data_25740 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25740 _Entry.Title ; C-terminal domain of Cdc37 cochaperone ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-08-02 _Entry.Accession_date 2015-08-02 _Entry.Last_release_date 2015-10-05 _Entry.Original_release_date 2015-10-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 10 STRUCTURES' _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Dimitra Keramisanou . . . . 25740 2 Amit Dudhat . . . . 25740 3 Michael Pare . . . . 25740 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25740 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Hsp90 . 25740 cdc37 . 25740 co-chaperone . 25740 kinase . 25740 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25740 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 351 25740 '15N chemical shifts' 86 25740 '1H chemical shifts' 583 25740 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 . . 2016-08-05 2015-08-02 update BMRB 'update entry citation' 25740 1 . . 2015-10-05 2015-08-02 original author 'original release' 25740 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1US7 'crystal structure of MC-Cdc37 two-domain fragment' 25740 PDB 2N5X 'C-terminal domain of Cdc37 cochaperone' 25740 PDB 2W0G 'crystal structure of M-Cdc37' 25740 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 25740 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26400850 _Citation.Full_citation . _Citation.Title ; The C-terminal domain of human Cdc37 studied by solution NMR ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 63 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 315 _Citation.Page_last 321 _Citation.Year 2015 _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 Ziming Zhang . . . . 25740 1 2 Dimitra Keramisanou . . . . 25740 1 3 Amit Dudhat . . . . 25740 1 4 Michael Pare . . . . 25740 1 5 Ioannis Gelis . . . . 25740 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25740 _Assembly.ID 1 _Assembly.Name 'C-terminal domain of Cdc37 cochaperone' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Cdc37 1 $Cdc37 A . yes native no no . . . 25740 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Cdc37 _Entity.Sf_category entity _Entity.Sf_framecode Cdc37 _Entity.Entry_ID 25740 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Cdc37 _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 ; GHMGPGGLDPVEVYESLPEE LQKCFDVKDVQMLQDAISKM DPTDAKYHMQRCIDSGLWVP NSKASEAKEGEEAGPGDPLL EAVPKTGDEKDVSV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 285-287 represent a non-native fragment after removal of purification tag' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 94 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'C-terminal domain of Cdc37' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10197.445 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q16543 . c . . . . . . . . . . . . . . 25740 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 1 285 GLY . 25740 1 2 286 HIS . 25740 1 3 287 MET . 25740 1 4 288 GLY . 25740 1 5 289 PRO . 25740 1 6 290 GLY . 25740 1 7 291 GLY . 25740 1 8 292 LEU . 25740 1 9 293 ASP . 25740 1 10 294 PRO . 25740 1 11 295 VAL . 25740 1 12 296 GLU . 25740 1 13 297 VAL . 25740 1 14 298 TYR . 25740 1 15 299 GLU . 25740 1 16 300 SER . 25740 1 17 301 LEU . 25740 1 18 302 PRO . 25740 1 19 303 GLU . 25740 1 20 304 GLU . 25740 1 21 305 LEU . 25740 1 22 306 GLN . 25740 1 23 307 LYS . 25740 1 24 308 CYS . 25740 1 25 309 PHE . 25740 1 26 310 ASP . 25740 1 27 311 VAL . 25740 1 28 312 LYS . 25740 1 29 313 ASP . 25740 1 30 314 VAL . 25740 1 31 315 GLN . 25740 1 32 316 MET . 25740 1 33 317 LEU . 25740 1 34 318 GLN . 25740 1 35 319 ASP . 25740 1 36 320 ALA . 25740 1 37 321 ILE . 25740 1 38 322 SER . 25740 1 39 323 LYS . 25740 1 40 324 MET . 25740 1 41 325 ASP . 25740 1 42 326 PRO . 25740 1 43 327 THR . 25740 1 44 328 ASP . 25740 1 45 329 ALA . 25740 1 46 330 LYS . 25740 1 47 331 TYR . 25740 1 48 332 HIS . 25740 1 49 333 MET . 25740 1 50 334 GLN . 25740 1 51 335 ARG . 25740 1 52 336 CYS . 25740 1 53 337 ILE . 25740 1 54 338 ASP . 25740 1 55 339 SER . 25740 1 56 340 GLY . 25740 1 57 341 LEU . 25740 1 58 342 TRP . 25740 1 59 343 VAL . 25740 1 60 344 PRO . 25740 1 61 345 ASN . 25740 1 62 346 SER . 25740 1 63 347 LYS . 25740 1 64 348 ALA . 25740 1 65 349 SER . 25740 1 66 350 GLU . 25740 1 67 351 ALA . 25740 1 68 352 LYS . 25740 1 69 353 GLU . 25740 1 70 354 GLY . 25740 1 71 355 GLU . 25740 1 72 356 GLU . 25740 1 73 357 ALA . 25740 1 74 358 GLY . 25740 1 75 359 PRO . 25740 1 76 360 GLY . 25740 1 77 361 ASP . 25740 1 78 362 PRO . 25740 1 79 363 LEU . 25740 1 80 364 LEU . 25740 1 81 365 GLU . 25740 1 82 366 ALA . 25740 1 83 367 VAL . 25740 1 84 368 PRO . 25740 1 85 369 LYS . 25740 1 86 370 THR . 25740 1 87 371 GLY . 25740 1 88 372 ASP . 25740 1 89 373 GLU . 25740 1 90 374 LYS . 25740 1 91 375 ASP . 25740 1 92 376 VAL . 25740 1 93 377 SER . 25740 1 94 378 VAL . 25740 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 25740 1 . HIS 2 2 25740 1 . MET 3 3 25740 1 . GLY 4 4 25740 1 . PRO 5 5 25740 1 . GLY 6 6 25740 1 . GLY 7 7 25740 1 . LEU 8 8 25740 1 . ASP 9 9 25740 1 . PRO 10 10 25740 1 . VAL 11 11 25740 1 . GLU 12 12 25740 1 . VAL 13 13 25740 1 . TYR 14 14 25740 1 . GLU 15 15 25740 1 . SER 16 16 25740 1 . LEU 17 17 25740 1 . PRO 18 18 25740 1 . GLU 19 19 25740 1 . GLU 20 20 25740 1 . LEU 21 21 25740 1 . GLN 22 22 25740 1 . LYS 23 23 25740 1 . CYS 24 24 25740 1 . PHE 25 25 25740 1 . ASP 26 26 25740 1 . VAL 27 27 25740 1 . LYS 28 28 25740 1 . ASP 29 29 25740 1 . VAL 30 30 25740 1 . GLN 31 31 25740 1 . MET 32 32 25740 1 . LEU 33 33 25740 1 . GLN 34 34 25740 1 . ASP 35 35 25740 1 . ALA 36 36 25740 1 . ILE 37 37 25740 1 . SER 38 38 25740 1 . LYS 39 39 25740 1 . MET 40 40 25740 1 . ASP 41 41 25740 1 . PRO 42 42 25740 1 . THR 43 43 25740 1 . ASP 44 44 25740 1 . ALA 45 45 25740 1 . LYS 46 46 25740 1 . TYR 47 47 25740 1 . HIS 48 48 25740 1 . MET 49 49 25740 1 . GLN 50 50 25740 1 . ARG 51 51 25740 1 . CYS 52 52 25740 1 . ILE 53 53 25740 1 . ASP 54 54 25740 1 . SER 55 55 25740 1 . GLY 56 56 25740 1 . LEU 57 57 25740 1 . TRP 58 58 25740 1 . VAL 59 59 25740 1 . PRO 60 60 25740 1 . ASN 61 61 25740 1 . SER 62 62 25740 1 . LYS 63 63 25740 1 . ALA 64 64 25740 1 . SER 65 65 25740 1 . GLU 66 66 25740 1 . ALA 67 67 25740 1 . LYS 68 68 25740 1 . GLU 69 69 25740 1 . GLY 70 70 25740 1 . GLU 71 71 25740 1 . GLU 72 72 25740 1 . ALA 73 73 25740 1 . GLY 74 74 25740 1 . PRO 75 75 25740 1 . GLY 76 76 25740 1 . ASP 77 77 25740 1 . PRO 78 78 25740 1 . LEU 79 79 25740 1 . LEU 80 80 25740 1 . GLU 81 81 25740 1 . ALA 82 82 25740 1 . VAL 83 83 25740 1 . PRO 84 84 25740 1 . LYS 85 85 25740 1 . THR 86 86 25740 1 . GLY 87 87 25740 1 . ASP 88 88 25740 1 . GLU 89 89 25740 1 . LYS 90 90 25740 1 . ASP 91 91 25740 1 . VAL 92 92 25740 1 . SER 93 93 25740 1 . VAL 94 94 25740 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 25740 _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 $Cdc37 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25740 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 25740 _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 $Cdc37 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21DE3 . . . . . pdb.His.MBP . . . 25740 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25740 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM Hepes, pH=7.5, 100mM NaCl, 2mM DTT' _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 Cdc37 '[U-100% 13C; U-100% 15N]' . . 1 $Cdc37 . . . 0.3 0.5 mM . . . . 25740 1 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25740 1 3 HEPES 'natural abundance' . . . . . . 50 . . mM . . . . 25740 1 4 D2O '[U-100% 2H]' . . . . . . 7 . . % . . . . 25740 1 5 H2O 'natural abundance' . . . . . . 93 . . % . . . . 25740 1 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25740 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25740 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM Hepes, pH=7.5, 100mM NaCl, 2mM DTT' _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 Cdc37 '[U-100% 15N]' . . 1 $Cdc37 . . . 0.3 0.5 mM . . . . 25740 2 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25740 2 3 HEPES 'natural abundance' . . . . . . 50 . . mM . . . . 25740 2 4 D2O [U-2H] . . . . . . 7 . . % . . . . 25740 2 5 H2O 'natural abundance' . . . . . . 93 . . % . . . . 25740 2 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25740 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25740 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM Hepes, pH=7.5, 100mM NaCl, 2mM DTT' _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 Cdc37 '[U-10% 13C; U-100% 15N]' . . 1 $Cdc37 . . . 0.3 0.5 mM . . . . 25740 3 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 25740 3 3 HEPES 'natural abundance' . . . . . . 5 . . mM . . . . 25740 3 4 D2O [U-2H] . . . . . . 7 . . % . . . . 25740 3 5 H2O 'natural abundance' . . . . . . 93 . . % . . . . 25740 3 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25740 3 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 25740 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 25740 1 pH 7.5 . pH 25740 1 pressure 1 . atm 25740 1 temperature 303 . K 25740 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25740 _Software.ID 1 _Software.Name CYANA _Software.Version 3.97 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 25740 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25740 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25740 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25740 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25740 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25740 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25740 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25740 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25740 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25740 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25740 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian VNMRS . 800 . . . 25740 1 2 spectrometer_2 Varian VNMRS . 600 . . . 25740 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 25740 _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 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 2 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 5 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 6 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 7 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 9 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 11 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 12 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 anisotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25740 1 14 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25740 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25740 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 25740 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25740 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCA' . . . 25740 1 2 '3D HN(CO)CA' . . . 25740 1 3 '3D HNCACB' . . . 25740 1 4 '3D CBCA(CO)NH' . . . 25740 1 8 '3D H(CCO)NH' . . . 25740 1 9 '3D C(CO)NH' . . . 25740 1 10 '3D 1H-15N NOESY' . . . 25740 1 11 '3D 1H-13C NOESY aliphatic' . . . 25740 1 14 '3D HNCO' . . . 25740 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 MET HA H 1 4.546 0.020 . 1 . . . A 287 MET HA . 25740 1 2 . 1 1 3 3 MET HB2 H 1 2.512 0.020 . 2 . . . A 287 MET HB2 . 25740 1 3 . 1 1 3 3 MET HB3 H 1 2.512 0.020 . 2 . . . A 287 MET HB3 . 25740 1 4 . 1 1 3 3 MET HG2 H 1 1.980 0.020 . 2 . . . A 287 MET HG2 . 25740 1 5 . 1 1 3 3 MET HG3 H 1 1.980 0.020 . 2 . . . A 287 MET HG3 . 25740 1 6 . 1 1 3 3 MET C C 13 176.456 0.400 . 1 . . . A 287 MET C . 25740 1 7 . 1 1 3 3 MET CA C 13 55.062 0.400 . 1 . . . A 287 MET CA . 25740 1 8 . 1 1 3 3 MET CB C 13 33.474 0.400 . 1 . . . A 287 MET CB . 25740 1 9 . 1 1 3 3 MET CG C 13 32.089 0.400 . 1 . . . A 287 MET CG . 25740 1 10 . 1 1 4 4 GLY H H 1 8.314 0.020 . 1 . . . A 288 GLY H . 25740 1 11 . 1 1 4 4 GLY HA2 H 1 4.550 0.020 . 2 . . . A 288 GLY HA2 . 25740 1 12 . 1 1 4 4 GLY HA3 H 1 4.550 0.020 . 2 . . . A 288 GLY HA3 . 25740 1 13 . 1 1 4 4 GLY N N 15 109.239 0.400 . 1 . . . A 288 GLY N . 25740 1 14 . 1 1 5 5 PRO HA H 1 4.436 0.020 . 1 . . . A 289 PRO HA . 25740 1 15 . 1 1 5 5 PRO HB2 H 1 2.332 0.020 . 2 . . . A 289 PRO HB2 . 25740 1 16 . 1 1 5 5 PRO HB3 H 1 2.332 0.020 . 2 . . . A 289 PRO HB3 . 25740 1 17 . 1 1 5 5 PRO HG2 H 1 2.086 0.020 . 2 . . . A 289 PRO HG2 . 25740 1 18 . 1 1 5 5 PRO HG3 H 1 2.086 0.020 . 2 . . . A 289 PRO HG3 . 25740 1 19 . 1 1 5 5 PRO HD2 H 1 3.660 0.020 . 2 . . . A 289 PRO HD2 . 25740 1 20 . 1 1 5 5 PRO HD3 H 1 3.660 0.020 . 2 . . . A 289 PRO HD3 . 25740 1 21 . 1 1 5 5 PRO C C 13 177.731 0.400 . 1 . . . A 289 PRO C . 25740 1 22 . 1 1 5 5 PRO CA C 13 64.156 0.400 . 1 . . . A 289 PRO CA . 25740 1 23 . 1 1 5 5 PRO CB C 13 31.993 0.400 . 1 . . . A 289 PRO CB . 25740 1 24 . 1 1 5 5 PRO CG C 13 27.360 0.400 . 1 . . . A 289 PRO CG . 25740 1 25 . 1 1 5 5 PRO CD C 13 49.606 0.400 . 1 . . . A 289 PRO CD . 25740 1 26 . 1 1 6 6 GLY H H 1 8.583 0.020 . 1 . . . A 290 GLY H . 25740 1 27 . 1 1 6 6 GLY HA2 H 1 4.204 0.020 . 2 . . . A 290 GLY HA2 . 25740 1 28 . 1 1 6 6 GLY HA3 H 1 3.791 0.020 . 2 . . . A 290 GLY HA3 . 25740 1 29 . 1 1 6 6 GLY C C 13 174.892 0.400 . 1 . . . A 290 GLY C . 25740 1 30 . 1 1 6 6 GLY CA C 13 45.065 0.400 . 1 . . . A 290 GLY CA . 25740 1 31 . 1 1 6 6 GLY N N 15 108.144 0.400 . 1 . . . A 290 GLY N . 25740 1 32 . 1 1 7 7 GLY H H 1 8.090 0.020 . 1 . . . A 291 GLY H . 25740 1 33 . 1 1 7 7 GLY HA2 H 1 3.935 0.020 . 2 . . . A 291 GLY HA2 . 25740 1 34 . 1 1 7 7 GLY HA3 H 1 3.935 0.020 . 2 . . . A 291 GLY HA3 . 25740 1 35 . 1 1 7 7 GLY C C 13 173.451 0.400 . 1 . . . A 291 GLY C . 25740 1 36 . 1 1 7 7 GLY CA C 13 45.477 0.400 . 1 . . . A 291 GLY CA . 25740 1 37 . 1 1 7 7 GLY N N 15 107.784 0.400 . 1 . . . A 291 GLY N . 25740 1 38 . 1 1 8 8 LEU H H 1 7.330 0.020 . 1 . . . A 292 LEU H . 25740 1 39 . 1 1 8 8 LEU HA H 1 4.518 0.020 . 1 . . . A 292 LEU HA . 25740 1 40 . 1 1 8 8 LEU HB2 H 1 1.263 0.020 . 2 . . . A 292 LEU HB2 . 25740 1 41 . 1 1 8 8 LEU HB3 H 1 1.263 0.020 . 2 . . . A 292 LEU HB3 . 25740 1 42 . 1 1 8 8 LEU HG H 1 1.491 0.020 . 1 . . . A 292 LEU HG . 25740 1 43 . 1 1 8 8 LEU HD11 H 1 0.906 0.020 . 2 . . . A 292 LEU HD11 . 25740 1 44 . 1 1 8 8 LEU HD12 H 1 0.906 0.020 . 2 . . . A 292 LEU HD12 . 25740 1 45 . 1 1 8 8 LEU HD13 H 1 0.906 0.020 . 2 . . . A 292 LEU HD13 . 25740 1 46 . 1 1 8 8 LEU HD21 H 1 0.837 0.020 . 2 . . . A 292 LEU HD21 . 25740 1 47 . 1 1 8 8 LEU HD22 H 1 0.837 0.020 . 2 . . . A 292 LEU HD22 . 25740 1 48 . 1 1 8 8 LEU HD23 H 1 0.837 0.020 . 2 . . . A 292 LEU HD23 . 25740 1 49 . 1 1 8 8 LEU C C 13 175.298 0.400 . 1 . . . A 292 LEU C . 25740 1 50 . 1 1 8 8 LEU CA C 13 53.589 0.400 . 1 . . . A 292 LEU CA . 25740 1 51 . 1 1 8 8 LEU CB C 13 44.648 0.400 . 1 . . . A 292 LEU CB . 25740 1 52 . 1 1 8 8 LEU CG C 13 26.927 0.400 . 1 . . . A 292 LEU CG . 25740 1 53 . 1 1 8 8 LEU CD1 C 13 26.197 0.400 . 1 . . . A 292 LEU CD1 . 25740 1 54 . 1 1 8 8 LEU CD2 C 13 23.533 0.400 . 1 . . . A 292 LEU CD2 . 25740 1 55 . 1 1 8 8 LEU N N 15 119.139 0.400 . 1 . . . A 292 LEU N . 25740 1 56 . 1 1 9 9 ASP H H 1 8.783 0.020 . 1 . . . A 293 ASP H . 25740 1 57 . 1 1 9 9 ASP HA H 1 5.052 0.020 . 1 . . . A 293 ASP HA . 25740 1 58 . 1 1 9 9 ASP HB2 H 1 2.678 0.020 . 2 . . . A 293 ASP HB2 . 25740 1 59 . 1 1 9 9 ASP HB3 H 1 2.898 0.020 . 2 . . . A 293 ASP HB3 . 25740 1 60 . 1 1 9 9 ASP CA C 13 51.068 0.400 . 1 . . . A 293 ASP CA . 25740 1 61 . 1 1 9 9 ASP CB C 13 42.859 0.400 . 1 . . . A 293 ASP CB . 25740 1 62 . 1 1 9 9 ASP N N 15 124.712 0.400 . 1 . . . A 293 ASP N . 25740 1 63 . 1 1 10 10 PRO HA H 1 4.224 0.020 . 1 . . . A 294 PRO HA . 25740 1 64 . 1 1 10 10 PRO HB2 H 1 2.185 0.020 . 2 . . . A 294 PRO HB2 . 25740 1 65 . 1 1 10 10 PRO HB3 H 1 2.185 0.020 . 2 . . . A 294 PRO HB3 . 25740 1 66 . 1 1 10 10 PRO HG2 H 1 1.994 0.020 . 2 . . . A 294 PRO HG2 . 25740 1 67 . 1 1 10 10 PRO HG3 H 1 1.994 0.020 . 2 . . . A 294 PRO HG3 . 25740 1 68 . 1 1 10 10 PRO HD2 H 1 4.216 0.020 . 2 . . . A 294 PRO HD2 . 25740 1 69 . 1 1 10 10 PRO HD3 H 1 4.080 0.020 . 2 . . . A 294 PRO HD3 . 25740 1 70 . 1 1 10 10 PRO C C 13 178.508 0.400 . 1 . . . A 294 PRO C . 25740 1 71 . 1 1 10 10 PRO CA C 13 65.058 0.400 . 1 . . . A 294 PRO CA . 25740 1 72 . 1 1 10 10 PRO CB C 13 31.792 0.400 . 1 . . . A 294 PRO CB . 25740 1 73 . 1 1 10 10 PRO CG C 13 27.371 0.400 . 1 . . . A 294 PRO CG . 25740 1 74 . 1 1 10 10 PRO CD C 13 51.178 0.400 . 1 . . . A 294 PRO CD . 25740 1 75 . 1 1 11 11 VAL H H 1 8.215 0.020 . 1 . . . A 295 VAL H . 25740 1 76 . 1 1 11 11 VAL HA H 1 3.711 0.020 . 1 . . . A 295 VAL HA . 25740 1 77 . 1 1 11 11 VAL HB H 1 2.194 0.020 . 1 . . . A 295 VAL HB . 25740 1 78 . 1 1 11 11 VAL HG11 H 1 0.929 0.020 . 2 . . . A 295 VAL HG11 . 25740 1 79 . 1 1 11 11 VAL HG12 H 1 0.929 0.020 . 2 . . . A 295 VAL HG12 . 25740 1 80 . 1 1 11 11 VAL HG13 H 1 0.929 0.020 . 2 . . . A 295 VAL HG13 . 25740 1 81 . 1 1 11 11 VAL HG21 H 1 0.980 0.020 . 2 . . . A 295 VAL HG21 . 25740 1 82 . 1 1 11 11 VAL HG22 H 1 0.980 0.020 . 2 . . . A 295 VAL HG22 . 25740 1 83 . 1 1 11 11 VAL HG23 H 1 0.980 0.020 . 2 . . . A 295 VAL HG23 . 25740 1 84 . 1 1 11 11 VAL C C 13 177.860 0.400 . 1 . . . A 295 VAL C . 25740 1 85 . 1 1 11 11 VAL CA C 13 66.648 0.400 . 1 . . . A 295 VAL CA . 25740 1 86 . 1 1 11 11 VAL CB C 13 31.221 0.400 . 1 . . . A 295 VAL CB . 25740 1 87 . 1 1 11 11 VAL CG1 C 13 21.145 0.400 . 1 . . . A 295 VAL CG1 . 25740 1 88 . 1 1 11 11 VAL CG2 C 13 22.670 0.400 . 1 . . . A 295 VAL CG2 . 25740 1 89 . 1 1 11 11 VAL N N 15 121.762 0.400 . 1 . . . A 295 VAL N . 25740 1 90 . 1 1 12 12 GLU H H 1 7.195 0.020 . 1 . . . A 296 GLU H . 25740 1 91 . 1 1 12 12 GLU HA H 1 4.063 0.020 . 1 . . . A 296 GLU HA . 25740 1 92 . 1 1 12 12 GLU HB2 H 1 2.201 0.020 . 2 . . . A 296 GLU HB2 . 25740 1 93 . 1 1 12 12 GLU HB3 H 1 2.201 0.020 . 2 . . . A 296 GLU HB3 . 25740 1 94 . 1 1 12 12 GLU HG2 H 1 2.400 0.020 . 2 . . . A 296 GLU HG2 . 25740 1 95 . 1 1 12 12 GLU HG3 H 1 2.400 0.020 . 2 . . . A 296 GLU HG3 . 25740 1 96 . 1 1 12 12 GLU C C 13 180.463 0.400 . 1 . . . A 296 GLU C . 25740 1 97 . 1 1 12 12 GLU CA C 13 58.987 0.400 . 1 . . . A 296 GLU CA . 25740 1 98 . 1 1 12 12 GLU CB C 13 29.507 0.400 . 1 . . . A 296 GLU CB . 25740 1 99 . 1 1 12 12 GLU CG C 13 36.476 0.400 . 1 . . . A 296 GLU CG . 25740 1 100 . 1 1 12 12 GLU N N 15 120.347 0.400 . 1 . . . A 296 GLU N . 25740 1 101 . 1 1 13 13 VAL H H 1 8.286 0.020 . 1 . . . A 297 VAL H . 25740 1 102 . 1 1 13 13 VAL HA H 1 3.531 0.020 . 1 . . . A 297 VAL HA . 25740 1 103 . 1 1 13 13 VAL HB H 1 2.033 0.020 . 1 . . . A 297 VAL HB . 25740 1 104 . 1 1 13 13 VAL HG11 H 1 0.736 0.020 . 2 . . . A 297 VAL HG11 . 25740 1 105 . 1 1 13 13 VAL HG12 H 1 0.736 0.020 . 2 . . . A 297 VAL HG12 . 25740 1 106 . 1 1 13 13 VAL HG13 H 1 0.736 0.020 . 2 . . . A 297 VAL HG13 . 25740 1 107 . 1 1 13 13 VAL HG21 H 1 0.972 0.020 . 2 . . . A 297 VAL HG21 . 25740 1 108 . 1 1 13 13 VAL HG22 H 1 0.972 0.020 . 2 . . . A 297 VAL HG22 . 25740 1 109 . 1 1 13 13 VAL HG23 H 1 0.972 0.020 . 2 . . . A 297 VAL HG23 . 25740 1 110 . 1 1 13 13 VAL C C 13 179.235 0.400 . 1 . . . A 297 VAL C . 25740 1 111 . 1 1 13 13 VAL CA C 13 66.709 0.400 . 1 . . . A 297 VAL CA . 25740 1 112 . 1 1 13 13 VAL CB C 13 31.356 0.400 . 1 . . . A 297 VAL CB . 25740 1 113 . 1 1 13 13 VAL CG1 C 13 22.171 0.400 . 1 . . . A 297 VAL CG1 . 25740 1 114 . 1 1 13 13 VAL CG2 C 13 23.851 0.400 . 1 . . . A 297 VAL CG2 . 25740 1 115 . 1 1 13 13 VAL N N 15 118.204 0.400 . 1 . . . A 297 VAL N . 25740 1 116 . 1 1 14 14 TYR H H 1 8.623 0.020 . 1 . . . A 298 TYR H . 25740 1 117 . 1 1 14 14 TYR HA H 1 3.762 0.020 . 1 . . . A 298 TYR HA . 25740 1 118 . 1 1 14 14 TYR HB2 H 1 3.213 0.020 . 2 . . . A 298 TYR HB2 . 25740 1 119 . 1 1 14 14 TYR HB3 H 1 3.019 0.020 . 2 . . . A 298 TYR HB3 . 25740 1 120 . 1 1 14 14 TYR HD1 H 1 6.840 0.020 . 1 . . . A 298 TYR HD1 . 25740 1 121 . 1 1 14 14 TYR HE1 H 1 6.892 0.020 . 1 . . . A 298 TYR HE1 . 25740 1 122 . 1 1 14 14 TYR C C 13 177.844 0.400 . 1 . . . A 298 TYR C . 25740 1 123 . 1 1 14 14 TYR CA C 13 62.198 0.400 . 1 . . . A 298 TYR CA . 25740 1 124 . 1 1 14 14 TYR CB C 13 38.322 0.400 . 1 . . . A 298 TYR CB . 25740 1 125 . 1 1 14 14 TYR CD1 C 13 132.605 0.400 . 1 . . . A 298 TYR CD1 . 25740 1 126 . 1 1 14 14 TYR CE1 C 13 119.380 0.400 . 1 . . . A 298 TYR CE1 . 25740 1 127 . 1 1 14 14 TYR N N 15 122.586 0.400 . 1 . . . A 298 TYR N . 25740 1 128 . 1 1 15 15 GLU H H 1 8.292 0.020 . 1 . . . A 299 GLU H . 25740 1 129 . 1 1 15 15 GLU HA H 1 3.785 0.020 . 1 . . . A 299 GLU HA . 25740 1 130 . 1 1 15 15 GLU HB2 H 1 2.119 0.020 . 2 . . . A 299 GLU HB2 . 25740 1 131 . 1 1 15 15 GLU HB3 H 1 2.119 0.020 . 2 . . . A 299 GLU HB3 . 25740 1 132 . 1 1 15 15 GLU HG2 H 1 2.675 0.020 . 2 . . . A 299 GLU HG2 . 25740 1 133 . 1 1 15 15 GLU HG3 H 1 2.436 0.020 . 2 . . . A 299 GLU HG3 . 25740 1 134 . 1 1 15 15 GLU C C 13 176.636 0.400 . 1 . . . A 299 GLU C . 25740 1 135 . 1 1 15 15 GLU CA C 13 58.718 0.400 . 1 . . . A 299 GLU CA . 25740 1 136 . 1 1 15 15 GLU CB C 13 29.580 0.400 . 1 . . . A 299 GLU CB . 25740 1 137 . 1 1 15 15 GLU CG C 13 36.918 0.400 . 1 . . . A 299 GLU CG . 25740 1 138 . 1 1 15 15 GLU N N 15 116.485 0.400 . 1 . . . A 299 GLU N . 25740 1 139 . 1 1 16 16 SER H H 1 7.728 0.020 . 1 . . . A 300 SER H . 25740 1 140 . 1 1 16 16 SER HA H 1 4.549 0.020 . 1 . . . A 300 SER HA . 25740 1 141 . 1 1 16 16 SER HB2 H 1 4.259 0.020 . 2 . . . A 300 SER HB2 . 25740 1 142 . 1 1 16 16 SER HB3 H 1 3.981 0.020 . 2 . . . A 300 SER HB3 . 25740 1 143 . 1 1 16 16 SER C C 13 173.963 0.400 . 1 . . . A 300 SER C . 25740 1 144 . 1 1 16 16 SER CA C 13 58.502 0.400 . 1 . . . A 300 SER CA . 25740 1 145 . 1 1 16 16 SER CB C 13 64.845 0.400 . 1 . . . A 300 SER CB . 25740 1 146 . 1 1 16 16 SER N N 15 113.046 0.400 . 1 . . . A 300 SER N . 25740 1 147 . 1 1 17 17 LEU H H 1 7.326 0.020 . 1 . . . A 301 LEU H . 25740 1 148 . 1 1 17 17 LEU HA H 1 4.138 0.020 . 1 . . . A 301 LEU HA . 25740 1 149 . 1 1 17 17 LEU HB2 H 1 1.024 0.020 . 2 . . . A 301 LEU HB2 . 25740 1 150 . 1 1 17 17 LEU HB3 H 1 1.670 0.020 . 2 . . . A 301 LEU HB3 . 25740 1 151 . 1 1 17 17 LEU HD11 H 1 0.649 0.020 . 2 . . . A 301 LEU HD11 . 25740 1 152 . 1 1 17 17 LEU HD12 H 1 0.649 0.020 . 2 . . . A 301 LEU HD12 . 25740 1 153 . 1 1 17 17 LEU HD13 H 1 0.649 0.020 . 2 . . . A 301 LEU HD13 . 25740 1 154 . 1 1 17 17 LEU HD21 H 1 0.680 0.020 . 2 . . . A 301 LEU HD21 . 25740 1 155 . 1 1 17 17 LEU HD22 H 1 0.680 0.020 . 2 . . . A 301 LEU HD22 . 25740 1 156 . 1 1 17 17 LEU HD23 H 1 0.680 0.020 . 2 . . . A 301 LEU HD23 . 25740 1 157 . 1 1 17 17 LEU CA C 13 53.047 0.400 . 1 . . . A 301 LEU CA . 25740 1 158 . 1 1 17 17 LEU CB C 13 41.865 0.400 . 1 . . . A 301 LEU CB . 25740 1 159 . 1 1 17 17 LEU CD1 C 13 26.440 0.400 . 1 . . . A 301 LEU CD1 . 25740 1 160 . 1 1 17 17 LEU CD2 C 13 22.522 0.400 . 1 . . . A 301 LEU CD2 . 25740 1 161 . 1 1 17 17 LEU N N 15 124.535 0.400 . 1 . . . A 301 LEU N . 25740 1 162 . 1 1 18 18 PRO HA H 1 4.415 0.020 . 1 . . . A 302 PRO HA . 25740 1 163 . 1 1 18 18 PRO HB2 H 1 1.804 0.020 . 2 . . . A 302 PRO HB2 . 25740 1 164 . 1 1 18 18 PRO HB3 H 1 2.466 0.020 . 2 . . . A 302 PRO HB3 . 25740 1 165 . 1 1 18 18 PRO HG2 H 1 1.659 0.020 . 2 . . . A 302 PRO HG2 . 25740 1 166 . 1 1 18 18 PRO HG3 H 1 1.940 0.020 . 2 . . . A 302 PRO HG3 . 25740 1 167 . 1 1 18 18 PRO HD2 H 1 2.833 0.020 . 2 . . . A 302 PRO HD2 . 25740 1 168 . 1 1 18 18 PRO HD3 H 1 2.441 0.020 . 2 . . . A 302 PRO HD3 . 25740 1 169 . 1 1 18 18 PRO C C 13 178.093 0.400 . 1 . . . A 302 PRO C . 25740 1 170 . 1 1 18 18 PRO CA C 13 62.171 0.400 . 1 . . . A 302 PRO CA . 25740 1 171 . 1 1 18 18 PRO CB C 13 32.242 0.400 . 1 . . . A 302 PRO CB . 25740 1 172 . 1 1 18 18 PRO CG C 13 27.904 0.400 . 1 . . . A 302 PRO CG . 25740 1 173 . 1 1 18 18 PRO CD C 13 49.001 0.400 . 1 . . . A 302 PRO CD . 25740 1 174 . 1 1 19 19 GLU H H 1 9.001 0.020 . 1 . . . A 303 GLU H . 25740 1 175 . 1 1 19 19 GLU HA H 1 3.871 0.020 . 1 . . . A 303 GLU HA . 25740 1 176 . 1 1 19 19 GLU HB2 H 1 2.087 0.020 . 2 . . . A 303 GLU HB2 . 25740 1 177 . 1 1 19 19 GLU HB3 H 1 1.955 0.020 . 2 . . . A 303 GLU HB3 . 25740 1 178 . 1 1 19 19 GLU HG2 H 1 2.316 0.020 . 2 . . . A 303 GLU HG2 . 25740 1 179 . 1 1 19 19 GLU HG3 H 1 2.228 0.020 . 2 . . . A 303 GLU HG3 . 25740 1 180 . 1 1 19 19 GLU C C 13 177.628 0.400 . 1 . . . A 303 GLU C . 25740 1 181 . 1 1 19 19 GLU CA C 13 60.070 0.400 . 1 . . . A 303 GLU CA . 25740 1 182 . 1 1 19 19 GLU CB C 13 29.615 0.400 . 1 . . . A 303 GLU CB . 25740 1 183 . 1 1 19 19 GLU CG C 13 36.285 0.400 . 1 . . . A 303 GLU CG . 25740 1 184 . 1 1 19 19 GLU N N 15 126.240 0.400 . 1 . . . A 303 GLU N . 25740 1 185 . 1 1 20 20 GLU H H 1 9.375 0.020 . 1 . . . A 304 GLU H . 25740 1 186 . 1 1 20 20 GLU HA H 1 3.942 0.020 . 1 . . . A 304 GLU HA . 25740 1 187 . 1 1 20 20 GLU HG2 H 1 2.267 0.020 . 2 . . . A 304 GLU HG2 . 25740 1 188 . 1 1 20 20 GLU HG3 H 1 2.267 0.020 . 2 . . . A 304 GLU HG3 . 25740 1 189 . 1 1 20 20 GLU C C 13 178.946 0.400 . 1 . . . A 304 GLU C . 25740 1 190 . 1 1 20 20 GLU CA C 13 59.812 0.400 . 1 . . . A 304 GLU CA . 25740 1 191 . 1 1 20 20 GLU CB C 13 29.161 0.400 . 1 . . . A 304 GLU CB . 25740 1 192 . 1 1 20 20 GLU CG C 13 36.550 0.400 . 1 . . . A 304 GLU CG . 25740 1 193 . 1 1 20 20 GLU N N 15 116.356 0.400 . 1 . . . A 304 GLU N . 25740 1 194 . 1 1 21 21 LEU H H 1 7.164 0.020 . 1 . . . A 305 LEU H . 25740 1 195 . 1 1 21 21 LEU HA H 1 4.272 0.020 . 1 . . . A 305 LEU HA . 25740 1 196 . 1 1 21 21 LEU HB2 H 1 1.695 0.020 . 2 . . . A 305 LEU HB2 . 25740 1 197 . 1 1 21 21 LEU HB3 H 1 1.695 0.020 . 2 . . . A 305 LEU HB3 . 25740 1 198 . 1 1 21 21 LEU HG H 1 1.585 0.020 . 1 . . . A 305 LEU HG . 25740 1 199 . 1 1 21 21 LEU HD11 H 1 0.761 0.020 . 2 . . . A 305 LEU HD11 . 25740 1 200 . 1 1 21 21 LEU HD12 H 1 0.761 0.020 . 2 . . . A 305 LEU HD12 . 25740 1 201 . 1 1 21 21 LEU HD13 H 1 0.761 0.020 . 2 . . . A 305 LEU HD13 . 25740 1 202 . 1 1 21 21 LEU HD21 H 1 0.744 0.020 . 2 . . . A 305 LEU HD21 . 25740 1 203 . 1 1 21 21 LEU HD22 H 1 0.744 0.020 . 2 . . . A 305 LEU HD22 . 25740 1 204 . 1 1 21 21 LEU HD23 H 1 0.744 0.020 . 2 . . . A 305 LEU HD23 . 25740 1 205 . 1 1 21 21 LEU C C 13 178.593 0.400 . 1 . . . A 305 LEU C . 25740 1 206 . 1 1 21 21 LEU CA C 13 57.030 0.400 . 1 . . . A 305 LEU CA . 25740 1 207 . 1 1 21 21 LEU CB C 13 42.471 0.400 . 1 . . . A 305 LEU CB . 25740 1 208 . 1 1 21 21 LEU CG C 13 27.715 0.400 . 1 . . . A 305 LEU CG . 25740 1 209 . 1 1 21 21 LEU CD1 C 13 25.209 0.400 . 1 . . . A 305 LEU CD1 . 25740 1 210 . 1 1 21 21 LEU CD2 C 13 23.477 0.400 . 1 . . . A 305 LEU CD2 . 25740 1 211 . 1 1 21 21 LEU N N 15 115.292 0.400 . 1 . . . A 305 LEU N . 25740 1 212 . 1 1 22 22 GLN H H 1 7.994 0.020 . 1 . . . A 306 GLN H . 25740 1 213 . 1 1 22 22 GLN HA H 1 3.668 0.020 . 1 . . . A 306 GLN HA . 25740 1 214 . 1 1 22 22 GLN HB2 H 1 2.132 0.020 . 2 . . . A 306 GLN HB2 . 25740 1 215 . 1 1 22 22 GLN HB3 H 1 2.132 0.020 . 2 . . . A 306 GLN HB3 . 25740 1 216 . 1 1 22 22 GLN HG2 H 1 1.312 0.020 . 2 . . . A 306 GLN HG2 . 25740 1 217 . 1 1 22 22 GLN HG3 H 1 1.955 0.020 . 2 . . . A 306 GLN HG3 . 25740 1 218 . 1 1 22 22 GLN HE21 H 1 7.022 0.020 . 2 . . . A 306 GLN HE21 . 25740 1 219 . 1 1 22 22 GLN HE22 H 1 6.573 0.020 . 2 . . . A 306 GLN HE22 . 25740 1 220 . 1 1 22 22 GLN C C 13 178.274 0.400 . 1 . . . A 306 GLN C . 25740 1 221 . 1 1 22 22 GLN CA C 13 60.371 0.400 . 1 . . . A 306 GLN CA . 25740 1 222 . 1 1 22 22 GLN CB C 13 28.158 0.400 . 1 . . . A 306 GLN CB . 25740 1 223 . 1 1 22 22 GLN CG C 13 34.238 0.400 . 1 . . . A 306 GLN CG . 25740 1 224 . 1 1 22 22 GLN N N 15 119.809 0.400 . 1 . . . A 306 GLN N . 25740 1 225 . 1 1 22 22 GLN NE2 N 15 111.950 0.400 . 1 . . . A 306 GLN NE2 . 25740 1 226 . 1 1 23 23 LYS H H 1 7.858 0.020 . 1 . . . A 307 LYS H . 25740 1 227 . 1 1 23 23 LYS HA H 1 4.195 0.020 . 1 . . . A 307 LYS HA . 25740 1 228 . 1 1 23 23 LYS HB2 H 1 1.889 0.020 . 2 . . . A 307 LYS HB2 . 25740 1 229 . 1 1 23 23 LYS HB3 H 1 1.889 0.020 . 2 . . . A 307 LYS HB3 . 25740 1 230 . 1 1 23 23 LYS HG2 H 1 1.683 0.020 . 2 . . . A 307 LYS HG2 . 25740 1 231 . 1 1 23 23 LYS HG3 H 1 1.573 0.020 . 2 . . . A 307 LYS HG3 . 25740 1 232 . 1 1 23 23 LYS HE2 H 1 2.944 0.020 . 2 . . . A 307 LYS HE2 . 25740 1 233 . 1 1 23 23 LYS HE3 H 1 2.944 0.020 . 2 . . . A 307 LYS HE3 . 25740 1 234 . 1 1 23 23 LYS C C 13 178.946 0.400 . 1 . . . A 307 LYS C . 25740 1 235 . 1 1 23 23 LYS CA C 13 58.932 0.400 . 1 . . . A 307 LYS CA . 25740 1 236 . 1 1 23 23 LYS CB C 13 32.208 0.400 . 1 . . . A 307 LYS CB . 25740 1 237 . 1 1 23 23 LYS CG C 13 24.972 0.400 . 1 . . . A 307 LYS CG . 25740 1 238 . 1 1 23 23 LYS CD C 13 29.060 0.400 . 1 . . . A 307 LYS CD . 25740 1 239 . 1 1 23 23 LYS CE C 13 42.242 0.400 . 1 . . . A 307 LYS CE . 25740 1 240 . 1 1 23 23 LYS N N 15 114.630 0.400 . 1 . . . A 307 LYS N . 25740 1 241 . 1 1 24 24 CYS H H 1 7.178 0.020 . 1 . . . A 308 CYS H . 25740 1 242 . 1 1 24 24 CYS HA H 1 4.211 0.020 . 1 . . . A 308 CYS HA . 25740 1 243 . 1 1 24 24 CYS HB2 H 1 3.011 0.020 . 2 . . . A 308 CYS HB2 . 25740 1 244 . 1 1 24 24 CYS HB3 H 1 2.402 0.020 . 2 . . . A 308 CYS HB3 . 25740 1 245 . 1 1 24 24 CYS C C 13 177.040 0.400 . 1 . . . A 308 CYS C . 25740 1 246 . 1 1 24 24 CYS CA C 13 62.139 0.400 . 1 . . . A 308 CYS CA . 25740 1 247 . 1 1 24 24 CYS CB C 13 27.478 0.400 . 1 . . . A 308 CYS CB . 25740 1 248 . 1 1 24 24 CYS N N 15 115.186 0.400 . 1 . . . A 308 CYS N . 25740 1 249 . 1 1 25 25 PHE H H 1 7.712 0.020 . 1 . . . A 309 PHE H . 25740 1 250 . 1 1 25 25 PHE HA H 1 4.138 0.020 . 1 . . . A 309 PHE HA . 25740 1 251 . 1 1 25 25 PHE HB2 H 1 3.427 0.020 . 2 . . . A 309 PHE HB2 . 25740 1 252 . 1 1 25 25 PHE HB3 H 1 3.075 0.020 . 2 . . . A 309 PHE HB3 . 25740 1 253 . 1 1 25 25 PHE HD2 H 1 7.258 0.020 . 1 . . . A 309 PHE HD2 . 25740 1 254 . 1 1 25 25 PHE HE2 H 1 7.116 0.020 . 1 . . . A 309 PHE HE2 . 25740 1 255 . 1 1 25 25 PHE HZ H 1 6.991 0.020 . 1 . . . A 309 PHE HZ . 25740 1 256 . 1 1 25 25 PHE C C 13 178.096 0.400 . 1 . . . A 309 PHE C . 25740 1 257 . 1 1 25 25 PHE CA C 13 61.808 0.400 . 1 . . . A 309 PHE CA . 25740 1 258 . 1 1 25 25 PHE CB C 13 38.406 0.400 . 1 . . . A 309 PHE CB . 25740 1 259 . 1 1 25 25 PHE CD2 C 13 131.387 0.400 . 1 . . . A 309 PHE CD2 . 25740 1 260 . 1 1 25 25 PHE CE2 C 13 131.420 0.400 . 1 . . . A 309 PHE CE2 . 25740 1 261 . 1 1 25 25 PHE CZ C 13 129.706 0.400 . 1 . . . A 309 PHE CZ . 25740 1 262 . 1 1 25 25 PHE N N 15 118.312 0.400 . 1 . . . A 309 PHE N . 25740 1 263 . 1 1 26 26 ASP H H 1 8.468 0.020 . 1 . . . A 310 ASP H . 25740 1 264 . 1 1 26 26 ASP HA H 1 4.430 0.020 . 1 . . . A 310 ASP HA . 25740 1 265 . 1 1 26 26 ASP HB2 H 1 2.932 0.020 . 2 . . . A 310 ASP HB2 . 25740 1 266 . 1 1 26 26 ASP HB3 H 1 2.781 0.020 . 2 . . . A 310 ASP HB3 . 25740 1 267 . 1 1 26 26 ASP C C 13 177.822 0.400 . 1 . . . A 310 ASP C . 25740 1 268 . 1 1 26 26 ASP CA C 13 57.319 0.400 . 1 . . . A 310 ASP CA . 25740 1 269 . 1 1 26 26 ASP CB C 13 40.507 0.400 . 1 . . . A 310 ASP CB . 25740 1 270 . 1 1 26 26 ASP N N 15 121.804 0.400 . 1 . . . A 310 ASP N . 25740 1 271 . 1 1 27 27 VAL H H 1 7.298 0.020 . 1 . . . A 311 VAL H . 25740 1 272 . 1 1 27 27 VAL HA H 1 4.323 0.020 . 1 . . . A 311 VAL HA . 25740 1 273 . 1 1 27 27 VAL HB H 1 2.384 0.020 . 1 . . . A 311 VAL HB . 25740 1 274 . 1 1 27 27 VAL HG11 H 1 0.990 0.020 . 2 . . . A 311 VAL HG11 . 25740 1 275 . 1 1 27 27 VAL HG12 H 1 0.990 0.020 . 2 . . . A 311 VAL HG12 . 25740 1 276 . 1 1 27 27 VAL HG13 H 1 0.990 0.020 . 2 . . . A 311 VAL HG13 . 25740 1 277 . 1 1 27 27 VAL HG21 H 1 1.041 0.020 . 2 . . . A 311 VAL HG21 . 25740 1 278 . 1 1 27 27 VAL HG22 H 1 1.041 0.020 . 2 . . . A 311 VAL HG22 . 25740 1 279 . 1 1 27 27 VAL HG23 H 1 1.041 0.020 . 2 . . . A 311 VAL HG23 . 25740 1 280 . 1 1 27 27 VAL C C 13 175.273 0.400 . 1 . . . A 311 VAL C . 25740 1 281 . 1 1 27 27 VAL CA C 13 61.382 0.400 . 1 . . . A 311 VAL CA . 25740 1 282 . 1 1 27 27 VAL CB C 13 32.135 0.400 . 1 . . . A 311 VAL CB . 25740 1 283 . 1 1 27 27 VAL CG1 C 13 21.732 0.400 . 1 . . . A 311 VAL CG1 . 25740 1 284 . 1 1 27 27 VAL CG2 C 13 19.959 0.400 . 1 . . . A 311 VAL CG2 . 25740 1 285 . 1 1 27 27 VAL N N 15 110.647 0.400 . 1 . . . A 311 VAL N . 25740 1 286 . 1 1 28 28 LYS H H 1 7.774 0.020 . 1 . . . A 312 LYS H . 25740 1 287 . 1 1 28 28 LYS HA H 1 3.718 0.020 . 1 . . . A 312 LYS HA . 25740 1 288 . 1 1 28 28 LYS HB2 H 1 2.017 0.020 . 2 . . . A 312 LYS HB2 . 25740 1 289 . 1 1 28 28 LYS HB3 H 1 1.882 0.020 . 2 . . . A 312 LYS HB3 . 25740 1 290 . 1 1 28 28 LYS HG2 H 1 1.313 0.020 . 2 . . . A 312 LYS HG2 . 25740 1 291 . 1 1 28 28 LYS HG3 H 1 1.313 0.020 . 2 . . . A 312 LYS HG3 . 25740 1 292 . 1 1 28 28 LYS HD2 H 1 1.630 0.020 . 2 . . . A 312 LYS HD2 . 25740 1 293 . 1 1 28 28 LYS HD3 H 1 1.630 0.020 . 2 . . . A 312 LYS HD3 . 25740 1 294 . 1 1 28 28 LYS HE2 H 1 2.935 0.020 . 2 . . . A 312 LYS HE2 . 25740 1 295 . 1 1 28 28 LYS HE3 H 1 2.935 0.020 . 2 . . . A 312 LYS HE3 . 25740 1 296 . 1 1 28 28 LYS C C 13 174.686 0.400 . 1 . . . A 312 LYS C . 25740 1 297 . 1 1 28 28 LYS CA C 13 57.173 0.400 . 1 . . . A 312 LYS CA . 25740 1 298 . 1 1 28 28 LYS CB C 13 29.674 0.400 . 1 . . . A 312 LYS CB . 25740 1 299 . 1 1 28 28 LYS N N 15 119.155 0.400 . 1 . . . A 312 LYS N . 25740 1 300 . 1 1 29 29 ASP H H 1 7.352 0.020 . 1 . . . A 313 ASP H . 25740 1 301 . 1 1 29 29 ASP HA H 1 4.965 0.020 . 1 . . . A 313 ASP HA . 25740 1 302 . 1 1 29 29 ASP C C 13 176.401 0.400 . 1 . . . A 313 ASP C . 25740 1 303 . 1 1 29 29 ASP CA C 13 53.037 0.400 . 1 . . . A 313 ASP CA . 25740 1 304 . 1 1 29 29 ASP CB C 13 43.255 0.400 . 1 . . . A 313 ASP CB . 25740 1 305 . 1 1 29 29 ASP N N 15 118.801 0.400 . 1 . . . A 313 ASP N . 25740 1 306 . 1 1 30 30 VAL H H 1 8.594 0.020 . 1 . . . A 314 VAL H . 25740 1 307 . 1 1 30 30 VAL HA H 1 3.762 0.020 . 1 . . . A 314 VAL HA . 25740 1 308 . 1 1 30 30 VAL HB H 1 2.193 0.020 . 1 . . . A 314 VAL HB . 25740 1 309 . 1 1 30 30 VAL HG11 H 1 1.024 0.020 . 2 . . . A 314 VAL HG11 . 25740 1 310 . 1 1 30 30 VAL HG12 H 1 1.024 0.020 . 2 . . . A 314 VAL HG12 . 25740 1 311 . 1 1 30 30 VAL HG13 H 1 1.024 0.020 . 2 . . . A 314 VAL HG13 . 25740 1 312 . 1 1 30 30 VAL HG21 H 1 1.110 0.020 . 2 . . . A 314 VAL HG21 . 25740 1 313 . 1 1 30 30 VAL HG22 H 1 1.110 0.020 . 2 . . . A 314 VAL HG22 . 25740 1 314 . 1 1 30 30 VAL HG23 H 1 1.110 0.020 . 2 . . . A 314 VAL HG23 . 25740 1 315 . 1 1 30 30 VAL C C 13 177.537 0.400 . 1 . . . A 314 VAL C . 25740 1 316 . 1 1 30 30 VAL CA C 13 65.129 0.400 . 1 . . . A 314 VAL CA . 25740 1 317 . 1 1 30 30 VAL CB C 13 31.749 0.400 . 1 . . . A 314 VAL CB . 25740 1 318 . 1 1 30 30 VAL CG1 C 13 21.430 0.400 . 1 . . . A 314 VAL CG1 . 25740 1 319 . 1 1 30 30 VAL CG2 C 13 21.677 0.400 . 1 . . . A 314 VAL CG2 . 25740 1 320 . 1 1 30 30 VAL N N 15 124.253 0.400 . 1 . . . A 314 VAL N . 25740 1 321 . 1 1 31 31 GLN H H 1 8.210 0.020 . 1 . . . A 315 GLN H . 25740 1 322 . 1 1 31 31 GLN HA H 1 4.071 0.020 . 1 . . . A 315 GLN HA . 25740 1 323 . 1 1 31 31 GLN HB2 H 1 2.181 0.020 . 2 . . . A 315 GLN HB2 . 25740 1 324 . 1 1 31 31 GLN HB3 H 1 2.181 0.020 . 2 . . . A 315 GLN HB3 . 25740 1 325 . 1 1 31 31 GLN HG2 H 1 2.400 0.020 . 2 . . . A 315 GLN HG2 . 25740 1 326 . 1 1 31 31 GLN HG3 H 1 2.400 0.020 . 2 . . . A 315 GLN HG3 . 25740 1 327 . 1 1 31 31 GLN HE21 H 1 7.676 0.020 . 2 . . . A 315 GLN HE21 . 25740 1 328 . 1 1 31 31 GLN HE22 H 1 6.836 0.020 . 2 . . . A 315 GLN HE22 . 25740 1 329 . 1 1 31 31 GLN C C 13 178.413 0.400 . 1 . . . A 315 GLN C . 25740 1 330 . 1 1 31 31 GLN CA C 13 58.831 0.400 . 1 . . . A 315 GLN CA . 25740 1 331 . 1 1 31 31 GLN CB C 13 28.023 0.400 . 1 . . . A 315 GLN CB . 25740 1 332 . 1 1 31 31 GLN CG C 13 34.226 0.400 . 1 . . . A 315 GLN CG . 25740 1 333 . 1 1 31 31 GLN N N 15 122.826 0.400 . 1 . . . A 315 GLN N . 25740 1 334 . 1 1 31 31 GLN NE2 N 15 113.621 0.400 . 1 . . . A 315 GLN NE2 . 25740 1 335 . 1 1 32 32 MET H H 1 8.177 0.020 . 1 . . . A 316 MET H . 25740 1 336 . 1 1 32 32 MET HA H 1 4.038 0.020 . 1 . . . A 316 MET HA . 25740 1 337 . 1 1 32 32 MET HB2 H 1 2.164 0.020 . 2 . . . A 316 MET HB2 . 25740 1 338 . 1 1 32 32 MET HB3 H 1 2.026 0.020 . 2 . . . A 316 MET HB3 . 25740 1 339 . 1 1 32 32 MET HG2 H 1 2.589 0.020 . 2 . . . A 316 MET HG2 . 25740 1 340 . 1 1 32 32 MET HG3 H 1 2.589 0.020 . 2 . . . A 316 MET HG3 . 25740 1 341 . 1 1 32 32 MET HE1 H 1 1.736 0.020 . 1 . . . A 316 MET HE1 . 25740 1 342 . 1 1 32 32 MET HE2 H 1 1.736 0.020 . 1 . . . A 316 MET HE2 . 25740 1 343 . 1 1 32 32 MET HE3 H 1 1.736 0.020 . 1 . . . A 316 MET HE3 . 25740 1 344 . 1 1 32 32 MET C C 13 179.022 0.400 . 1 . . . A 316 MET C . 25740 1 345 . 1 1 32 32 MET CA C 13 58.718 0.400 . 1 . . . A 316 MET CA . 25740 1 346 . 1 1 32 32 MET CB C 13 33.348 0.400 . 1 . . . A 316 MET CB . 25740 1 347 . 1 1 32 32 MET CG C 13 32.137 0.400 . 1 . . . A 316 MET CG . 25740 1 348 . 1 1 32 32 MET CE C 13 16.494 0.400 . 1 . . . A 316 MET CE . 25740 1 349 . 1 1 32 32 MET N N 15 120.940 0.400 . 1 . . . A 316 MET N . 25740 1 350 . 1 1 33 33 LEU H H 1 7.605 0.020 . 1 . . . A 317 LEU H . 25740 1 351 . 1 1 33 33 LEU HA H 1 4.275 0.020 . 1 . . . A 317 LEU HA . 25740 1 352 . 1 1 33 33 LEU HB2 H 1 1.106 0.020 . 2 . . . A 317 LEU HB2 . 25740 1 353 . 1 1 33 33 LEU HB3 H 1 1.777 0.020 . 2 . . . A 317 LEU HB3 . 25740 1 354 . 1 1 33 33 LEU HG H 1 1.161 0.020 . 1 . . . A 317 LEU HG . 25740 1 355 . 1 1 33 33 LEU HD11 H 1 0.488 0.020 . 2 . . . A 317 LEU HD11 . 25740 1 356 . 1 1 33 33 LEU HD12 H 1 0.488 0.020 . 2 . . . A 317 LEU HD12 . 25740 1 357 . 1 1 33 33 LEU HD13 H 1 0.488 0.020 . 2 . . . A 317 LEU HD13 . 25740 1 358 . 1 1 33 33 LEU HD21 H 1 0.080 0.020 . 2 . . . A 317 LEU HD21 . 25740 1 359 . 1 1 33 33 LEU HD22 H 1 0.080 0.020 . 2 . . . A 317 LEU HD22 . 25740 1 360 . 1 1 33 33 LEU HD23 H 1 0.080 0.020 . 2 . . . A 317 LEU HD23 . 25740 1 361 . 1 1 33 33 LEU C C 13 177.453 0.400 . 1 . . . A 317 LEU C . 25740 1 362 . 1 1 33 33 LEU CA C 13 58.369 0.400 . 1 . . . A 317 LEU CA . 25740 1 363 . 1 1 33 33 LEU CB C 13 41.908 0.400 . 1 . . . A 317 LEU CB . 25740 1 364 . 1 1 33 33 LEU CG C 13 26.790 0.400 . 1 . . . A 317 LEU CG . 25740 1 365 . 1 1 33 33 LEU CD1 C 13 23.649 0.400 . 1 . . . A 317 LEU CD1 . 25740 1 366 . 1 1 33 33 LEU CD2 C 13 25.155 0.400 . 1 . . . A 317 LEU CD2 . 25740 1 367 . 1 1 33 33 LEU N N 15 120.571 0.400 . 1 . . . A 317 LEU N . 25740 1 368 . 1 1 34 34 GLN H H 1 7.978 0.020 . 1 . . . A 318 GLN H . 25740 1 369 . 1 1 34 34 GLN HA H 1 3.864 0.020 . 1 . . . A 318 GLN HA . 25740 1 370 . 1 1 34 34 GLN HB2 H 1 2.160 0.020 . 2 . . . A 318 GLN HB2 . 25740 1 371 . 1 1 34 34 GLN HB3 H 1 2.160 0.020 . 2 . . . A 318 GLN HB3 . 25740 1 372 . 1 1 34 34 GLN HG2 H 1 2.510 0.020 . 2 . . . A 318 GLN HG2 . 25740 1 373 . 1 1 34 34 GLN HG3 H 1 2.405 0.020 . 2 . . . A 318 GLN HG3 . 25740 1 374 . 1 1 34 34 GLN HE21 H 1 7.235 0.020 . 2 . . . A 318 GLN HE21 . 25740 1 375 . 1 1 34 34 GLN HE22 H 1 6.797 0.020 . 2 . . . A 318 GLN HE22 . 25740 1 376 . 1 1 34 34 GLN C C 13 179.153 0.400 . 1 . . . A 318 GLN C . 25740 1 377 . 1 1 34 34 GLN CA C 13 59.006 0.400 . 1 . . . A 318 GLN CA . 25740 1 378 . 1 1 34 34 GLN CB C 13 28.267 0.400 . 1 . . . A 318 GLN CB . 25740 1 379 . 1 1 34 34 GLN CG C 13 34.112 0.400 . 1 . . . A 318 GLN CG . 25740 1 380 . 1 1 34 34 GLN N N 15 117.590 0.400 . 1 . . . A 318 GLN N . 25740 1 381 . 1 1 34 34 GLN NE2 N 15 110.618 0.400 . 1 . . . A 318 GLN NE2 . 25740 1 382 . 1 1 35 35 ASP H H 1 8.171 0.020 . 1 . . . A 319 ASP H . 25740 1 383 . 1 1 35 35 ASP HA H 1 4.332 0.020 . 1 . . . A 319 ASP HA . 25740 1 384 . 1 1 35 35 ASP HB2 H 1 2.732 0.020 . 2 . . . A 319 ASP HB2 . 25740 1 385 . 1 1 35 35 ASP HB3 H 1 2.619 0.020 . 2 . . . A 319 ASP HB3 . 25740 1 386 . 1 1 35 35 ASP C C 13 178.540 0.400 . 1 . . . A 319 ASP C . 25740 1 387 . 1 1 35 35 ASP CA C 13 57.313 0.400 . 1 . . . A 319 ASP CA . 25740 1 388 . 1 1 35 35 ASP CB C 13 40.661 0.400 . 1 . . . A 319 ASP CB . 25740 1 389 . 1 1 35 35 ASP N N 15 120.422 0.400 . 1 . . . A 319 ASP N . 25740 1 390 . 1 1 36 36 ALA H H 1 8.243 0.020 . 1 . . . A 320 ALA H . 25740 1 391 . 1 1 36 36 ALA HA H 1 4.013 0.020 . 1 . . . A 320 ALA HA . 25740 1 392 . 1 1 36 36 ALA HB1 H 1 1.335 0.020 . 1 . . . A 320 ALA HB1 . 25740 1 393 . 1 1 36 36 ALA HB2 H 1 1.335 0.020 . 1 . . . A 320 ALA HB2 . 25740 1 394 . 1 1 36 36 ALA HB3 H 1 1.335 0.020 . 1 . . . A 320 ALA HB3 . 25740 1 395 . 1 1 36 36 ALA C C 13 181.582 0.400 . 1 . . . A 320 ALA C . 25740 1 396 . 1 1 36 36 ALA CA C 13 55.366 0.400 . 1 . . . A 320 ALA CA . 25740 1 397 . 1 1 36 36 ALA CB C 13 18.527 0.400 . 1 . . . A 320 ALA CB . 25740 1 398 . 1 1 36 36 ALA N N 15 123.057 0.400 . 1 . . . A 320 ALA N . 25740 1 399 . 1 1 37 37 ILE H H 1 8.543 0.020 . 1 . . . A 321 ILE H . 25740 1 400 . 1 1 37 37 ILE HA H 1 3.819 0.020 . 1 . . . A 321 ILE HA . 25740 1 401 . 1 1 37 37 ILE HB H 1 1.992 0.020 . 1 . . . A 321 ILE HB . 25740 1 402 . 1 1 37 37 ILE HG12 H 1 1.595 0.020 . 2 . . . A 321 ILE HG12 . 25740 1 403 . 1 1 37 37 ILE HG13 H 1 1.322 0.020 . 2 . . . A 321 ILE HG13 . 25740 1 404 . 1 1 37 37 ILE HG21 H 1 0.935 0.020 . 1 . . . A 321 ILE HG21 . 25740 1 405 . 1 1 37 37 ILE HG22 H 1 0.935 0.020 . 1 . . . A 321 ILE HG22 . 25740 1 406 . 1 1 37 37 ILE HG23 H 1 0.935 0.020 . 1 . . . A 321 ILE HG23 . 25740 1 407 . 1 1 37 37 ILE HD11 H 1 0.809 0.020 . 1 . . . A 321 ILE HD11 . 25740 1 408 . 1 1 37 37 ILE HD12 H 1 0.809 0.020 . 1 . . . A 321 ILE HD12 . 25740 1 409 . 1 1 37 37 ILE HD13 H 1 0.809 0.020 . 1 . . . A 321 ILE HD13 . 25740 1 410 . 1 1 37 37 ILE C C 13 178.972 0.400 . 1 . . . A 321 ILE C . 25740 1 411 . 1 1 37 37 ILE CA C 13 64.051 0.400 . 1 . . . A 321 ILE CA . 25740 1 412 . 1 1 37 37 ILE CB C 13 37.500 0.400 . 1 . . . A 321 ILE CB . 25740 1 413 . 1 1 37 37 ILE CG1 C 13 28.707 0.400 . 1 . . . A 321 ILE CG1 . 25740 1 414 . 1 1 37 37 ILE CG2 C 13 17.552 0.400 . 1 . . . A 321 ILE CG2 . 25740 1 415 . 1 1 37 37 ILE CD1 C 13 12.676 0.400 . 1 . . . A 321 ILE CD1 . 25740 1 416 . 1 1 37 37 ILE N N 15 118.131 0.400 . 1 . . . A 321 ILE N . 25740 1 417 . 1 1 38 38 SER H H 1 7.869 0.020 . 1 . . . A 322 SER H . 25740 1 418 . 1 1 38 38 SER HA H 1 4.311 0.020 . 1 . . . A 322 SER HA . 25740 1 419 . 1 1 38 38 SER HB2 H 1 4.075 0.020 . 2 . . . A 322 SER HB2 . 25740 1 420 . 1 1 38 38 SER HB3 H 1 4.075 0.020 . 2 . . . A 322 SER HB3 . 25740 1 421 . 1 1 38 38 SER C C 13 174.802 0.400 . 1 . . . A 322 SER C . 25740 1 422 . 1 1 38 38 SER CA C 13 61.156 0.400 . 1 . . . A 322 SER CA . 25740 1 423 . 1 1 38 38 SER CB C 13 63.299 0.400 . 1 . . . A 322 SER CB . 25740 1 424 . 1 1 38 38 SER N N 15 115.590 0.400 . 1 . . . A 322 SER N . 25740 1 425 . 1 1 39 39 LYS H H 1 7.111 0.020 . 1 . . . A 323 LYS H . 25740 1 426 . 1 1 39 39 LYS HA H 1 4.402 0.020 . 1 . . . A 323 LYS HA . 25740 1 427 . 1 1 39 39 LYS HB2 H 1 2.043 0.020 . 2 . . . A 323 LYS HB2 . 25740 1 428 . 1 1 39 39 LYS HB3 H 1 2.043 0.020 . 2 . . . A 323 LYS HB3 . 25740 1 429 . 1 1 39 39 LYS HG2 H 1 1.455 0.020 . 2 . . . A 323 LYS HG2 . 25740 1 430 . 1 1 39 39 LYS HG3 H 1 1.455 0.020 . 2 . . . A 323 LYS HG3 . 25740 1 431 . 1 1 39 39 LYS HD2 H 1 1.724 0.020 . 2 . . . A 323 LYS HD2 . 25740 1 432 . 1 1 39 39 LYS HD3 H 1 1.588 0.020 . 2 . . . A 323 LYS HD3 . 25740 1 433 . 1 1 39 39 LYS HE2 H 1 2.929 0.020 . 2 . . . A 323 LYS HE2 . 25740 1 434 . 1 1 39 39 LYS HE3 H 1 2.929 0.020 . 2 . . . A 323 LYS HE3 . 25740 1 435 . 1 1 39 39 LYS C C 13 176.687 0.400 . 1 . . . A 323 LYS C . 25740 1 436 . 1 1 39 39 LYS CA C 13 56.341 0.400 . 1 . . . A 323 LYS CA . 25740 1 437 . 1 1 39 39 LYS CB C 13 33.405 0.400 . 1 . . . A 323 LYS CB . 25740 1 438 . 1 1 39 39 LYS CG C 13 25.074 0.400 . 1 . . . A 323 LYS CG . 25740 1 439 . 1 1 39 39 LYS CD C 13 29.104 0.400 . 1 . . . A 323 LYS CD . 25740 1 440 . 1 1 39 39 LYS CE C 13 42.283 0.400 . 1 . . . A 323 LYS CE . 25740 1 441 . 1 1 39 39 LYS N N 15 119.262 0.400 . 1 . . . A 323 LYS N . 25740 1 442 . 1 1 40 40 MET H H 1 7.363 0.020 . 1 . . . A 324 MET H . 25740 1 443 . 1 1 40 40 MET HA H 1 4.430 0.020 . 1 . . . A 324 MET HA . 25740 1 444 . 1 1 40 40 MET HB2 H 1 2.325 0.020 . 2 . . . A 324 MET HB2 . 25740 1 445 . 1 1 40 40 MET HB3 H 1 2.163 0.020 . 2 . . . A 324 MET HB3 . 25740 1 446 . 1 1 40 40 MET HG2 H 1 2.916 0.020 . 2 . . . A 324 MET HG2 . 25740 1 447 . 1 1 40 40 MET HG3 H 1 2.674 0.020 . 2 . . . A 324 MET HG3 . 25740 1 448 . 1 1 40 40 MET C C 13 175.908 0.400 . 1 . . . A 324 MET C . 25740 1 449 . 1 1 40 40 MET CA C 13 55.476 0.400 . 1 . . . A 324 MET CA . 25740 1 450 . 1 1 40 40 MET CB C 13 35.709 0.400 . 1 . . . A 324 MET CB . 25740 1 451 . 1 1 40 40 MET CG C 13 32.278 0.400 . 1 . . . A 324 MET CG . 25740 1 452 . 1 1 40 40 MET N N 15 118.953 0.400 . 1 . . . A 324 MET N . 25740 1 453 . 1 1 41 41 ASP H H 1 8.985 0.020 . 1 . . . A 325 ASP H . 25740 1 454 . 1 1 41 41 ASP HB2 H 1 2.801 0.020 . 2 . . . A 325 ASP HB2 . 25740 1 455 . 1 1 41 41 ASP HB3 H 1 2.801 0.020 . 2 . . . A 325 ASP HB3 . 25740 1 456 . 1 1 41 41 ASP CB C 13 42.242 0.400 . 1 . . . A 325 ASP CB . 25740 1 457 . 1 1 41 41 ASP N N 15 124.530 0.400 . 1 . . . A 325 ASP N . 25740 1 458 . 1 1 42 42 PRO HA H 1 4.382 0.020 . 1 . . . A 326 PRO HA . 25740 1 459 . 1 1 42 42 PRO HB2 H 1 2.423 0.020 . 2 . . . A 326 PRO HB2 . 25740 1 460 . 1 1 42 42 PRO HB3 H 1 2.423 0.020 . 2 . . . A 326 PRO HB3 . 25740 1 461 . 1 1 42 42 PRO HG2 H 1 2.159 0.020 . 2 . . . A 326 PRO HG2 . 25740 1 462 . 1 1 42 42 PRO HG3 H 1 2.061 0.020 . 2 . . . A 326 PRO HG3 . 25740 1 463 . 1 1 42 42 PRO HD2 H 1 4.007 0.020 . 2 . . . A 326 PRO HD2 . 25740 1 464 . 1 1 42 42 PRO HD3 H 1 3.874 0.020 . 2 . . . A 326 PRO HD3 . 25740 1 465 . 1 1 42 42 PRO C C 13 179.207 0.400 . 1 . . . A 326 PRO C . 25740 1 466 . 1 1 42 42 PRO CA C 13 65.516 0.400 . 1 . . . A 326 PRO CA . 25740 1 467 . 1 1 42 42 PRO CB C 13 32.456 0.400 . 1 . . . A 326 PRO CB . 25740 1 468 . 1 1 42 42 PRO CG C 13 27.698 0.400 . 1 . . . A 326 PRO CG . 25740 1 469 . 1 1 42 42 PRO CD C 13 51.151 0.400 . 1 . . . A 326 PRO CD . 25740 1 470 . 1 1 43 43 THR H H 1 8.450 0.020 . 1 . . . A 327 THR H . 25740 1 471 . 1 1 43 43 THR HA H 1 3.997 0.020 . 1 . . . A 327 THR HA . 25740 1 472 . 1 1 43 43 THR HB H 1 4.264 0.020 . 1 . . . A 327 THR HB . 25740 1 473 . 1 1 43 43 THR HG21 H 1 1.251 0.020 . 1 . . . A 327 THR HG21 . 25740 1 474 . 1 1 43 43 THR HG22 H 1 1.251 0.020 . 1 . . . A 327 THR HG22 . 25740 1 475 . 1 1 43 43 THR HG23 H 1 1.251 0.020 . 1 . . . A 327 THR HG23 . 25740 1 476 . 1 1 43 43 THR C C 13 176.843 0.400 . 1 . . . A 327 THR C . 25740 1 477 . 1 1 43 43 THR CA C 13 66.473 0.400 . 1 . . . A 327 THR CA . 25740 1 478 . 1 1 43 43 THR CB C 13 68.070 0.400 . 1 . . . A 327 THR CB . 25740 1 479 . 1 1 43 43 THR CG2 C 13 22.133 0.400 . 1 . . . A 327 THR CG2 . 25740 1 480 . 1 1 43 43 THR N N 15 115.440 0.400 . 1 . . . A 327 THR N . 25740 1 481 . 1 1 44 44 ASP H H 1 7.756 0.020 . 1 . . . A 328 ASP H . 25740 1 482 . 1 1 44 44 ASP HA H 1 4.526 0.020 . 1 . . . A 328 ASP HA . 25740 1 483 . 1 1 44 44 ASP HB2 H 1 2.926 0.020 . 2 . . . A 328 ASP HB2 . 25740 1 484 . 1 1 44 44 ASP HB3 H 1 2.833 0.020 . 2 . . . A 328 ASP HB3 . 25740 1 485 . 1 1 44 44 ASP C C 13 177.647 0.400 . 1 . . . A 328 ASP C . 25740 1 486 . 1 1 44 44 ASP CA C 13 57.149 0.400 . 1 . . . A 328 ASP CA . 25740 1 487 . 1 1 44 44 ASP CB C 13 40.920 0.400 . 1 . . . A 328 ASP CB . 25740 1 488 . 1 1 44 44 ASP N N 15 124.544 0.400 . 1 . . . A 328 ASP N . 25740 1 489 . 1 1 45 45 ALA H H 1 8.715 0.020 . 1 . . . A 329 ALA H . 25740 1 490 . 1 1 45 45 ALA HA H 1 4.095 0.020 . 1 . . . A 329 ALA HA . 25740 1 491 . 1 1 45 45 ALA HB1 H 1 1.557 0.020 . 1 . . . A 329 ALA HB1 . 25740 1 492 . 1 1 45 45 ALA HB2 H 1 1.557 0.020 . 1 . . . A 329 ALA HB2 . 25740 1 493 . 1 1 45 45 ALA HB3 H 1 1.557 0.020 . 1 . . . A 329 ALA HB3 . 25740 1 494 . 1 1 45 45 ALA C C 13 179.243 0.400 . 1 . . . A 329 ALA C . 25740 1 495 . 1 1 45 45 ALA CA C 13 55.933 0.400 . 1 . . . A 329 ALA CA . 25740 1 496 . 1 1 45 45 ALA CB C 13 19.428 0.400 . 1 . . . A 329 ALA CB . 25740 1 497 . 1 1 45 45 ALA N N 15 121.237 0.400 . 1 . . . A 329 ALA N . 25740 1 498 . 1 1 46 46 LYS H H 1 7.876 0.020 . 1 . . . A 330 LYS H . 25740 1 499 . 1 1 46 46 LYS HA H 1 4.002 0.020 . 1 . . . A 330 LYS HA . 25740 1 500 . 1 1 46 46 LYS HB2 H 1 1.947 0.020 . 2 . . . A 330 LYS HB2 . 25740 1 501 . 1 1 46 46 LYS HB3 H 1 1.947 0.020 . 2 . . . A 330 LYS HB3 . 25740 1 502 . 1 1 46 46 LYS HG2 H 1 1.621 0.020 . 2 . . . A 330 LYS HG2 . 25740 1 503 . 1 1 46 46 LYS HG3 H 1 1.499 0.020 . 2 . . . A 330 LYS HG3 . 25740 1 504 . 1 1 46 46 LYS HD2 H 1 1.732 0.020 . 2 . . . A 330 LYS HD2 . 25740 1 505 . 1 1 46 46 LYS HD3 H 1 1.732 0.020 . 2 . . . A 330 LYS HD3 . 25740 1 506 . 1 1 46 46 LYS HE2 H 1 3.000 0.020 . 2 . . . A 330 LYS HE2 . 25740 1 507 . 1 1 46 46 LYS HE3 H 1 3.000 0.020 . 2 . . . A 330 LYS HE3 . 25740 1 508 . 1 1 46 46 LYS C C 13 178.390 0.400 . 1 . . . A 330 LYS C . 25740 1 509 . 1 1 46 46 LYS CA C 13 59.634 0.400 . 1 . . . A 330 LYS CA . 25740 1 510 . 1 1 46 46 LYS CB C 13 32.530 0.400 . 1 . . . A 330 LYS CB . 25740 1 511 . 1 1 46 46 LYS CG C 13 25.040 0.400 . 1 . . . A 330 LYS CG . 25740 1 512 . 1 1 46 46 LYS CD C 13 29.469 0.400 . 1 . . . A 330 LYS CD . 25740 1 513 . 1 1 46 46 LYS CE C 13 42.211 0.400 . 1 . . . A 330 LYS CE . 25740 1 514 . 1 1 46 46 LYS N N 15 116.644 0.400 . 1 . . . A 330 LYS N . 25740 1 515 . 1 1 47 47 TYR H H 1 7.557 0.020 . 1 . . . A 331 TYR H . 25740 1 516 . 1 1 47 47 TYR HA H 1 4.172 0.020 . 1 . . . A 331 TYR HA . 25740 1 517 . 1 1 47 47 TYR HB2 H 1 3.152 0.020 . 2 . . . A 331 TYR HB2 . 25740 1 518 . 1 1 47 47 TYR HB3 H 1 3.003 0.020 . 2 . . . A 331 TYR HB3 . 25740 1 519 . 1 1 47 47 TYR HD1 H 1 6.425 0.020 . 1 . . . A 331 TYR HD1 . 25740 1 520 . 1 1 47 47 TYR HD2 H 1 7.999 0.020 . 1 . . . A 331 TYR HD2 . 25740 1 521 . 1 1 47 47 TYR HE1 H 1 6.646 0.020 . 1 . . . A 331 TYR HE1 . 25740 1 522 . 1 1 47 47 TYR HE2 H 1 6.960 0.020 . 1 . . . A 331 TYR HE2 . 25740 1 523 . 1 1 47 47 TYR C C 13 177.952 0.400 . 1 . . . A 331 TYR C . 25740 1 524 . 1 1 47 47 TYR CA C 13 61.009 0.400 . 1 . . . A 331 TYR CA . 25740 1 525 . 1 1 47 47 TYR CB C 13 38.258 0.400 . 1 . . . A 331 TYR CB . 25740 1 526 . 1 1 47 47 TYR CD1 C 13 133.247 0.400 . 1 . . . A 331 TYR CD1 . 25740 1 527 . 1 1 47 47 TYR CD2 C 13 139.472 0.400 . 1 . . . A 331 TYR CD2 . 25740 1 528 . 1 1 47 47 TYR CE1 C 13 118.014 0.400 . 1 . . . A 331 TYR CE1 . 25740 1 529 . 1 1 47 47 TYR N N 15 119.783 0.400 . 1 . . . A 331 TYR N . 25740 1 530 . 1 1 48 48 HIS H H 1 8.215 0.020 . 1 . . . A 332 HIS H . 25740 1 531 . 1 1 48 48 HIS HA H 1 4.228 0.020 . 1 . . . A 332 HIS HA . 25740 1 532 . 1 1 48 48 HIS HB2 H 1 2.791 0.020 . 2 . . . A 332 HIS HB2 . 25740 1 533 . 1 1 48 48 HIS HB3 H 1 2.791 0.020 . 2 . . . A 332 HIS HB3 . 25740 1 534 . 1 1 48 48 HIS C C 13 179.155 0.400 . 1 . . . A 332 HIS C . 25740 1 535 . 1 1 48 48 HIS CA C 13 59.991 0.400 . 1 . . . A 332 HIS CA . 25740 1 536 . 1 1 48 48 HIS CB C 13 31.214 0.400 . 1 . . . A 332 HIS CB . 25740 1 537 . 1 1 48 48 HIS N N 15 116.793 0.400 . 1 . . . A 332 HIS N . 25740 1 538 . 1 1 49 49 MET H H 1 8.967 0.020 . 1 . . . A 333 MET H . 25740 1 539 . 1 1 49 49 MET HA H 1 4.415 0.020 . 1 . . . A 333 MET HA . 25740 1 540 . 1 1 49 49 MET HB2 H 1 2.235 0.020 . 2 . . . A 333 MET HB2 . 25740 1 541 . 1 1 49 49 MET HB3 H 1 2.086 0.020 . 2 . . . A 333 MET HB3 . 25740 1 542 . 1 1 49 49 MET HG2 H 1 2.578 0.020 . 2 . . . A 333 MET HG2 . 25740 1 543 . 1 1 49 49 MET HG3 H 1 2.578 0.020 . 2 . . . A 333 MET HG3 . 25740 1 544 . 1 1 49 49 MET HE1 H 1 2.089 0.020 . 1 . . . A 333 MET HE1 . 25740 1 545 . 1 1 49 49 MET HE2 H 1 2.089 0.020 . 1 . . . A 333 MET HE2 . 25740 1 546 . 1 1 49 49 MET HE3 H 1 2.089 0.020 . 1 . . . A 333 MET HE3 . 25740 1 547 . 1 1 49 49 MET C C 13 178.846 0.400 . 1 . . . A 333 MET C . 25740 1 548 . 1 1 49 49 MET CA C 13 58.202 0.400 . 1 . . . A 333 MET CA . 25740 1 549 . 1 1 49 49 MET CB C 13 31.228 0.400 . 1 . . . A 333 MET CB . 25740 1 550 . 1 1 49 49 MET CG C 13 32.145 0.400 . 1 . . . A 333 MET CG . 25740 1 551 . 1 1 49 49 MET CE C 13 16.911 0.400 . 1 . . . A 333 MET CE . 25740 1 552 . 1 1 49 49 MET N N 15 118.382 0.400 . 1 . . . A 333 MET N . 25740 1 553 . 1 1 50 50 GLN H H 1 8.243 0.020 . 1 . . . A 334 GLN H . 25740 1 554 . 1 1 50 50 GLN HA H 1 3.923 0.020 . 1 . . . A 334 GLN HA . 25740 1 555 . 1 1 50 50 GLN HB2 H 1 2.154 0.020 . 2 . . . A 334 GLN HB2 . 25740 1 556 . 1 1 50 50 GLN HB3 H 1 2.154 0.020 . 2 . . . A 334 GLN HB3 . 25740 1 557 . 1 1 50 50 GLN HG2 H 1 2.476 0.020 . 2 . . . A 334 GLN HG2 . 25740 1 558 . 1 1 50 50 GLN HG3 H 1 2.367 0.020 . 2 . . . A 334 GLN HG3 . 25740 1 559 . 1 1 50 50 GLN HE21 H 1 7.996 0.020 . 2 . . . A 334 GLN HE21 . 25740 1 560 . 1 1 50 50 GLN HE22 H 1 6.829 0.020 . 2 . . . A 334 GLN HE22 . 25740 1 561 . 1 1 50 50 GLN C C 13 178.366 0.400 . 1 . . . A 334 GLN C . 25740 1 562 . 1 1 50 50 GLN CA C 13 58.777 0.400 . 1 . . . A 334 GLN CA . 25740 1 563 . 1 1 50 50 GLN CB C 13 27.854 0.400 . 1 . . . A 334 GLN CB . 25740 1 564 . 1 1 50 50 GLN CG C 13 33.575 0.400 . 1 . . . A 334 GLN CG . 25740 1 565 . 1 1 50 50 GLN N N 15 118.773 0.400 . 1 . . . A 334 GLN N . 25740 1 566 . 1 1 50 50 GLN NE2 N 15 115.257 0.400 . 1 . . . A 334 GLN NE2 . 25740 1 567 . 1 1 51 51 ARG H H 1 7.171 0.020 . 1 . . . A 335 ARG H . 25740 1 568 . 1 1 51 51 ARG HA H 1 3.993 0.020 . 1 . . . A 335 ARG HA . 25740 1 569 . 1 1 51 51 ARG HB2 H 1 1.766 0.020 . 2 . . . A 335 ARG HB2 . 25740 1 570 . 1 1 51 51 ARG HB3 H 1 1.766 0.020 . 2 . . . A 335 ARG HB3 . 25740 1 571 . 1 1 51 51 ARG HG2 H 1 1.541 0.020 . 2 . . . A 335 ARG HG2 . 25740 1 572 . 1 1 51 51 ARG HG3 H 1 1.312 0.020 . 2 . . . A 335 ARG HG3 . 25740 1 573 . 1 1 51 51 ARG HD2 H 1 2.703 0.020 . 2 . . . A 335 ARG HD2 . 25740 1 574 . 1 1 51 51 ARG HD3 H 1 2.703 0.020 . 2 . . . A 335 ARG HD3 . 25740 1 575 . 1 1 51 51 ARG C C 13 180.309 0.400 . 1 . . . A 335 ARG C . 25740 1 576 . 1 1 51 51 ARG CA C 13 59.572 0.400 . 1 . . . A 335 ARG CA . 25740 1 577 . 1 1 51 51 ARG CB C 13 30.014 0.400 . 1 . . . A 335 ARG CB . 25740 1 578 . 1 1 51 51 ARG CD C 13 42.868 0.400 . 1 . . . A 335 ARG CD . 25740 1 579 . 1 1 51 51 ARG N N 15 118.007 0.400 . 1 . . . A 335 ARG N . 25740 1 580 . 1 1 52 52 CYS H H 1 8.413 0.020 . 1 . . . A 336 CYS H . 25740 1 581 . 1 1 52 52 CYS HA H 1 3.986 0.020 . 1 . . . A 336 CYS HA . 25740 1 582 . 1 1 52 52 CYS HB2 H 1 2.778 0.020 . 2 . . . A 336 CYS HB2 . 25740 1 583 . 1 1 52 52 CYS HB3 H 1 3.628 0.020 . 2 . . . A 336 CYS HB3 . 25740 1 584 . 1 1 52 52 CYS C C 13 176.477 0.400 . 1 . . . A 336 CYS C . 25740 1 585 . 1 1 52 52 CYS CA C 13 65.132 0.400 . 1 . . . A 336 CYS CA . 25740 1 586 . 1 1 52 52 CYS CB C 13 26.911 0.400 . 1 . . . A 336 CYS CB . 25740 1 587 . 1 1 52 52 CYS N N 15 120.801 0.400 . 1 . . . A 336 CYS N . 25740 1 588 . 1 1 53 53 ILE H H 1 8.384 0.020 . 1 . . . A 337 ILE H . 25740 1 589 . 1 1 53 53 ILE HA H 1 4.245 0.020 . 1 . . . A 337 ILE HA . 25740 1 590 . 1 1 53 53 ILE HB H 1 1.934 0.020 . 1 . . . A 337 ILE HB . 25740 1 591 . 1 1 53 53 ILE HG12 H 1 1.021 0.020 . 2 . . . A 337 ILE HG12 . 25740 1 592 . 1 1 53 53 ILE HG13 H 1 1.021 0.020 . 2 . . . A 337 ILE HG13 . 25740 1 593 . 1 1 53 53 ILE HG21 H 1 0.972 0.020 . 1 . . . A 337 ILE HG21 . 25740 1 594 . 1 1 53 53 ILE HG22 H 1 0.972 0.020 . 1 . . . A 337 ILE HG22 . 25740 1 595 . 1 1 53 53 ILE HG23 H 1 0.972 0.020 . 1 . . . A 337 ILE HG23 . 25740 1 596 . 1 1 53 53 ILE HD11 H 1 0.823 0.020 . 1 . . . A 337 ILE HD11 . 25740 1 597 . 1 1 53 53 ILE HD12 H 1 0.823 0.020 . 1 . . . A 337 ILE HD12 . 25740 1 598 . 1 1 53 53 ILE HD13 H 1 0.823 0.020 . 1 . . . A 337 ILE HD13 . 25740 1 599 . 1 1 53 53 ILE C C 13 180.573 0.400 . 1 . . . A 337 ILE C . 25740 1 600 . 1 1 53 53 ILE CA C 13 64.660 0.400 . 1 . . . A 337 ILE CA . 25740 1 601 . 1 1 53 53 ILE CB C 13 38.682 0.400 . 1 . . . A 337 ILE CB . 25740 1 602 . 1 1 53 53 ILE CG1 C 13 29.716 0.400 . 1 . . . A 337 ILE CG1 . 25740 1 603 . 1 1 53 53 ILE CG2 C 13 16.986 0.400 . 1 . . . A 337 ILE CG2 . 25740 1 604 . 1 1 53 53 ILE CD1 C 13 13.638 0.400 . 1 . . . A 337 ILE CD1 . 25740 1 605 . 1 1 53 53 ILE N N 15 122.594 0.400 . 1 . . . A 337 ILE N . 25740 1 606 . 1 1 54 54 ASP H H 1 9.059 0.020 . 1 . . . A 338 ASP H . 25740 1 607 . 1 1 54 54 ASP HA H 1 4.446 0.020 . 1 . . . A 338 ASP HA . 25740 1 608 . 1 1 54 54 ASP HB2 H 1 2.736 0.020 . 2 . . . A 338 ASP HB2 . 25740 1 609 . 1 1 54 54 ASP HB3 H 1 2.545 0.020 . 2 . . . A 338 ASP HB3 . 25740 1 610 . 1 1 54 54 ASP C C 13 178.176 0.400 . 1 . . . A 338 ASP C . 25740 1 611 . 1 1 54 54 ASP CA C 13 57.438 0.400 . 1 . . . A 338 ASP CA . 25740 1 612 . 1 1 54 54 ASP CB C 13 40.648 0.400 . 1 . . . A 338 ASP CB . 25740 1 613 . 1 1 54 54 ASP N N 15 121.683 0.400 . 1 . . . A 338 ASP N . 25740 1 614 . 1 1 55 55 SER H H 1 7.755 0.020 . 1 . . . A 339 SER H . 25740 1 615 . 1 1 55 55 SER HA H 1 4.584 0.020 . 1 . . . A 339 SER HA . 25740 1 616 . 1 1 55 55 SER HB2 H 1 3.716 0.020 . 2 . . . A 339 SER HB2 . 25740 1 617 . 1 1 55 55 SER HB3 H 1 3.639 0.020 . 2 . . . A 339 SER HB3 . 25740 1 618 . 1 1 55 55 SER C C 13 174.949 0.400 . 1 . . . A 339 SER C . 25740 1 619 . 1 1 55 55 SER CA C 13 58.648 0.400 . 1 . . . A 339 SER CA . 25740 1 620 . 1 1 55 55 SER CB C 13 65.489 0.400 . 1 . . . A 339 SER CB . 25740 1 621 . 1 1 55 55 SER N N 15 110.406 0.400 . 1 . . . A 339 SER N . 25740 1 622 . 1 1 56 56 GLY H H 1 7.728 0.020 . 1 . . . A 340 GLY H . 25740 1 623 . 1 1 56 56 GLY HA2 H 1 4.202 0.020 . 2 . . . A 340 GLY HA2 . 25740 1 624 . 1 1 56 56 GLY HA3 H 1 3.786 0.020 . 2 . . . A 340 GLY HA3 . 25740 1 625 . 1 1 56 56 GLY C C 13 173.630 0.400 . 1 . . . A 340 GLY C . 25740 1 626 . 1 1 56 56 GLY CA C 13 45.450 0.400 . 1 . . . A 340 GLY CA . 25740 1 627 . 1 1 56 56 GLY N N 15 110.203 0.400 . 1 . . . A 340 GLY N . 25740 1 628 . 1 1 57 57 LEU H H 1 8.034 0.020 . 1 . . . A 341 LEU H . 25740 1 629 . 1 1 57 57 LEU HA H 1 4.115 0.020 . 1 . . . A 341 LEU HA . 25740 1 630 . 1 1 57 57 LEU HB2 H 1 1.505 0.020 . 2 . . . A 341 LEU HB2 . 25740 1 631 . 1 1 57 57 LEU HB3 H 1 1.403 0.020 . 2 . . . A 341 LEU HB3 . 25740 1 632 . 1 1 57 57 LEU HG H 1 1.426 0.020 . 1 . . . A 341 LEU HG . 25740 1 633 . 1 1 57 57 LEU HD11 H 1 0.722 0.020 . 2 . . . A 341 LEU HD11 . 25740 1 634 . 1 1 57 57 LEU HD12 H 1 0.722 0.020 . 2 . . . A 341 LEU HD12 . 25740 1 635 . 1 1 57 57 LEU HD13 H 1 0.722 0.020 . 2 . . . A 341 LEU HD13 . 25740 1 636 . 1 1 57 57 LEU HD21 H 1 0.667 0.020 . 2 . . . A 341 LEU HD21 . 25740 1 637 . 1 1 57 57 LEU HD22 H 1 0.667 0.020 . 2 . . . A 341 LEU HD22 . 25740 1 638 . 1 1 57 57 LEU HD23 H 1 0.667 0.020 . 2 . . . A 341 LEU HD23 . 25740 1 639 . 1 1 57 57 LEU C C 13 176.398 0.400 . 1 . . . A 341 LEU C . 25740 1 640 . 1 1 57 57 LEU CA C 13 57.189 0.400 . 1 . . . A 341 LEU CA . 25740 1 641 . 1 1 57 57 LEU CB C 13 43.075 0.400 . 1 . . . A 341 LEU CB . 25740 1 642 . 1 1 57 57 LEU CG C 13 26.831 0.400 . 1 . . . A 341 LEU CG . 25740 1 643 . 1 1 57 57 LEU CD1 C 13 24.542 0.400 . 1 . . . A 341 LEU CD1 . 25740 1 644 . 1 1 57 57 LEU CD2 C 13 24.935 0.400 . 1 . . . A 341 LEU CD2 . 25740 1 645 . 1 1 57 57 LEU N N 15 122.062 0.400 . 1 . . . A 341 LEU N . 25740 1 646 . 1 1 58 58 TRP H H 1 7.433 0.020 . 1 . . . A 342 TRP H . 25740 1 647 . 1 1 58 58 TRP HA H 1 4.964 0.020 . 1 . . . A 342 TRP HA . 25740 1 648 . 1 1 58 58 TRP HB2 H 1 3.023 0.020 . 2 . . . A 342 TRP HB2 . 25740 1 649 . 1 1 58 58 TRP HB3 H 1 2.947 0.020 . 2 . . . A 342 TRP HB3 . 25740 1 650 . 1 1 58 58 TRP HD1 H 1 7.132 0.020 . 1 . . . A 342 TRP HD1 . 25740 1 651 . 1 1 58 58 TRP HE1 H 1 10.195 0.020 . 1 . . . A 342 TRP HE1 . 25740 1 652 . 1 1 58 58 TRP HE3 H 1 7.484 0.020 . 1 . . . A 342 TRP HE3 . 25740 1 653 . 1 1 58 58 TRP HZ2 H 1 7.348 0.020 . 1 . . . A 342 TRP HZ2 . 25740 1 654 . 1 1 58 58 TRP HZ3 H 1 6.921 0.020 . 1 . . . A 342 TRP HZ3 . 25740 1 655 . 1 1 58 58 TRP HH2 H 1 7.038 0.020 . 1 . . . A 342 TRP HH2 . 25740 1 656 . 1 1 58 58 TRP C C 13 173.573 0.400 . 1 . . . A 342 TRP C . 25740 1 657 . 1 1 58 58 TRP CA C 13 55.522 0.400 . 1 . . . A 342 TRP CA . 25740 1 658 . 1 1 58 58 TRP CB C 13 32.786 0.400 . 1 . . . A 342 TRP CB . 25740 1 659 . 1 1 58 58 TRP CD1 C 13 125.791 0.400 . 1 . . . A 342 TRP CD1 . 25740 1 660 . 1 1 58 58 TRP CE3 C 13 120.547 0.400 . 1 . . . A 342 TRP CE3 . 25740 1 661 . 1 1 58 58 TRP CZ2 C 13 114.178 0.400 . 1 . . . A 342 TRP CZ2 . 25740 1 662 . 1 1 58 58 TRP CZ3 C 13 121.359 0.400 . 1 . . . A 342 TRP CZ3 . 25740 1 663 . 1 1 58 58 TRP CH2 C 13 124.197 0.400 . 1 . . . A 342 TRP CH2 . 25740 1 664 . 1 1 58 58 TRP N N 15 116.259 0.400 . 1 . . . A 342 TRP N . 25740 1 665 . 1 1 58 58 TRP NE1 N 15 129.132 0.400 . 1 . . . A 342 TRP NE1 . 25740 1 666 . 1 1 59 59 VAL H H 1 7.896 0.020 . 1 . . . A 343 VAL H . 25740 1 667 . 1 1 59 59 VAL HA H 1 4.218 0.020 . 1 . . . A 343 VAL HA . 25740 1 668 . 1 1 59 59 VAL HB H 1 1.894 0.020 . 1 . . . A 343 VAL HB . 25740 1 669 . 1 1 59 59 VAL HG11 H 1 0.823 0.020 . 2 . . . A 343 VAL HG11 . 25740 1 670 . 1 1 59 59 VAL HG12 H 1 0.823 0.020 . 2 . . . A 343 VAL HG12 . 25740 1 671 . 1 1 59 59 VAL HG13 H 1 0.823 0.020 . 2 . . . A 343 VAL HG13 . 25740 1 672 . 1 1 59 59 VAL HG21 H 1 0.831 0.020 . 2 . . . A 343 VAL HG21 . 25740 1 673 . 1 1 59 59 VAL HG22 H 1 0.831 0.020 . 2 . . . A 343 VAL HG22 . 25740 1 674 . 1 1 59 59 VAL HG23 H 1 0.831 0.020 . 2 . . . A 343 VAL HG23 . 25740 1 675 . 1 1 59 59 VAL CG1 C 13 21.135 0.400 . 1 . . . A 343 VAL CG1 . 25740 1 676 . 1 1 59 59 VAL CG2 C 13 20.239 0.400 . 1 . . . A 343 VAL CG2 . 25740 1 677 . 1 1 59 59 VAL N N 15 126.451 0.400 . 1 . . . A 343 VAL N . 25740 1 678 . 1 1 60 60 PRO HD2 H 1 3.172 0.020 . 2 . . . A 344 PRO HD2 . 25740 1 679 . 1 1 60 60 PRO HD3 H 1 3.461 0.020 . 2 . . . A 344 PRO HD3 . 25740 1 680 . 1 1 60 60 PRO CD C 13 50.546 0.400 . 1 . . . A 344 PRO CD . 25740 1 681 . 1 1 61 61 ASN HA H 1 4.646 0.020 . 1 . . . A 345 ASN HA . 25740 1 682 . 1 1 61 61 ASN HB2 H 1 2.810 0.020 . 2 . . . A 345 ASN HB2 . 25740 1 683 . 1 1 61 61 ASN HB3 H 1 2.767 0.020 . 2 . . . A 345 ASN HB3 . 25740 1 684 . 1 1 61 61 ASN HD21 H 1 7.602 0.020 . 2 . . . A 345 ASN HD21 . 25740 1 685 . 1 1 61 61 ASN HD22 H 1 6.896 0.020 . 2 . . . A 345 ASN HD22 . 25740 1 686 . 1 1 61 61 ASN CA C 13 53.794 0.400 . 1 . . . A 345 ASN CA . 25740 1 687 . 1 1 61 61 ASN CB C 13 38.725 0.400 . 1 . . . A 345 ASN CB . 25740 1 688 . 1 1 61 61 ASN ND2 N 15 112.543 0.400 . 1 . . . A 345 ASN ND2 . 25740 1 689 . 1 1 64 64 ALA H H 1 8.637 0.020 . 1 . . . A 348 ALA H . 25740 1 690 . 1 1 64 64 ALA HA H 1 4.320 0.020 . 1 . . . A 348 ALA HA . 25740 1 691 . 1 1 64 64 ALA HB1 H 1 1.422 0.020 . 1 . . . A 348 ALA HB1 . 25740 1 692 . 1 1 64 64 ALA HB2 H 1 1.422 0.020 . 1 . . . A 348 ALA HB2 . 25740 1 693 . 1 1 64 64 ALA HB3 H 1 1.422 0.020 . 1 . . . A 348 ALA HB3 . 25740 1 694 . 1 1 64 64 ALA C C 13 178.059 0.400 . 1 . . . A 348 ALA C . 25740 1 695 . 1 1 64 64 ALA CA C 13 52.867 0.400 . 1 . . . A 348 ALA CA . 25740 1 696 . 1 1 64 64 ALA CB C 13 19.128 0.400 . 1 . . . A 348 ALA CB . 25740 1 697 . 1 1 64 64 ALA N N 15 124.716 0.400 . 1 . . . A 348 ALA N . 25740 1 698 . 1 1 65 65 SER H H 1 8.229 0.020 . 1 . . . A 349 SER H . 25740 1 699 . 1 1 65 65 SER HA H 1 4.426 0.020 . 1 . . . A 349 SER HA . 25740 1 700 . 1 1 65 65 SER HB2 H 1 3.887 0.020 . 2 . . . A 349 SER HB2 . 25740 1 701 . 1 1 65 65 SER HB3 H 1 3.887 0.020 . 2 . . . A 349 SER HB3 . 25740 1 702 . 1 1 65 65 SER C C 13 174.628 0.400 . 1 . . . A 349 SER C . 25740 1 703 . 1 1 65 65 SER CA C 13 58.569 0.400 . 1 . . . A 349 SER CA . 25740 1 704 . 1 1 65 65 SER CB C 13 63.827 0.400 . 1 . . . A 349 SER CB . 25740 1 705 . 1 1 65 65 SER N N 15 114.746 0.400 . 1 . . . A 349 SER N . 25740 1 706 . 1 1 66 66 GLU H H 1 8.308 0.020 . 1 . . . A 350 GLU H . 25740 1 707 . 1 1 66 66 GLU HA H 1 4.314 0.020 . 1 . . . A 350 GLU HA . 25740 1 708 . 1 1 66 66 GLU HB2 H 1 2.077 0.020 . 2 . . . A 350 GLU HB2 . 25740 1 709 . 1 1 66 66 GLU HB3 H 1 1.934 0.020 . 2 . . . A 350 GLU HB3 . 25740 1 710 . 1 1 66 66 GLU HG2 H 1 2.265 0.020 . 2 . . . A 350 GLU HG2 . 25740 1 711 . 1 1 66 66 GLU HG3 H 1 2.265 0.020 . 2 . . . A 350 GLU HG3 . 25740 1 712 . 1 1 66 66 GLU C C 13 176.101 0.400 . 1 . . . A 350 GLU C . 25740 1 713 . 1 1 66 66 GLU CA C 13 56.415 0.400 . 1 . . . A 350 GLU CA . 25740 1 714 . 1 1 66 66 GLU CB C 13 30.314 0.400 . 1 . . . A 350 GLU CB . 25740 1 715 . 1 1 66 66 GLU CG C 13 36.319 0.400 . 1 . . . A 350 GLU CG . 25740 1 716 . 1 1 66 66 GLU N N 15 122.713 0.400 . 1 . . . A 350 GLU N . 25740 1 717 . 1 1 67 67 ALA H H 1 8.217 0.020 . 1 . . . A 351 ALA H . 25740 1 718 . 1 1 67 67 ALA HA H 1 4.303 0.020 . 1 . . . A 351 ALA HA . 25740 1 719 . 1 1 67 67 ALA HB1 H 1 1.379 0.020 . 1 . . . A 351 ALA HB1 . 25740 1 720 . 1 1 67 67 ALA HB2 H 1 1.379 0.020 . 1 . . . A 351 ALA HB2 . 25740 1 721 . 1 1 67 67 ALA HB3 H 1 1.379 0.020 . 1 . . . A 351 ALA HB3 . 25740 1 722 . 1 1 67 67 ALA C C 13 177.536 0.400 . 1 . . . A 351 ALA C . 25740 1 723 . 1 1 67 67 ALA CA C 13 52.389 0.400 . 1 . . . A 351 ALA CA . 25740 1 724 . 1 1 67 67 ALA CB C 13 19.258 0.400 . 1 . . . A 351 ALA CB . 25740 1 725 . 1 1 67 67 ALA N N 15 125.143 0.400 . 1 . . . A 351 ALA N . 25740 1 726 . 1 1 68 68 LYS H H 1 8.322 0.020 . 1 . . . A 352 LYS H . 25740 1 727 . 1 1 68 68 LYS HA H 1 4.339 0.020 . 1 . . . A 352 LYS HA . 25740 1 728 . 1 1 68 68 LYS HB2 H 1 1.739 0.020 . 2 . . . A 352 LYS HB2 . 25740 1 729 . 1 1 68 68 LYS HB3 H 1 1.739 0.020 . 2 . . . A 352 LYS HB3 . 25740 1 730 . 1 1 68 68 LYS HG2 H 1 1.438 0.020 . 2 . . . A 352 LYS HG2 . 25740 1 731 . 1 1 68 68 LYS HG3 H 1 1.438 0.020 . 2 . . . A 352 LYS HG3 . 25740 1 732 . 1 1 68 68 LYS HD2 H 1 1.689 0.020 . 2 . . . A 352 LYS HD2 . 25740 1 733 . 1 1 68 68 LYS HD3 H 1 1.689 0.020 . 2 . . . A 352 LYS HD3 . 25740 1 734 . 1 1 68 68 LYS HE2 H 1 3.023 0.020 . 2 . . . A 352 LYS HE2 . 25740 1 735 . 1 1 68 68 LYS HE3 H 1 3.023 0.020 . 2 . . . A 352 LYS HE3 . 25740 1 736 . 1 1 68 68 LYS C C 13 176.588 0.400 . 1 . . . A 352 LYS C . 25740 1 737 . 1 1 68 68 LYS CA C 13 56.052 0.400 . 1 . . . A 352 LYS CA . 25740 1 738 . 1 1 68 68 LYS CB C 13 33.241 0.400 . 1 . . . A 352 LYS CB . 25740 1 739 . 1 1 68 68 LYS CG C 13 24.606 0.400 . 1 . . . A 352 LYS CG . 25740 1 740 . 1 1 68 68 LYS CD C 13 29.076 0.400 . 1 . . . A 352 LYS CD . 25740 1 741 . 1 1 68 68 LYS CE C 13 42.178 0.400 . 1 . . . A 352 LYS CE . 25740 1 742 . 1 1 68 68 LYS N N 15 121.415 0.400 . 1 . . . A 352 LYS N . 25740 1 743 . 1 1 69 69 GLU H H 1 8.489 0.020 . 1 . . . A 353 GLU H . 25740 1 744 . 1 1 69 69 GLU HA H 1 4.277 0.020 . 1 . . . A 353 GLU HA . 25740 1 745 . 1 1 69 69 GLU HB2 H 1 2.016 0.020 . 2 . . . A 353 GLU HB2 . 25740 1 746 . 1 1 69 69 GLU HB3 H 1 1.974 0.020 . 2 . . . A 353 GLU HB3 . 25740 1 747 . 1 1 69 69 GLU HG2 H 1 2.269 0.020 . 2 . . . A 353 GLU HG2 . 25740 1 748 . 1 1 69 69 GLU HG3 H 1 2.269 0.020 . 2 . . . A 353 GLU HG3 . 25740 1 749 . 1 1 69 69 GLU C C 13 177.075 0.400 . 1 . . . A 353 GLU C . 25740 1 750 . 1 1 69 69 GLU CA C 13 56.934 0.400 . 1 . . . A 353 GLU CA . 25740 1 751 . 1 1 69 69 GLU CB C 13 30.224 0.400 . 1 . . . A 353 GLU CB . 25740 1 752 . 1 1 69 69 GLU CG C 13 36.237 0.400 . 1 . . . A 353 GLU CG . 25740 1 753 . 1 1 69 69 GLU N N 15 122.517 0.400 . 1 . . . A 353 GLU N . 25740 1 754 . 1 1 70 70 GLY H H 1 8.515 0.020 . 1 . . . A 354 GLY H . 25740 1 755 . 1 1 70 70 GLY HA2 H 1 4.009 0.020 . 2 . . . A 354 GLY HA2 . 25740 1 756 . 1 1 70 70 GLY HA3 H 1 3.954 0.020 . 2 . . . A 354 GLY HA3 . 25740 1 757 . 1 1 70 70 GLY C C 13 174.220 0.400 . 1 . . . A 354 GLY C . 25740 1 758 . 1 1 70 70 GLY CA C 13 45.345 0.400 . 1 . . . A 354 GLY CA . 25740 1 759 . 1 1 70 70 GLY N N 15 110.658 0.400 . 1 . . . A 354 GLY N . 25740 1 760 . 1 1 71 71 GLU H H 1 8.181 0.020 . 1 . . . A 355 GLU H . 25740 1 761 . 1 1 71 71 GLU HA H 1 4.324 0.020 . 1 . . . A 355 GLU HA . 25740 1 762 . 1 1 71 71 GLU HB2 H 1 2.066 0.020 . 2 . . . A 355 GLU HB2 . 25740 1 763 . 1 1 71 71 GLU HB3 H 1 1.925 0.020 . 2 . . . A 355 GLU HB3 . 25740 1 764 . 1 1 71 71 GLU HG2 H 1 2.233 0.020 . 2 . . . A 355 GLU HG2 . 25740 1 765 . 1 1 71 71 GLU HG3 H 1 2.233 0.020 . 2 . . . A 355 GLU HG3 . 25740 1 766 . 1 1 71 71 GLU C C 13 176.604 0.400 . 1 . . . A 355 GLU C . 25740 1 767 . 1 1 71 71 GLU CA C 13 56.393 0.400 . 1 . . . A 355 GLU CA . 25740 1 768 . 1 1 71 71 GLU CB C 13 30.469 0.400 . 1 . . . A 355 GLU CB . 25740 1 769 . 1 1 71 71 GLU CG C 13 36.334 0.400 . 1 . . . A 355 GLU CG . 25740 1 770 . 1 1 71 71 GLU N N 15 120.448 0.400 . 1 . . . A 355 GLU N . 25740 1 771 . 1 1 72 72 GLU H H 1 8.526 0.020 . 1 . . . A 356 GLU H . 25740 1 772 . 1 1 72 72 GLU HA H 1 4.274 0.020 . 1 . . . A 356 GLU HA . 25740 1 773 . 1 1 72 72 GLU HB2 H 1 2.061 0.020 . 2 . . . A 356 GLU HB2 . 25740 1 774 . 1 1 72 72 GLU HB3 H 1 1.942 0.020 . 2 . . . A 356 GLU HB3 . 25740 1 775 . 1 1 72 72 GLU HG2 H 1 2.266 0.020 . 2 . . . A 356 GLU HG2 . 25740 1 776 . 1 1 72 72 GLU HG3 H 1 2.266 0.020 . 2 . . . A 356 GLU HG3 . 25740 1 777 . 1 1 72 72 GLU C C 13 176.172 0.400 . 1 . . . A 356 GLU C . 25740 1 778 . 1 1 72 72 GLU CA C 13 56.549 0.400 . 1 . . . A 356 GLU CA . 25740 1 779 . 1 1 72 72 GLU CB C 13 30.260 0.400 . 1 . . . A 356 GLU CB . 25740 1 780 . 1 1 72 72 GLU CG C 13 36.234 0.400 . 1 . . . A 356 GLU CG . 25740 1 781 . 1 1 72 72 GLU N N 15 122.099 0.400 . 1 . . . A 356 GLU N . 25740 1 782 . 1 1 73 73 ALA H H 1 8.345 0.020 . 1 . . . A 357 ALA H . 25740 1 783 . 1 1 73 73 ALA HA H 1 4.370 0.020 . 1 . . . A 357 ALA HA . 25740 1 784 . 1 1 73 73 ALA HB1 H 1 1.408 0.020 . 1 . . . A 357 ALA HB1 . 25740 1 785 . 1 1 73 73 ALA HB2 H 1 1.408 0.020 . 1 . . . A 357 ALA HB2 . 25740 1 786 . 1 1 73 73 ALA HB3 H 1 1.408 0.020 . 1 . . . A 357 ALA HB3 . 25740 1 787 . 1 1 73 73 ALA C C 13 177.938 0.400 . 1 . . . A 357 ALA C . 25740 1 788 . 1 1 73 73 ALA CA C 13 52.506 0.400 . 1 . . . A 357 ALA CA . 25740 1 789 . 1 1 73 73 ALA CB C 13 19.585 0.400 . 1 . . . A 357 ALA CB . 25740 1 790 . 1 1 73 73 ALA N N 15 125.548 0.400 . 1 . . . A 357 ALA N . 25740 1 791 . 1 1 74 74 GLY H H 1 8.262 0.020 . 1 . . . A 358 GLY H . 25740 1 792 . 1 1 74 74 GLY HA2 H 1 4.209 0.020 . 2 . . . A 358 GLY HA2 . 25740 1 793 . 1 1 74 74 GLY HA3 H 1 4.209 0.020 . 2 . . . A 358 GLY HA3 . 25740 1 794 . 1 1 74 74 GLY CA C 13 44.729 0.400 . 1 . . . A 358 GLY CA . 25740 1 795 . 1 1 74 74 GLY N N 15 108.542 0.400 . 1 . . . A 358 GLY N . 25740 1 796 . 1 1 75 75 PRO HA H 1 4.438 0.020 . 1 . . . A 359 PRO HA . 25740 1 797 . 1 1 75 75 PRO HB2 H 1 2.290 0.020 . 2 . . . A 359 PRO HB2 . 25740 1 798 . 1 1 75 75 PRO HB3 H 1 2.290 0.020 . 2 . . . A 359 PRO HB3 . 25740 1 799 . 1 1 75 75 PRO HG2 H 1 2.018 0.020 . 2 . . . A 359 PRO HG2 . 25740 1 800 . 1 1 75 75 PRO HG3 H 1 2.018 0.020 . 2 . . . A 359 PRO HG3 . 25740 1 801 . 1 1 75 75 PRO HD2 H 1 3.659 0.020 . 2 . . . A 359 PRO HD2 . 25740 1 802 . 1 1 75 75 PRO HD3 H 1 3.659 0.020 . 2 . . . A 359 PRO HD3 . 25740 1 803 . 1 1 75 75 PRO C C 13 177.625 0.400 . 1 . . . A 359 PRO C . 25740 1 804 . 1 1 75 75 PRO CA C 13 63.793 0.400 . 1 . . . A 359 PRO CA . 25740 1 805 . 1 1 75 75 PRO CB C 13 32.217 0.400 . 1 . . . A 359 PRO CB . 25740 1 806 . 1 1 75 75 PRO CG C 13 27.129 0.400 . 1 . . . A 359 PRO CG . 25740 1 807 . 1 1 75 75 PRO CD C 13 49.732 0.400 . 1 . . . A 359 PRO CD . 25740 1 808 . 1 1 76 76 GLY H H 1 8.422 0.020 . 1 . . . A 360 GLY H . 25740 1 809 . 1 1 76 76 GLY HA2 H 1 3.923 0.020 . 2 . . . A 360 GLY HA2 . 25740 1 810 . 1 1 76 76 GLY HA3 H 1 3.923 0.020 . 2 . . . A 360 GLY HA3 . 25740 1 811 . 1 1 76 76 GLY C C 13 173.455 0.400 . 1 . . . A 360 GLY C . 25740 1 812 . 1 1 76 76 GLY CA C 13 44.893 0.400 . 1 . . . A 360 GLY CA . 25740 1 813 . 1 1 76 76 GLY N N 15 109.322 0.400 . 1 . . . A 360 GLY N . 25740 1 814 . 1 1 77 77 ASP H H 1 8.132 0.020 . 1 . . . A 361 ASP H . 25740 1 815 . 1 1 77 77 ASP HB2 H 1 2.540 0.020 . 2 . . . A 361 ASP HB2 . 25740 1 816 . 1 1 77 77 ASP HB3 H 1 2.540 0.020 . 2 . . . A 361 ASP HB3 . 25740 1 817 . 1 1 77 77 ASP N N 15 121.888 0.400 . 1 . . . A 361 ASP N . 25740 1 818 . 1 1 78 78 PRO HA H 1 4.399 0.020 . 1 . . . A 362 PRO HA . 25740 1 819 . 1 1 78 78 PRO HB2 H 1 2.294 0.020 . 2 . . . A 362 PRO HB2 . 25740 1 820 . 1 1 78 78 PRO HB3 H 1 2.294 0.020 . 2 . . . A 362 PRO HB3 . 25740 1 821 . 1 1 78 78 PRO HG2 H 1 2.012 0.020 . 2 . . . A 362 PRO HG2 . 25740 1 822 . 1 1 78 78 PRO HG3 H 1 1.910 0.020 . 2 . . . A 362 PRO HG3 . 25740 1 823 . 1 1 78 78 PRO HD2 H 1 3.840 0.020 . 2 . . . A 362 PRO HD2 . 25740 1 824 . 1 1 78 78 PRO HD3 H 1 3.840 0.020 . 2 . . . A 362 PRO HD3 . 25740 1 825 . 1 1 78 78 PRO C C 13 177.280 0.400 . 1 . . . A 362 PRO C . 25740 1 826 . 1 1 78 78 PRO CA C 13 63.756 0.400 . 1 . . . A 362 PRO CA . 25740 1 827 . 1 1 78 78 PRO CB C 13 32.219 0.400 . 1 . . . A 362 PRO CB . 25740 1 828 . 1 1 78 78 PRO CG C 13 27.248 0.400 . 1 . . . A 362 PRO CG . 25740 1 829 . 1 1 78 78 PRO CD C 13 50.928 0.400 . 1 . . . A 362 PRO CD . 25740 1 830 . 1 1 79 79 LEU H H 1 8.370 0.020 . 1 . . . A 363 LEU H . 25740 1 831 . 1 1 79 79 LEU HA H 1 4.284 0.020 . 1 . . . A 363 LEU HA . 25740 1 832 . 1 1 79 79 LEU HB2 H 1 1.595 0.020 . 2 . . . A 363 LEU HB2 . 25740 1 833 . 1 1 79 79 LEU HB3 H 1 1.595 0.020 . 2 . . . A 363 LEU HB3 . 25740 1 834 . 1 1 79 79 LEU HG H 1 1.643 0.020 . 1 . . . A 363 LEU HG . 25740 1 835 . 1 1 79 79 LEU HD11 H 1 0.889 0.020 . 2 . . . A 363 LEU HD11 . 25740 1 836 . 1 1 79 79 LEU HD12 H 1 0.889 0.020 . 2 . . . A 363 LEU HD12 . 25740 1 837 . 1 1 79 79 LEU HD13 H 1 0.889 0.020 . 2 . . . A 363 LEU HD13 . 25740 1 838 . 1 1 79 79 LEU HD21 H 1 0.853 0.020 . 2 . . . A 363 LEU HD21 . 25740 1 839 . 1 1 79 79 LEU HD22 H 1 0.853 0.020 . 2 . . . A 363 LEU HD22 . 25740 1 840 . 1 1 79 79 LEU HD23 H 1 0.853 0.020 . 2 . . . A 363 LEU HD23 . 25740 1 841 . 1 1 79 79 LEU C C 13 177.647 0.400 . 1 . . . A 363 LEU C . 25740 1 842 . 1 1 79 79 LEU CA C 13 55.500 0.400 . 1 . . . A 363 LEU CA . 25740 1 843 . 1 1 79 79 LEU CB C 13 41.776 0.400 . 1 . . . A 363 LEU CB . 25740 1 844 . 1 1 79 79 LEU CG C 13 27.156 0.400 . 1 . . . A 363 LEU CG . 25740 1 845 . 1 1 79 79 LEU CD1 C 13 25.023 0.400 . 1 . . . A 363 LEU CD1 . 25740 1 846 . 1 1 79 79 LEU CD2 C 13 23.465 0.400 . 1 . . . A 363 LEU CD2 . 25740 1 847 . 1 1 79 79 LEU N N 15 120.709 0.400 . 1 . . . A 363 LEU N . 25740 1 848 . 1 1 80 80 LEU H H 1 7.903 0.020 . 1 . . . A 364 LEU H . 25740 1 849 . 1 1 80 80 LEU HA H 1 4.340 0.020 . 1 . . . A 364 LEU HA . 25740 1 850 . 1 1 80 80 LEU HB2 H 1 1.621 0.020 . 2 . . . A 364 LEU HB2 . 25740 1 851 . 1 1 80 80 LEU HB3 H 1 1.621 0.020 . 2 . . . A 364 LEU HB3 . 25740 1 852 . 1 1 80 80 LEU HG H 1 1.630 0.020 . 1 . . . A 364 LEU HG . 25740 1 853 . 1 1 80 80 LEU HD11 H 1 0.927 0.020 . 2 . . . A 364 LEU HD11 . 25740 1 854 . 1 1 80 80 LEU HD12 H 1 0.927 0.020 . 2 . . . A 364 LEU HD12 . 25740 1 855 . 1 1 80 80 LEU HD13 H 1 0.927 0.020 . 2 . . . A 364 LEU HD13 . 25740 1 856 . 1 1 80 80 LEU HD21 H 1 0.878 0.020 . 2 . . . A 364 LEU HD21 . 25740 1 857 . 1 1 80 80 LEU HD22 H 1 0.878 0.020 . 2 . . . A 364 LEU HD22 . 25740 1 858 . 1 1 80 80 LEU HD23 H 1 0.878 0.020 . 2 . . . A 364 LEU HD23 . 25740 1 859 . 1 1 80 80 LEU C C 13 177.360 0.400 . 1 . . . A 364 LEU C . 25740 1 860 . 1 1 80 80 LEU CA C 13 55.198 0.400 . 1 . . . A 364 LEU CA . 25740 1 861 . 1 1 80 80 LEU CB C 13 42.367 0.400 . 1 . . . A 364 LEU CB . 25740 1 862 . 1 1 80 80 LEU CG C 13 26.940 0.400 . 1 . . . A 364 LEU CG . 25740 1 863 . 1 1 80 80 LEU CD1 C 13 25.033 0.400 . 1 . . . A 364 LEU CD1 . 25740 1 864 . 1 1 80 80 LEU CD2 C 13 23.490 0.400 . 1 . . . A 364 LEU CD2 . 25740 1 865 . 1 1 80 80 LEU N N 15 121.784 0.400 . 1 . . . A 364 LEU N . 25740 1 866 . 1 1 81 81 GLU H H 1 8.104 0.020 . 1 . . . A 365 GLU H . 25740 1 867 . 1 1 81 81 GLU HA H 1 4.270 0.020 . 1 . . . A 365 GLU HA . 25740 1 868 . 1 1 81 81 GLU HB2 H 1 2.046 0.020 . 2 . . . A 365 GLU HB2 . 25740 1 869 . 1 1 81 81 GLU HB3 H 1 1.903 0.020 . 2 . . . A 365 GLU HB3 . 25740 1 870 . 1 1 81 81 GLU HG2 H 1 2.242 0.020 . 2 . . . A 365 GLU HG2 . 25740 1 871 . 1 1 81 81 GLU HG3 H 1 2.242 0.020 . 2 . . . A 365 GLU HG3 . 25740 1 872 . 1 1 81 81 GLU C C 13 175.954 0.400 . 1 . . . A 365 GLU C . 25740 1 873 . 1 1 81 81 GLU CA C 13 56.486 0.400 . 1 . . . A 365 GLU CA . 25740 1 874 . 1 1 81 81 GLU CB C 13 30.425 0.400 . 1 . . . A 365 GLU CB . 25740 1 875 . 1 1 81 81 GLU CG C 13 36.348 0.400 . 1 . . . A 365 GLU CG . 25740 1 876 . 1 1 81 81 GLU N N 15 121.066 0.400 . 1 . . . A 365 GLU N . 25740 1 877 . 1 1 82 82 ALA H H 1 8.155 0.020 . 1 . . . A 366 ALA H . 25740 1 878 . 1 1 82 82 ALA HA H 1 4.328 0.020 . 1 . . . A 366 ALA HA . 25740 1 879 . 1 1 82 82 ALA HB1 H 1 1.361 0.020 . 1 . . . A 366 ALA HB1 . 25740 1 880 . 1 1 82 82 ALA HB2 H 1 1.361 0.020 . 1 . . . A 366 ALA HB2 . 25740 1 881 . 1 1 82 82 ALA HB3 H 1 1.361 0.020 . 1 . . . A 366 ALA HB3 . 25740 1 882 . 1 1 82 82 ALA C C 13 177.335 0.400 . 1 . . . A 366 ALA C . 25740 1 883 . 1 1 82 82 ALA CA C 13 52.361 0.400 . 1 . . . A 366 ALA CA . 25740 1 884 . 1 1 82 82 ALA CB C 13 19.323 0.400 . 1 . . . A 366 ALA CB . 25740 1 885 . 1 1 82 82 ALA N N 15 124.942 0.400 . 1 . . . A 366 ALA N . 25740 1 886 . 1 1 83 83 VAL H H 1 8.016 0.020 . 1 . . . A 367 VAL H . 25740 1 887 . 1 1 83 83 VAL HA H 1 4.379 0.020 . 1 . . . A 367 VAL HA . 25740 1 888 . 1 1 83 83 VAL HG11 H 1 0.934 0.020 . 2 . . . A 367 VAL HG11 . 25740 1 889 . 1 1 83 83 VAL HG12 H 1 0.934 0.020 . 2 . . . A 367 VAL HG12 . 25740 1 890 . 1 1 83 83 VAL HG13 H 1 0.934 0.020 . 2 . . . A 367 VAL HG13 . 25740 1 891 . 1 1 83 83 VAL HG21 H 1 0.954 0.020 . 2 . . . A 367 VAL HG21 . 25740 1 892 . 1 1 83 83 VAL HG22 H 1 0.954 0.020 . 2 . . . A 367 VAL HG22 . 25740 1 893 . 1 1 83 83 VAL HG23 H 1 0.954 0.020 . 2 . . . A 367 VAL HG23 . 25740 1 894 . 1 1 83 83 VAL CA C 13 59.851 0.400 . 1 . . . A 367 VAL CA . 25740 1 895 . 1 1 83 83 VAL CG1 C 13 21.398 0.400 . 1 . . . A 367 VAL CG1 . 25740 1 896 . 1 1 83 83 VAL CG2 C 13 20.588 0.400 . 1 . . . A 367 VAL CG2 . 25740 1 897 . 1 1 83 83 VAL N N 15 120.970 0.400 . 1 . . . A 367 VAL N . 25740 1 898 . 1 1 84 84 PRO HA H 1 4.365 0.020 . 1 . . . A 368 PRO HA . 25740 1 899 . 1 1 84 84 PRO HB2 H 1 2.289 0.020 . 2 . . . A 368 PRO HB2 . 25740 1 900 . 1 1 84 84 PRO HB3 H 1 2.289 0.020 . 2 . . . A 368 PRO HB3 . 25740 1 901 . 1 1 84 84 PRO HG2 H 1 2.021 0.020 . 2 . . . A 368 PRO HG2 . 25740 1 902 . 1 1 84 84 PRO HG3 H 1 1.868 0.020 . 2 . . . A 368 PRO HG3 . 25740 1 903 . 1 1 84 84 PRO HD2 H 1 3.879 0.020 . 2 . . . A 368 PRO HD2 . 25740 1 904 . 1 1 84 84 PRO HD3 H 1 3.681 0.020 . 2 . . . A 368 PRO HD3 . 25740 1 905 . 1 1 84 84 PRO C C 13 176.737 0.400 . 1 . . . A 368 PRO C . 25740 1 906 . 1 1 84 84 PRO CA C 13 63.297 0.400 . 1 . . . A 368 PRO CA . 25740 1 907 . 1 1 84 84 PRO CB C 13 32.241 0.400 . 1 . . . A 368 PRO CB . 25740 1 908 . 1 1 84 84 PRO CG C 13 27.483 0.400 . 1 . . . A 368 PRO CG . 25740 1 909 . 1 1 84 84 PRO CD C 13 51.050 0.400 . 1 . . . A 368 PRO CD . 25740 1 910 . 1 1 85 85 LYS H H 1 8.469 0.020 . 1 . . . A 369 LYS H . 25740 1 911 . 1 1 85 85 LYS HA H 1 4.415 0.020 . 1 . . . A 369 LYS HA . 25740 1 912 . 1 1 85 85 LYS HB2 H 1 1.812 0.020 . 2 . . . A 369 LYS HB2 . 25740 1 913 . 1 1 85 85 LYS HB3 H 1 1.812 0.020 . 2 . . . A 369 LYS HB3 . 25740 1 914 . 1 1 85 85 LYS HG2 H 1 1.486 0.020 . 2 . . . A 369 LYS HG2 . 25740 1 915 . 1 1 85 85 LYS HG3 H 1 1.486 0.020 . 2 . . . A 369 LYS HG3 . 25740 1 916 . 1 1 85 85 LYS HD2 H 1 1.704 0.020 . 2 . . . A 369 LYS HD2 . 25740 1 917 . 1 1 85 85 LYS HD3 H 1 1.704 0.020 . 2 . . . A 369 LYS HD3 . 25740 1 918 . 1 1 85 85 LYS HE2 H 1 3.017 0.020 . 2 . . . A 369 LYS HE2 . 25740 1 919 . 1 1 85 85 LYS HE3 H 1 3.017 0.020 . 2 . . . A 369 LYS HE3 . 25740 1 920 . 1 1 85 85 LYS C C 13 177.024 0.400 . 1 . . . A 369 LYS C . 25740 1 921 . 1 1 85 85 LYS CA C 13 56.111 0.400 . 1 . . . A 369 LYS CA . 25740 1 922 . 1 1 85 85 LYS CB C 13 33.187 0.400 . 1 . . . A 369 LYS CB . 25740 1 923 . 1 1 85 85 LYS CG C 13 24.697 0.400 . 1 . . . A 369 LYS CG . 25740 1 924 . 1 1 85 85 LYS CD C 13 29.084 0.400 . 1 . . . A 369 LYS CD . 25740 1 925 . 1 1 85 85 LYS CE C 13 42.221 0.400 . 1 . . . A 369 LYS CE . 25740 1 926 . 1 1 85 85 LYS N N 15 122.406 0.400 . 1 . . . A 369 LYS N . 25740 1 927 . 1 1 86 86 THR H H 1 8.358 0.020 . 1 . . . A 370 THR H . 25740 1 928 . 1 1 86 86 THR HA H 1 4.389 0.020 . 1 . . . A 370 THR HA . 25740 1 929 . 1 1 86 86 THR HB H 1 4.248 0.020 . 1 . . . A 370 THR HB . 25740 1 930 . 1 1 86 86 THR HG21 H 1 1.209 0.020 . 1 . . . A 370 THR HG21 . 25740 1 931 . 1 1 86 86 THR HG22 H 1 1.209 0.020 . 1 . . . A 370 THR HG22 . 25740 1 932 . 1 1 86 86 THR HG23 H 1 1.209 0.020 . 1 . . . A 370 THR HG23 . 25740 1 933 . 1 1 86 86 THR C C 13 175.159 0.400 . 1 . . . A 370 THR C . 25740 1 934 . 1 1 86 86 THR CA C 13 61.871 0.400 . 1 . . . A 370 THR CA . 25740 1 935 . 1 1 86 86 THR CB C 13 70.171 0.400 . 1 . . . A 370 THR CB . 25740 1 936 . 1 1 86 86 THR CG2 C 13 21.599 0.400 . 1 . . . A 370 THR CG2 . 25740 1 937 . 1 1 86 86 THR N N 15 115.455 0.400 . 1 . . . A 370 THR N . 25740 1 938 . 1 1 87 87 GLY H H 1 8.543 0.020 . 1 . . . A 371 GLY H . 25740 1 939 . 1 1 87 87 GLY HA2 H 1 4.012 0.020 . 2 . . . A 371 GLY HA2 . 25740 1 940 . 1 1 87 87 GLY HA3 H 1 4.012 0.020 . 2 . . . A 371 GLY HA3 . 25740 1 941 . 1 1 87 87 GLY C C 13 173.914 0.400 . 1 . . . A 371 GLY C . 25740 1 942 . 1 1 87 87 GLY CA C 13 45.398 0.400 . 1 . . . A 371 GLY CA . 25740 1 943 . 1 1 87 87 GLY N N 15 111.361 0.400 . 1 . . . A 371 GLY N . 25740 1 944 . 1 1 88 88 ASP H H 1 8.270 0.020 . 1 . . . A 372 ASP H . 25740 1 945 . 1 1 88 88 ASP HA H 1 4.630 0.020 . 1 . . . A 372 ASP HA . 25740 1 946 . 1 1 88 88 ASP HB2 H 1 2.671 0.020 . 2 . . . A 372 ASP HB2 . 25740 1 947 . 1 1 88 88 ASP HB3 H 1 2.599 0.020 . 2 . . . A 372 ASP HB3 . 25740 1 948 . 1 1 88 88 ASP C C 13 176.463 0.400 . 1 . . . A 372 ASP C . 25740 1 949 . 1 1 88 88 ASP CA C 13 54.334 0.400 . 1 . . . A 372 ASP CA . 25740 1 950 . 1 1 88 88 ASP CB C 13 41.165 0.400 . 1 . . . A 372 ASP CB . 25740 1 951 . 1 1 88 88 ASP N N 15 120.708 0.400 . 1 . . . A 372 ASP N . 25740 1 952 . 1 1 89 89 GLU H H 1 8.517 0.020 . 1 . . . A 373 GLU H . 25740 1 953 . 1 1 89 89 GLU HA H 1 4.251 0.020 . 1 . . . A 373 GLU HA . 25740 1 954 . 1 1 89 89 GLU HB2 H 1 2.027 0.020 . 2 . . . A 373 GLU HB2 . 25740 1 955 . 1 1 89 89 GLU HB3 H 1 1.982 0.020 . 2 . . . A 373 GLU HB3 . 25740 1 956 . 1 1 89 89 GLU HG2 H 1 2.279 0.020 . 2 . . . A 373 GLU HG2 . 25740 1 957 . 1 1 89 89 GLU HG3 H 1 2.279 0.020 . 2 . . . A 373 GLU HG3 . 25740 1 958 . 1 1 89 89 GLU C C 13 176.596 0.400 . 1 . . . A 373 GLU C . 25740 1 959 . 1 1 89 89 GLU CA C 13 57.102 0.400 . 1 . . . A 373 GLU CA . 25740 1 960 . 1 1 89 89 GLU CB C 13 29.934 0.400 . 1 . . . A 373 GLU CB . 25740 1 961 . 1 1 89 89 GLU CG C 13 36.345 0.400 . 1 . . . A 373 GLU CG . 25740 1 962 . 1 1 89 89 GLU N N 15 121.392 0.400 . 1 . . . A 373 GLU N . 25740 1 963 . 1 1 90 90 LYS H H 1 8.286 0.020 . 1 . . . A 374 LYS H . 25740 1 964 . 1 1 90 90 LYS HA H 1 4.285 0.020 . 1 . . . A 374 LYS HA . 25740 1 965 . 1 1 90 90 LYS HB2 H 1 1.783 0.020 . 2 . . . A 374 LYS HB2 . 25740 1 966 . 1 1 90 90 LYS HB3 H 1 1.783 0.020 . 2 . . . A 374 LYS HB3 . 25740 1 967 . 1 1 90 90 LYS HG2 H 1 1.391 0.020 . 2 . . . A 374 LYS HG2 . 25740 1 968 . 1 1 90 90 LYS HG3 H 1 1.391 0.020 . 2 . . . A 374 LYS HG3 . 25740 1 969 . 1 1 90 90 LYS HD2 H 1 1.677 0.020 . 2 . . . A 374 LYS HD2 . 25740 1 970 . 1 1 90 90 LYS HD3 H 1 1.677 0.020 . 2 . . . A 374 LYS HD3 . 25740 1 971 . 1 1 90 90 LYS HE2 H 1 3.005 0.020 . 2 . . . A 374 LYS HE2 . 25740 1 972 . 1 1 90 90 LYS HE3 H 1 3.005 0.020 . 2 . . . A 374 LYS HE3 . 25740 1 973 . 1 1 90 90 LYS C C 13 176.229 0.400 . 1 . . . A 374 LYS C . 25740 1 974 . 1 1 90 90 LYS CA C 13 56.391 0.400 . 1 . . . A 374 LYS CA . 25740 1 975 . 1 1 90 90 LYS CB C 13 33.069 0.400 . 1 . . . A 374 LYS CB . 25740 1 976 . 1 1 90 90 LYS CG C 13 24.521 0.400 . 1 . . . A 374 LYS CG . 25740 1 977 . 1 1 90 90 LYS CD C 13 29.072 0.400 . 1 . . . A 374 LYS CD . 25740 1 978 . 1 1 90 90 LYS CE C 13 42.167 0.400 . 1 . . . A 374 LYS CE . 25740 1 979 . 1 1 90 90 LYS N N 15 121.569 0.400 . 1 . . . A 374 LYS N . 25740 1 980 . 1 1 91 91 ASP H H 1 8.308 0.020 . 1 . . . A 375 ASP H . 25740 1 981 . 1 1 91 91 ASP HA H 1 4.629 0.020 . 1 . . . A 375 ASP HA . 25740 1 982 . 1 1 91 91 ASP HB2 H 1 2.734 0.020 . 2 . . . A 375 ASP HB2 . 25740 1 983 . 1 1 91 91 ASP HB3 H 1 2.628 0.020 . 2 . . . A 375 ASP HB3 . 25740 1 984 . 1 1 91 91 ASP C C 13 176.127 0.400 . 1 . . . A 375 ASP C . 25740 1 985 . 1 1 91 91 ASP CA C 13 54.434 0.400 . 1 . . . A 375 ASP CA . 25740 1 986 . 1 1 91 91 ASP CB C 13 40.918 0.400 . 1 . . . A 375 ASP CB . 25740 1 987 . 1 1 91 91 ASP N N 15 121.544 0.400 . 1 . . . A 375 ASP N . 25740 1 988 . 1 1 92 92 VAL H H 1 8.015 0.020 . 1 . . . A 376 VAL H . 25740 1 989 . 1 1 92 92 VAL HA H 1 4.029 0.020 . 1 . . . A 376 VAL HA . 25740 1 990 . 1 1 92 92 VAL HB H 1 2.127 0.020 . 1 . . . A 376 VAL HB . 25740 1 991 . 1 1 92 92 VAL HG11 H 1 0.978 0.020 . 2 . . . A 376 VAL HG11 . 25740 1 992 . 1 1 92 92 VAL HG12 H 1 0.978 0.020 . 2 . . . A 376 VAL HG12 . 25740 1 993 . 1 1 92 92 VAL HG13 H 1 0.978 0.020 . 2 . . . A 376 VAL HG13 . 25740 1 994 . 1 1 92 92 VAL HG21 H 1 0.916 0.020 . 2 . . . A 376 VAL HG21 . 25740 1 995 . 1 1 92 92 VAL HG22 H 1 0.916 0.020 . 2 . . . A 376 VAL HG22 . 25740 1 996 . 1 1 92 92 VAL HG23 H 1 0.916 0.020 . 2 . . . A 376 VAL HG23 . 25740 1 997 . 1 1 92 92 VAL C C 13 176.114 0.400 . 1 . . . A 376 VAL C . 25740 1 998 . 1 1 92 92 VAL CA C 13 61.988 0.400 . 1 . . . A 376 VAL CA . 25740 1 999 . 1 1 92 92 VAL CB C 13 32.737 0.400 . 1 . . . A 376 VAL CB . 25740 1 1000 . 1 1 92 92 VAL CG1 C 13 21.112 0.400 . 1 . . . A 376 VAL CG1 . 25740 1 1001 . 1 1 92 92 VAL CG2 C 13 20.130 0.400 . 1 . . . A 376 VAL CG2 . 25740 1 1002 . 1 1 92 92 VAL N N 15 119.657 0.400 . 1 . . . A 376 VAL N . 25740 1 1003 . 1 1 93 93 SER H H 1 8.416 0.020 . 1 . . . A 377 SER H . 25740 1 1004 . 1 1 93 93 SER HA H 1 4.515 0.020 . 1 . . . A 377 SER HA . 25740 1 1005 . 1 1 93 93 SER HB2 H 1 3.866 0.020 . 2 . . . A 377 SER HB2 . 25740 1 1006 . 1 1 93 93 SER HB3 H 1 3.866 0.020 . 2 . . . A 377 SER HB3 . 25740 1 1007 . 1 1 93 93 SER C C 13 173.607 0.400 . 1 . . . A 377 SER C . 25740 1 1008 . 1 1 93 93 SER CA C 13 58.450 0.400 . 1 . . . A 377 SER CA . 25740 1 1009 . 1 1 93 93 SER CB C 13 63.987 0.400 . 1 . . . A 377 SER CB . 25740 1 1010 . 1 1 93 93 SER N N 15 120.254 0.400 . 1 . . . A 377 SER N . 25740 1 1011 . 1 1 94 94 VAL H H 1 7.709 0.020 . 1 . . . A 378 VAL H . 25740 1 1012 . 1 1 94 94 VAL HG11 H 1 0.906 0.020 . 2 . . . A 378 VAL HG11 . 25740 1 1013 . 1 1 94 94 VAL HG12 H 1 0.906 0.020 . 2 . . . A 378 VAL HG12 . 25740 1 1014 . 1 1 94 94 VAL HG13 H 1 0.906 0.020 . 2 . . . A 378 VAL HG13 . 25740 1 1015 . 1 1 94 94 VAL HG21 H 1 0.875 0.020 . 2 . . . A 378 VAL HG21 . 25740 1 1016 . 1 1 94 94 VAL HG22 H 1 0.875 0.020 . 2 . . . A 378 VAL HG22 . 25740 1 1017 . 1 1 94 94 VAL HG23 H 1 0.875 0.020 . 2 . . . A 378 VAL HG23 . 25740 1 1018 . 1 1 94 94 VAL CG1 C 13 21.678 0.400 . 1 . . . A 378 VAL CG1 . 25740 1 1019 . 1 1 94 94 VAL CG2 C 13 20.110 0.400 . 1 . . . A 378 VAL CG2 . 25740 1 1020 . 1 1 94 94 VAL N N 15 125.790 0.400 . 1 . . . A 378 VAL N . 25740 1 stop_ save_