1 0.802 0.00 . . . . . . A 418 ILE HD11 . 30410 1 772 . 1 . 1 75 75 ILE HD12 H 1 0.802 0.00 . . . . . . A 418 ILE HD12 . 30410 1 773 . 1 . 1 75 75 ILE HD13 H 1 0.802 0.00 . . . . . . A 418 ILE HD13 . 30410 1 774 . 1 . 1 75 75 ILE CA C 13 62.437 0.00 . . . . . . A 418 ILE CA . 30410 1 775 . 1 . 1 75 75 ILE CB C 13 36.357 0.00 . . . . . . A 418 ILE CB . 30410 1 776 . 1 . 1 75 75 ILE CG1 C 13 29.535 0.00 . . . . . . A 418 ILE CG1 . 30410 1 777 . 1 . 1 75 75 ILE CG2 C 13 19.187 0.00 . . . . . . A 418 ILE CG2 . 30410 1 778 . 1 . 1 75 75 ILE CD1 C 13 12.213 0.00 . . . . . . A 418 ILE CD1 . 30410 1 779 . 1 . 1 75 75 ILE N N 15 120.960 0.00 . . . . . . A 418 ILE N . 30410 1 780 . 1 . 1 76 76 ASN H H 1 8.673 0.00 . . . . . . A 419 ASN H . 30410 1 781 . 1 . 1 76 76 ASN HA H 1 4.560 0.00 . . . . . . A 419 ASN HA . 30410 1 782 . 1 . 1 76 76 ASN HB2 H 1 2.662 0.00 . . . . . . A 419 ASN HB2 . 30410 1 783 . 1 . 1 76 76 ASN HB3 H 1 2.948 0.00 . . . . . . A 419 ASN HB3 . 30410 1 784 . 1 . 1 76 76 ASN CA C 13 56.350 0.00 . . . . . . A 419 ASN CA . 30410 1 785 . 1 . 1 76 76 ASN CB C 13 37.699 0.00 . . . . . . A 419 ASN CB . 30410 1 786 . 1 . 1 76 76 ASN N N 15 120.679 0.00 . . . . . . A 419 ASN N . 30410 1 787 . 1 . 1 77 77 GLU H H 1 8.018 0.00 . . . . . . A 420 GLU H . 30410 1 788 . 1 . 1 77 77 GLU HA H 1 4.333 0.00 . . . . . . A 420 GLU HA . 30410 1 789 . 1 . 1 77 77 GLU HB2 H 1 2.098 0.00 . . . . . . A 420 GLU HB2 . 30410 1 790 . 1 . 1 77 77 GLU HB3 H 1 2.192 0.00 . . . . . . A 420 GLU HB3 . 30410 1 791 . 1 . 1 77 77 GLU HG2 H 1 2.359 0.00 . . . . . . A 420 GLU HG2 . 30410 1 792 . 1 . 1 77 77 GLU HG3 H 1 2.359 0.00 . . . . . . A 420 GLU HG3 . 30410 1 793 . 1 . 1 77 77 GLU CA C 13 58.834 0.00 . . . . . . A 420 GLU CA . 30410 1 794 . 1 . 1 77 77 GLU CB C 13 28.991 0.00 . . . . . . A 420 GLU CB . 30410 1 795 . 1 . 1 77 77 GLU CG C 13 35.653 0.00 . . . . . . A 420 GLU CG . 30410 1 796 . 1 . 1 77 77 GLU N N 15 122.421 0.00 . . . . . . A 420 GLU N . 30410 1 797 . 1 . 1 78 78 GLN H H 1 7.783 0.00 . . . . . . A 421 GLN H . 30410 1 798 . 1 . 1 78 78 GLN HA H 1 4.035 0.00 . . . . . . A 421 GLN HA . 30410 1 799 . 1 . 1 78 78 GLN HB2 H 1 2.298 0.00 . . . . . . A 421 GLN HB2 . 30410 1 800 . 1 . 1 78 78 GLN HB3 H 1 2.298 0.00 . . . . . . A 421 GLN HB3 . 30410 1 801 . 1 . 1 78 78 GLN HG2 H 1 2.555 0.00 . . . . . . A 421 GLN HG2 . 30410 1 802 . 1 . 1 78 78 GLN HG3 H 1 2.555 0.00 . . . . . . A 421 GLN HG3 . 30410 1 803 . 1 . 1 78 78 GLN CA C 13 59.161 0.00 . . . . . . A 421 GLN CA . 30410 1 804 . 1 . 1 78 78 GLN CB C 13 28.270 0.00 . . . . . . A 421 GLN CB . 30410 1 805 . 1 . 1 78 78 GLN CG C 13 33.742 0.00 . . . . . . A 421 GLN CG . 30410 1 806 . 1 . 1 78 78 GLN N N 15 120.733 0.00 . . . . . . A 421 GLN N . 30410 1 807 . 1 . 1 79 79 ILE H H 1 8.398 0.00 . . . . . . A 422 ILE H . 30410 1 808 . 1 . 1 79 79 ILE HA H 1 3.606 0.00 . . . . . . A 422 ILE HA . 30410 1 809 . 1 . 1 79 79 ILE HB H 1 1.859 0.00 . . . . . . A 422 ILE HB . 30410 1 810 . 1 . 1 79 79 ILE HG21 H 1 0.919 0.00 . . . . . . A 422 ILE HG21 . 30410 1 811 . 1 . 1 79 79 ILE HG22 H 1 0.919 0.00 . . . . . . A 422 ILE HG22 . 30410 1 812 . 1 . 1 79 79 ILE HG23 H 1 0.919 0.00 . . . . . . A 422 ILE HG23 . 30410 1 813 . 1 . 1 79 79 ILE HD11 H 1 0.842 0.00 . . . . . . A 422 ILE HD11 . 30410 1 814 . 1 . 1 79 79 ILE HD12 H 1 0.842 0.00 . . . . . . A 422 ILE HD12 . 30410 1 815 . 1 . 1 79 79 ILE HD13 H 1 0.842 0.00 . . . . . . A 422 ILE HD13 . 30410 1 816 . 1 . 1 79 79 ILE CA C 13 65.507 0.00 . . . . . . A 422 ILE CA . 30410 1 817 . 1 . 1 79 79 ILE CB C 13 38.626 0.00 . . . . . . A 422 ILE CB . 30410 1 818 . 1 . 1 79 79 ILE CG1 C 13 29.403 0.00 . . . . . . A 422 ILE CG1 . 30410 1 819 . 1 . 1 79 79 ILE CG2 C 13 17.005 0.00 . . . . . . A 422 ILE CG2 . 30410 1 820 . 1 . 1 79 79 ILE CD1 C 13 14.221 0.00 . . . . . . A 422 ILE CD1 . 30410 1 821 . 1 . 1 79 79 ILE N N 15 120.451 0.00 . . . . . . A 422 ILE N . 30410 1 822 . 1 . 1 80 80 ARG H H 1 8.000 0.00 . . . . . . A 423 ARG H . 30410 1 823 . 1 . 1 80 80 ARG CA C 13 59.826 0.00 . . . . . . A 423 ARG CA . 30410 1 824 . 1 . 1 80 80 ARG CB C 13 29.871 0.00 . . . . . . A 423 ARG CB . 30410 1 825 . 1 . 1 80 80 ARG N N 15 120.808 0.00 . . . . . . A 423 ARG N . 30410 1 826 . 1 . 1 81 81 LYS H H 1 8.138 0.00 . . . . . . A 424 LYS H . 30410 1 827 . 1 . 1 81 81 LYS CA C 13 57.908 0.00 . . . . . . A 424 LYS CA . 30410 1 828 . 1 . 1 81 81 LYS CB C 13 32.354 0.00 . . . . . . A 424 LYS CB . 30410 1 829 . 1 . 1 81 81 LYS N N 15 119.423 0.00 . . . . . . A 424 LYS N . 30410 1 830 . 1 . 1 82 82 GLU CB C 13 29.639 0.00 . . . . . . A 425 GLU CB . 30410 1 831 . 1 . 1 83 83 LYS H H 1 8.012 0.00 . . . . . . A 426 LYS H . 30410 1 832 . 1 . 1 83 83 LYS N N 15 119.976 0.00 . . . . . . A 426 LYS N . 30410 1 833 . 1 . 1 84 84 GLU H H 1 8.127 0.00 . . . . . . A 427 GLU H . 30410 1 834 . 1 . 1 84 84 GLU N N 15 119.552 0.00 . . . . . . A 427 GLU N . 30410 1 835 . 1 . 1 85 85 GLU H H 1 8.197 0.00 . . . . . . A 428 GLU H . 30410 1 836 . 1 . 1 85 85 GLU HA H 1 4.160 0.00 . . . . . . A 428 GLU HA . 30410 1 837 . 1 . 1 85 85 GLU HB2 H 1 2.062 0.00 . . . . . . A 428 GLU HB2 . 30410 1 838 . 1 . 1 85 85 GLU HB3 H 1 2.062 0.00 . . . . . . A 428 GLU HB3 . 30410 1 839 . 1 . 1 85 85 GLU HG2 H 1 2.264 0.00 . . . . . . A 428 GLU HG2 . 30410 1 840 . 1 . 1 85 85 GLU HG3 H 1 2.412 0.00 . . . . . . A 428 GLU HG3 . 30410 1 841 . 1 . 1 85 85 GLU CA C 13 57.901 0.00 . . . . . . A 428 GLU CA . 30410 1 842 . 1 . 1 85 85 GLU CB C 13 29.750 0.00 . . . . . . A 428 GLU CB . 30410 1 843 . 1 . 1 85 85 GLU CG C 13 36.542 0.00 . . . . . . A 428 GLU CG . 30410 1 844 . 1 . 1 85 85 GLU N N 15 119.328 0.00 . . . . . . A 428 GLU N . 30410 1 845 . 1 . 1 86 86 ALA H H 1 7.846 0.00 . . . . . . A 429 ALA H . 30410 1 846 . 1 . 1 86 86 ALA HA H 1 4.221 0.00 . . . . . . A 429 ALA HA . 30410 1 847 . 1 . 1 86 86 ALA HB1 H 1 1.481 0.00 . . . . . . A 429 ALA HB1 . 30410 1 848 . 1 . 1 86 86 ALA HB2 H 1 1.481 0.00 . . . . . . A 429 ALA HB2 . 30410 1 849 . 1 . 1 86 86 ALA HB3 H 1 1.481 0.00 . . . . . . A 429 ALA HB3 . 30410 1 850 . 1 . 1 86 86 ALA CA C 13 53.558 0.00 . . . . . . A 429 ALA CA . 30410 1 851 . 1 . 1 86 86 ALA CB C 13 18.939 0.00 . . . . . . A 429 ALA CB . 30410 1 852 . 1 . 1 86 86 ALA N N 15 122.180 0.00 . . . . . . A 429 ALA N . 30410 1 853 . 1 . 1 87 87 GLU H H 1 7.941 0.00 . . . . . . A 430 GLU H . 30410 1 854 . 1 . 1 87 87 GLU HA H 1 4.212 0.00 . . . . . . A 430 GLU HA . 30410 1 855 . 1 . 1 87 87 GLU HB2 H 1 1.987 0.00 . . . . . . A 430 GLU HB2 . 30410 1 856 . 1 . 1 87 87 GLU HB3 H 1 2.067 0.00 . . . . . . A 430 GLU HB3 . 30410 1 857 . 1 . 1 87 87 GLU HG2 H 1 2.274 0.00 . . . . . . A 430 GLU HG2 . 30410 1 858 . 1 . 1 87 87 GLU HG3 H 1 2.399 0.00 . . . . . . A 430 GLU HG3 . 30410 1 859 . 1 . 1 87 87 GLU CA C 13 56.757 0.00 . . . . . . A 430 GLU CA . 30410 1 860 . 1 . 1 87 87 GLU CB C 13 30.165 0.00 . . . . . . A 430 GLU CB . 30410 1 861 . 1 . 1 87 87 GLU CG C 13 36.463 0.00 . . . . . . A 430 GLU CG . 30410 1 862 . 1 . 1 87 87 GLU N N 15 118.071 0.00 . . . . . . A 430 GLU N . 30410 1 863 . 1 . 1 88 88 ALA H H 1 7.885 0.00 . . . . . . A 431 ALA H . 30410 1 864 . 1 . 1 88 88 ALA HA H 1 4.348 0.00 . . . . . . A 431 ALA HA . 30410 1 865 . 1 . 1 88 88 ALA HB1 H 1 1.413 0.00 . . . . . . A 431 ALA HB1 . 30410 1 866 . 1 . 1 88 88 ALA HB2 H 1 1.413 0.00 . . . . . . A 431 ALA HB2 . 30410 1 867 . 1 . 1 88 88 ALA HB3 H 1 1.413 0.00 . . . . . . A 431 ALA HB3 . 30410 1 868 . 1 . 1 88 88 ALA CA C 13 52.550 0.00 . . . . . . A 431 ALA CA . 30410 1 869 . 1 . 1 88 88 ALA CB C 13 19.024 0.00 . . . . . . A 431 ALA CB . 30410 1 870 . 1 . 1 88 88 ALA N N 15 124.454 0.00 . . . . . . A 431 ALA N . 30410 1 871 . 1 . 1 89 89 ARG H H 1 7.774 0.00 . . . . . . A 432 ARG H . 30410 1 872 . 1 . 1 89 89 ARG CA C 13 57.479 0.00 . . . . . . A 432 ARG CA . 30410 1 873 . 1 . 1 89 89 ARG CB C 13 31.640 0.00 . . . . . . A 432 ARG CB . 30410 1 874 . 1 . 1 89 89 ARG N N 15 125.787 0.00 . . . . . . A 432 ARG N . 30410 1 stop_ save_