data_31134 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 31134 _Entry.Title ; Solution NMR structure of human DNMT1 N-terminal alpha-helical domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-12-09 _Entry.Accession_date 2023-12-09 _Entry.Last_release_date 2024-01-08 _Entry.Original_release_date 2024-01-08 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_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 Q. Hu Q. . . . 31134 2 M. Botuyan M. V. . . 31134 3 G. Mer G. . . . 31134 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DNA damage repair' . 31134 'DNA methylation' . 31134 DNMT1 . 31134 TRANSFERASE . 31134 epigenetics . 31134 'gene expression' . 31134 transcription . 31134 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 31134 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 353 31134 '15N chemical shifts' 80 31134 '1H chemical shifts' 593 31134 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 1 . . 2024-02-26 . original BMRB . 31134 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 8V9U 'BMRB Entry Tracking System' 31134 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 31134 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38382673 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Identification of a conserved alpha-helical domain at the N-terminus of human DNA methyl transferase 1 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 1083-351X _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2024 _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 Q. Hu Q. . . . 31134 1 2 M. Botuyan M. V. . . 31134 1 3 G. Mer G. . . . 31134 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 31134 _Assembly.ID 1 _Assembly.Name 'DNA (cytosine-5)-methyltransferase 1 (E.C.2.1.1.37)' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 31134 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 31134 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMPAISLPDDVRRRLKDLE RDSLTEKECVKEKLNLLHEF LQTEIKNQLCDLETKLRKEE LSEEGYLAKVKSLLNKDLSL E ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 81 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 2.1.1.37 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9494.941 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CXXC-type zinc finger protein 9' common 31134 1 'DNA MTase HsaI' common 31134 1 'DNA methyltransferase HsaI' common 31134 1 Dnmt1 common 31134 1 M.HsaI common 31134 1 MCMT common 31134 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 13 GLY . 31134 1 2 14 HIS . 31134 1 3 15 MET . 31134 1 4 16 PRO . 31134 1 5 17 ALA . 31134 1 6 18 ILE . 31134 1 7 19 SER . 31134 1 8 20 LEU . 31134 1 9 21 PRO . 31134 1 10 22 ASP . 31134 1 11 23 ASP . 31134 1 12 24 VAL . 31134 1 13 25 ARG . 31134 1 14 26 ARG . 31134 1 15 27 ARG . 31134 1 16 28 LEU . 31134 1 17 29 LYS . 31134 1 18 30 ASP . 31134 1 19 31 LEU . 31134 1 20 32 GLU . 31134 1 21 33 ARG . 31134 1 22 34 ASP . 31134 1 23 35 SER . 31134 1 24 36 LEU . 31134 1 25 37 THR . 31134 1 26 38 GLU . 31134 1 27 39 LYS . 31134 1 28 40 GLU . 31134 1 29 41 CYS . 31134 1 30 42 VAL . 31134 1 31 43 LYS . 31134 1 32 44 GLU . 31134 1 33 45 LYS . 31134 1 34 46 LEU . 31134 1 35 47 ASN . 31134 1 36 48 LEU . 31134 1 37 49 LEU . 31134 1 38 50 HIS . 31134 1 39 51 GLU . 31134 1 40 52 PHE . 31134 1 41 53 LEU . 31134 1 42 54 GLN . 31134 1 43 55 THR . 31134 1 44 56 GLU . 31134 1 45 57 ILE . 31134 1 46 58 LYS . 31134 1 47 59 ASN . 31134 1 48 60 GLN . 31134 1 49 61 LEU . 31134 1 50 62 CYS . 31134 1 51 63 ASP . 31134 1 52 64 LEU . 31134 1 53 65 GLU . 31134 1 54 66 THR . 31134 1 55 67 LYS . 31134 1 56 68 LEU . 31134 1 57 69 ARG . 31134 1 58 70 LYS . 31134 1 59 71 GLU . 31134 1 60 72 GLU . 31134 1 61 73 LEU . 31134 1 62 74 SER . 31134 1 63 75 GLU . 31134 1 64 76 GLU . 31134 1 65 77 GLY . 31134 1 66 78 TYR . 31134 1 67 79 LEU . 31134 1 68 80 ALA . 31134 1 69 81 LYS . 31134 1 70 82 VAL . 31134 1 71 83 LYS . 31134 1 72 84 SER . 31134 1 73 85 LEU . 31134 1 74 86 LEU . 31134 1 75 87 ASN . 31134 1 76 88 LYS . 31134 1 77 89 ASP . 31134 1 78 90 LEU . 31134 1 79 91 SER . 31134 1 80 92 LEU . 31134 1 81 93 GLU . 31134 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 31134 1 . HIS 2 2 31134 1 . MET 3 3 31134 1 . PRO 4 4 31134 1 . ALA 5 5 31134 1 . ILE 6 6 31134 1 . SER 7 7 31134 1 . LEU 8 8 31134 1 . PRO 9 9 31134 1 . ASP 10 10 31134 1 . ASP 11 11 31134 1 . VAL 12 12 31134 1 . ARG 13 13 31134 1 . ARG 14 14 31134 1 . ARG 15 15 31134 1 . LEU 16 16 31134 1 . LYS 17 17 31134 1 . ASP 18 18 31134 1 . LEU 19 19 31134 1 . GLU 20 20 31134 1 . ARG 21 21 31134 1 . ASP 22 22 31134 1 . SER 23 23 31134 1 . LEU 24 24 31134 1 . THR 25 25 31134 1 . GLU 26 26 31134 1 . LYS 27 27 31134 1 . GLU 28 28 31134 1 . CYS 29 29 31134 1 . VAL 30 30 31134 1 . LYS 31 31 31134 1 . GLU 32 32 31134 1 . LYS 33 33 31134 1 . LEU 34 34 31134 1 . ASN 35 35 31134 1 . LEU 36 36 31134 1 . LEU 37 37 31134 1 . HIS 38 38 31134 1 . GLU 39 39 31134 1 . PHE 40 40 31134 1 . LEU 41 41 31134 1 . GLN 42 42 31134 1 . THR 43 43 31134 1 . GLU 44 44 31134 1 . ILE 45 45 31134 1 . LYS 46 46 31134 1 . ASN 47 47 31134 1 . GLN 48 48 31134 1 . LEU 49 49 31134 1 . CYS 50 50 31134 1 . ASP 51 51 31134 1 . LEU 52 52 31134 1 . GLU 53 53 31134 1 . THR 54 54 31134 1 . LYS 55 55 31134 1 . LEU 56 56 31134 1 . ARG 57 57 31134 1 . LYS 58 58 31134 1 . GLU 59 59 31134 1 . GLU 60 60 31134 1 . LEU 61 61 31134 1 . SER 62 62 31134 1 . GLU 63 63 31134 1 . GLU 64 64 31134 1 . GLY 65 65 31134 1 . TYR 66 66 31134 1 . LEU 67 67 31134 1 . ALA 68 68 31134 1 . LYS 69 69 31134 1 . VAL 70 70 31134 1 . LYS 71 71 31134 1 . SER 72 72 31134 1 . LEU 73 73 31134 1 . LEU 74 74 31134 1 . ASN 75 75 31134 1 . LYS 76 76 31134 1 . ASP 77 77 31134 1 . LEU 78 78 31134 1 . SER 79 79 31134 1 . LEU 80 80 31134 1 . GLU 81 81 31134 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 31134 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'DNMT1, AIM, CXXC9, DNMT' . 31134 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 31134 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . PLASMID . . pTEV . . . 31134 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 31134 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-13C; U-15N] DNMT1, 20 mM MES/Bis-Tris, 50 mM sodium chloride, 90% H2O/10% D2O.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DNMT1 '[U-13C; U-15N]' . . 1 $entity_1 . . 1 . . mM . . . . 31134 1 2 MES/Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 31134 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 31134 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 31134 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-15N] DNMT1, 20 mM MES/Bis-Tris, 50 mM sodium chloride, 90% H2O/10% D2O.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DNMT1 [U-15N] . . 1 $entity_1 . . 1 . . mM . . . . 31134 2 2 MES/Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 31134 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 31134 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 31134 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-13C; U-15N] DNMT1, 20 mM MES/Bis-Tris, 50 mM sodium chloride, 100% D2O.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 DNMT1 '[U-13C; U-15N]' . . 1 $entity_1 . . 1 . . mM . . . . 31134 3 2 MES/Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 31134 3 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 31134 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 31134 _Sample.ID 4 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1 mM [U-15N] DNMT1, 20 mM MES/Bis-Tris, 50 mM sodium chloride, 5 % pentaethylene glycol monododecyl ether (C12E5), 95 % n-hexanol, 90% H2O/10% D2O. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DNMT1 [U-15N] . . 1 $entity_1 . . 1 . . mM . . . . 31134 4 2 MES/Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 31134 4 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 31134 4 4 'pentaethylene glycol monododecyl ether (C12E5)' 'natural abundance' . . . . . . 5 . . % . . . . 31134 4 5 n-hexanol 'natural abundance' . . . . . . 95 . . % . . . . 31134 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 31134 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 31134 1 pH 6.0 . pH 31134 1 pressure 1 . atm 31134 1 temperature 298 . K 31134 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 31134 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 31134 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 31134 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 31134 _Software.ID 2 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 31134 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 31134 2 'peak picking' . 31134 2 processing . 31134 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 31134 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 31134 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 31134 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 31134 _Software.ID 4 _Software.Type . _Software.Name TALOS+ _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Shen, Delaglio, Cornilescu and Bax' . . 31134 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'geometry optimization' . 31134 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 31134 _Software.ID 5 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 31134 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 31134 5 'structure calculation' . 31134 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 31134 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 31134 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III' . 700 . . . 31134 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 31134 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 3 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 4 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 6 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 7 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 8 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 12 '3D 1H-13C NOESY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 13 '3D HCCH-COSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 14 '3D HCCH-COSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 15 '3D HCCH-TOCSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 16 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 17 '3D 1H-15N NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 18 '2D 1H-15N HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 19 '2D 1H-15N IPAP HSQC' no . . . . . . . . . . . . 4 $sample_4 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31134 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 31134 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.251449530 . . . . . 31134 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 external direct 1.0 . . . . . 31134 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.101329118 . . . . . 31134 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 31134 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 31134 1 2 '2D 1H-13C HSQC' . . . 31134 1 3 '3D HNCO' . . . 31134 1 4 '3D HN(CA)CO' . . . 31134 1 5 '3D HNCA' . . . 31134 1 6 '3D HN(CO)CA' . . . 31134 1 7 '3D HNCACB' . . . 31134 1 8 '3D CBCA(CO)NH' . . . 31134 1 9 '3D HCCH-TOCSY' . . . 31134 1 10 '3D HBHA(CO)NH' . . . 31134 1 11 '3D 1H-13C NOESY' . . . 31134 1 12 '3D 1H-13C NOESY' . . . 31134 1 13 '3D HCCH-COSY' . . . 31134 1 14 '3D HCCH-COSY' . . . 31134 1 15 '3D HCCH-TOCSY' . . . 31134 1 16 '3D 1H-15N NOESY' . . . 31134 1 17 '3D 1H-15N NOESY' . . . 31134 1 18 '2D 1H-15N HSQC' . . . 31134 1 19 '2D 1H-15N IPAP HSQC' . . . 31134 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 PRO HA H 1 4.391 . . 1 . . . . A 16 PRO HA . 31134 1 2 . 1 . 1 4 4 PRO HB2 H 1 2.275 . . 2 . . . . A 16 PRO HB2 . 31134 1 3 . 1 . 1 4 4 PRO HB3 H 1 1.895 . . 2 . . . . A 16 PRO HB3 . 31134 1 4 . 1 . 1 4 4 PRO HG2 H 1 2.018 . . 1 . . . . A 16 PRO HG2 . 31134 1 5 . 1 . 1 4 4 PRO HG3 H 1 2.018 . . 1 . . . . A 16 PRO HG3 . 31134 1 6 . 1 . 1 4 4 PRO HD2 H 1 3.803 . . 2 . . . . A 16 PRO HD2 . 31134 1 7 . 1 . 1 4 4 PRO HD3 H 1 3.668 . . 2 . . . . A 16 PRO HD3 . 31134 1 8 . 1 . 1 4 4 PRO C C 13 176.214 . . 1 . . . . A 16 PRO C . 31134 1 9 . 1 . 1 4 4 PRO CA C 13 62.913 . . 1 . . . . A 16 PRO CA . 31134 1 10 . 1 . 1 4 4 PRO CB C 13 32.140 . . 1 . . . . A 16 PRO CB . 31134 1 11 . 1 . 1 4 4 PRO CG C 13 27.391 . . 1 . . . . A 16 PRO CG . 31134 1 12 . 1 . 1 4 4 PRO CD C 13 50.617 . . 1 . . . . A 16 PRO CD . 31134 1 13 . 1 . 1 5 5 ALA H H 1 8.373 . . 1 . . . . A 17 ALA H . 31134 1 14 . 1 . 1 5 5 ALA HA H 1 4.287 . . 1 . . . . A 17 ALA HA . 31134 1 15 . 1 . 1 5 5 ALA HB1 H 1 1.358 . . 1 . . . . A 17 ALA HB1 . 31134 1 16 . 1 . 1 5 5 ALA HB2 H 1 1.358 . . 1 . . . . A 17 ALA HB2 . 31134 1 17 . 1 . 1 5 5 ALA HB3 H 1 1.358 . . 1 . . . . A 17 ALA HB3 . 31134 1 18 . 1 . 1 5 5 ALA C C 13 177.622 . . 1 . . . . A 17 ALA C . 31134 1 19 . 1 . 1 5 5 ALA CA C 13 52.366 . . 1 . . . . A 17 ALA CA . 31134 1 20 . 1 . 1 5 5 ALA CB C 13 19.462 . . 1 . . . . A 17 ALA CB . 31134 1 21 . 1 . 1 5 5 ALA N N 15 124.106 . . 1 . . . . A 17 ALA N . 31134 1 22 . 1 . 1 6 6 ILE H H 1 8.086 . . 1 . . . . A 18 ILE H . 31134 1 23 . 1 . 1 6 6 ILE HA H 1 4.200 . . 1 . . . . A 18 ILE HA . 31134 1 24 . 1 . 1 6 6 ILE HB H 1 1.834 . . 1 . . . . A 18 ILE HB . 31134 1 25 . 1 . 1 6 6 ILE HG12 H 1 1.497 . . 1 . . . . A 18 ILE HG12 . 31134 1 26 . 1 . 1 6 6 ILE HG13 H 1 1.161 . . 1 . . . . A 18 ILE HG13 . 31134 1 27 . 1 . 1 6 6 ILE HG21 H 1 0.893 . . 1 . . . . A 18 ILE HG21 . 31134 1 28 . 1 . 1 6 6 ILE HG22 H 1 0.893 . . 1 . . . . A 18 ILE HG22 . 31134 1 29 . 1 . 1 6 6 ILE HG23 H 1 0.893 . . 1 . . . . A 18 ILE HG23 . 31134 1 30 . 1 . 1 6 6 ILE HD11 H 1 0.863 . . 1 . . . . A 18 ILE HD11 . 31134 1 31 . 1 . 1 6 6 ILE HD12 H 1 0.863 . . 1 . . . . A 18 ILE HD12 . 31134 1 32 . 1 . 1 6 6 ILE HD13 H 1 0.863 . . 1 . . . . A 18 ILE HD13 . 31134 1 33 . 1 . 1 6 6 ILE C C 13 175.438 . . 1 . . . . A 18 ILE C . 31134 1 34 . 1 . 1 6 6 ILE CA C 13 60.797 . . 1 . . . . A 18 ILE CA . 31134 1 35 . 1 . 1 6 6 ILE CB C 13 39.375 . . 1 . . . . A 18 ILE CB . 31134 1 36 . 1 . 1 6 6 ILE CG1 C 13 27.361 . . 1 . . . . A 18 ILE CG1 . 31134 1 37 . 1 . 1 6 6 ILE CG2 C 13 17.541 . . 1 . . . . A 18 ILE CG2 . 31134 1 38 . 1 . 1 6 6 ILE CD1 C 13 13.605 . . 1 . . . . A 18 ILE CD1 . 31134 1 39 . 1 . 1 6 6 ILE N N 15 119.223 . . 1 . . . . A 18 ILE N . 31134 1 40 . 1 . 1 7 7 SER H H 1 8.381 . . 1 . . . . A 19 SER H . 31134 1 41 . 1 . 1 7 7 SER HA H 1 4.489 . . 1 . . . . A 19 SER HA . 31134 1 42 . 1 . 1 7 7 SER HB2 H 1 3.793 . . 2 . . . . A 19 SER HB2 . 31134 1 43 . 1 . 1 7 7 SER HB3 H 1 3.734 . . 2 . . . . A 19 SER HB3 . 31134 1 44 . 1 . 1 7 7 SER C C 13 173.708 . . 1 . . . . A 19 SER C . 31134 1 45 . 1 . 1 7 7 SER CA C 13 57.197 . . 1 . . . . A 19 SER CA . 31134 1 46 . 1 . 1 7 7 SER CB C 13 63.563 . . 1 . . . . A 19 SER CB . 31134 1 47 . 1 . 1 7 7 SER N N 15 120.443 . . 1 . . . . A 19 SER N . 31134 1 48 . 1 . 1 8 8 LEU H H 1 8.208 . . 1 . . . . A 20 LEU H . 31134 1 49 . 1 . 1 8 8 LEU HA H 1 4.287 . . 1 . . . . A 20 LEU HA . 31134 1 50 . 1 . 1 8 8 LEU HB2 H 1 1.373 . . 2 . . . . A 20 LEU HB2 . 31134 1 51 . 1 . 1 8 8 LEU HB3 H 1 0.964 . . 2 . . . . A 20 LEU HB3 . 31134 1 52 . 1 . 1 8 8 LEU HG H 1 1.412 . . 1 . . . . A 20 LEU HG . 31134 1 53 . 1 . 1 8 8 LEU HD11 H 1 0.416 . . 1 . . . . A 20 LEU HD11 . 31134 1 54 . 1 . 1 8 8 LEU HD12 H 1 0.416 . . 1 . . . . A 20 LEU HD12 . 31134 1 55 . 1 . 1 8 8 LEU HD13 H 1 0.416 . . 1 . . . . A 20 LEU HD13 . 31134 1 56 . 1 . 1 8 8 LEU HD21 H 1 0.553 . . 1 . . . . A 20 LEU HD21 . 31134 1 57 . 1 . 1 8 8 LEU HD22 H 1 0.553 . . 1 . . . . A 20 LEU HD22 . 31134 1 58 . 1 . 1 8 8 LEU HD23 H 1 0.553 . . 1 . . . . A 20 LEU HD23 . 31134 1 59 . 1 . 1 8 8 LEU CA C 13 51.995 . . 1 . . . . A 20 LEU CA . 31134 1 60 . 1 . 1 8 8 LEU CB C 13 43.143 . . 1 . . . . A 20 LEU CB . 31134 1 61 . 1 . 1 8 8 LEU CG C 13 26.420 . . 1 . . . . A 20 LEU CG . 31134 1 62 . 1 . 1 8 8 LEU CD1 C 13 24.309 . . 1 . . . . A 20 LEU CD1 . 31134 1 63 . 1 . 1 8 8 LEU CD2 C 13 25.224 . . 1 . . . . A 20 LEU CD2 . 31134 1 64 . 1 . 1 8 8 LEU N N 15 124.804 . . 1 . . . . A 20 LEU N . 31134 1 65 . 1 . 1 9 9 PRO HA H 1 4.479 . . 1 . . . . A 21 PRO HA . 31134 1 66 . 1 . 1 9 9 PRO HB2 H 1 2.496 . . 2 . . . . A 21 PRO HB2 . 31134 1 67 . 1 . 1 9 9 PRO HB3 H 1 1.955 . . 2 . . . . A 21 PRO HB3 . 31134 1 68 . 1 . 1 9 9 PRO HG2 H 1 2.115 . . 1 . . . . A 21 PRO HG2 . 31134 1 69 . 1 . 1 9 9 PRO HG3 H 1 2.115 . . 1 . . . . A 21 PRO HG3 . 31134 1 70 . 1 . 1 9 9 PRO HD2 H 1 3.667 . . 2 . . . . A 21 PRO HD2 . 31134 1 71 . 1 . 1 9 9 PRO HD3 H 1 2.775 . . 2 . . . . A 21 PRO HD3 . 31134 1 72 . 1 . 1 9 9 PRO C C 13 177.502 . . 1 . . . . A 21 PRO C . 31134 1 73 . 1 . 1 9 9 PRO CA C 13 62.452 . . 1 . . . . A 21 PRO CA . 31134 1 74 . 1 . 1 9 9 PRO CB C 13 32.703 . . 1 . . . . A 21 PRO CB . 31134 1 75 . 1 . 1 9 9 PRO CG C 13 27.761 . . 1 . . . . A 21 PRO CG . 31134 1 76 . 1 . 1 9 9 PRO CD C 13 50.859 . . 1 . . . . A 21 PRO CD . 31134 1 77 . 1 . 1 10 10 ASP H H 1 8.925 . . 1 . . . . A 22 ASP H . 31134 1 78 . 1 . 1 10 10 ASP HA H 1 4.206 . . 1 . . . . A 22 ASP HA . 31134 1 79 . 1 . 1 10 10 ASP HB2 H 1 2.636 . . 1 . . . . A 22 ASP HB2 . 31134 1 80 . 1 . 1 10 10 ASP HB3 H 1 2.636 . . 1 . . . . A 22 ASP HB3 . 31134 1 81 . 1 . 1 10 10 ASP C C 13 178.135 . . 1 . . . . A 22 ASP C . 31134 1 82 . 1 . 1 10 10 ASP CA C 13 58.030 . . 1 . . . . A 22 ASP CA . 31134 1 83 . 1 . 1 10 10 ASP CB C 13 40.865 . . 1 . . . . A 22 ASP CB . 31134 1 84 . 1 . 1 10 10 ASP N N 15 123.323 . . 1 . . . . A 22 ASP N . 31134 1 85 . 1 . 1 11 11 ASP H H 1 8.968 . . 1 . . . . A 23 ASP H . 31134 1 86 . 1 . 1 11 11 ASP HA H 1 4.301 . . 1 . . . . A 23 ASP HA . 31134 1 87 . 1 . 1 11 11 ASP HB2 H 1 2.643 . . 1 . . . . A 23 ASP HB2 . 31134 1 88 . 1 . 1 11 11 ASP HB3 H 1 2.643 . . 1 . . . . A 23 ASP HB3 . 31134 1 89 . 1 . 1 11 11 ASP C C 13 178.410 . . 1 . . . . A 23 ASP C . 31134 1 90 . 1 . 1 11 11 ASP CA C 13 57.005 . . 1 . . . . A 23 ASP CA . 31134 1 91 . 1 . 1 11 11 ASP CB C 13 40.212 . . 1 . . . . A 23 ASP CB . 31134 1 92 . 1 . 1 11 11 ASP N N 15 116.907 . . 1 . . . . A 23 ASP N . 31134 1 93 . 1 . 1 12 12 VAL H H 1 7.088 . . 1 . . . . A 24 VAL H . 31134 1 94 . 1 . 1 12 12 VAL HA H 1 3.596 . . 1 . . . . A 24 VAL HA . 31134 1 95 . 1 . 1 12 12 VAL HB H 1 1.891 . . 1 . . . . A 24 VAL HB . 31134 1 96 . 1 . 1 12 12 VAL HG11 H 1 1.038 . . 1 . . . . A 24 VAL HG11 . 31134 1 97 . 1 . 1 12 12 VAL HG12 H 1 1.038 . . 1 . . . . A 24 VAL HG12 . 31134 1 98 . 1 . 1 12 12 VAL HG13 H 1 1.038 . . 1 . . . . A 24 VAL HG13 . 31134 1 99 . 1 . 1 12 12 VAL HG21 H 1 0.794 . . 1 . . . . A 24 VAL HG21 . 31134 1 100 . 1 . 1 12 12 VAL HG22 H 1 0.794 . . 1 . . . . A 24 VAL HG22 . 31134 1 101 . 1 . 1 12 12 VAL HG23 H 1 0.794 . . 1 . . . . A 24 VAL HG23 . 31134 1 102 . 1 . 1 12 12 VAL C C 13 177.109 . . 1 . . . . A 24 VAL C . 31134 1 103 . 1 . 1 12 12 VAL CA C 13 66.001 . . 1 . . . . A 24 VAL CA . 31134 1 104 . 1 . 1 12 12 VAL CB C 13 31.701 . . 1 . . . . A 24 VAL CB . 31134 1 105 . 1 . 1 12 12 VAL CG1 C 13 22.982 . . 1 . . . . A 24 VAL CG1 . 31134 1 106 . 1 . 1 12 12 VAL CG2 C 13 21.638 . . 1 . . . . A 24 VAL CG2 . 31134 1 107 . 1 . 1 12 12 VAL N N 15 120.805 . . 1 . . . . A 24 VAL N . 31134 1 108 . 1 . 1 13 13 ARG H H 1 7.821 . . 1 . . . . A 25 ARG H . 31134 1 109 . 1 . 1 13 13 ARG HA H 1 3.764 . . 1 . . . . A 25 ARG HA . 31134 1 110 . 1 . 1 13 13 ARG HB2 H 1 1.837 . . 1 . . . . A 25 ARG HB2 . 31134 1 111 . 1 . 1 13 13 ARG HB3 H 1 1.837 . . 1 . . . . A 25 ARG HB3 . 31134 1 112 . 1 . 1 13 13 ARG HG2 H 1 1.600 . . 2 . . . . A 25 ARG HG2 . 31134 1 113 . 1 . 1 13 13 ARG HG3 H 1 1.427 . . 2 . . . . A 25 ARG HG3 . 31134 1 114 . 1 . 1 13 13 ARG HD2 H 1 3.200 . . 1 . . . . A 25 ARG HD2 . 31134 1 115 . 1 . 1 13 13 ARG HD3 H 1 3.200 . . 1 . . . . A 25 ARG HD3 . 31134 1 116 . 1 . 1 13 13 ARG C C 13 178.948 . . 1 . . . . A 25 ARG C . 31134 1 117 . 1 . 1 13 13 ARG CA C 13 60.377 . . 1 . . . . A 25 ARG CA . 31134 1 118 . 1 . 1 13 13 ARG CB C 13 29.795 . . 1 . . . . A 25 ARG CB . 31134 1 119 . 1 . 1 13 13 ARG CG C 13 28.538 . . 1 . . . . A 25 ARG CG . 31134 1 120 . 1 . 1 13 13 ARG CD C 13 43.102 . . 1 . . . . A 25 ARG CD . 31134 1 121 . 1 . 1 13 13 ARG N N 15 118.809 . . 1 . . . . A 25 ARG N . 31134 1 122 . 1 . 1 14 14 ARG H H 1 8.043 . . 1 . . . . A 26 ARG H . 31134 1 123 . 1 . 1 14 14 ARG HA H 1 3.962 . . 1 . . . . A 26 ARG HA . 31134 1 124 . 1 . 1 14 14 ARG HB2 H 1 1.873 . . 1 . . . . A 26 ARG HB2 . 31134 1 125 . 1 . 1 14 14 ARG HB3 H 1 1.873 . . 1 . . . . A 26 ARG HB3 . 31134 1 126 . 1 . 1 14 14 ARG HG2 H 1 1.719 . . 1 . . . . A 26 ARG HG2 . 31134 1 127 . 1 . 1 14 14 ARG HG3 H 1 1.580 . . 1 . . . . A 26 ARG HG3 . 31134 1 128 . 1 . 1 14 14 ARG HD2 H 1 3.190 . . 1 . . . . A 26 ARG HD2 . 31134 1 129 . 1 . 1 14 14 ARG HD3 H 1 3.190 . . 1 . . . . A 26 ARG HD3 . 31134 1 130 . 1 . 1 14 14 ARG C C 13 178.327 . . 1 . . . . A 26 ARG C . 31134 1 131 . 1 . 1 14 14 ARG CA C 13 59.574 . . 1 . . . . A 26 ARG CA . 31134 1 132 . 1 . 1 14 14 ARG CB C 13 29.896 . . 1 . . . . A 26 ARG CB . 31134 1 133 . 1 . 1 14 14 ARG CG C 13 27.631 . . 1 . . . . A 26 ARG CG . 31134 1 134 . 1 . 1 14 14 ARG CD C 13 43.210 . . 1 . . . . A 26 ARG CD . 31134 1 135 . 1 . 1 14 14 ARG N N 15 118.603 . . 1 . . . . A 26 ARG N . 31134 1 136 . 1 . 1 15 15 ARG H H 1 7.658 . . 1 . . . . A 27 ARG H . 31134 1 137 . 1 . 1 15 15 ARG HA H 1 4.106 . . 1 . . . . A 27 ARG HA . 31134 1 138 . 1 . 1 15 15 ARG HB2 H 1 1.930 . . 1 . . . . A 27 ARG HB2 . 31134 1 139 . 1 . 1 15 15 ARG HB3 H 1 1.930 . . 1 . . . . A 27 ARG HB3 . 31134 1 140 . 1 . 1 15 15 ARG HG2 H 1 1.826 . . 2 . . . . A 27 ARG HG2 . 31134 1 141 . 1 . 1 15 15 ARG HG3 H 1 1.777 . . 2 . . . . A 27 ARG HG3 . 31134 1 142 . 1 . 1 15 15 ARG HD2 H 1 3.275 . . 2 . . . . A 27 ARG HD2 . 31134 1 143 . 1 . 1 15 15 ARG HD3 H 1 3.169 . . 2 . . . . A 27 ARG HD3 . 31134 1 144 . 1 . 1 15 15 ARG C C 13 179.010 . . 1 . . . . A 27 ARG C . 31134 1 145 . 1 . 1 15 15 ARG CA C 13 58.871 . . 1 . . . . A 27 ARG CA . 31134 1 146 . 1 . 1 15 15 ARG CB C 13 30.203 . . 1 . . . . A 27 ARG CB . 31134 1 147 . 1 . 1 15 15 ARG CG C 13 27.931 . . 1 . . . . A 27 ARG CG . 31134 1 148 . 1 . 1 15 15 ARG CD C 13 43.494 . . 1 . . . . A 27 ARG CD . 31134 1 149 . 1 . 1 15 15 ARG N N 15 119.451 . . 1 . . . . A 27 ARG N . 31134 1 150 . 1 . 1 16 16 LEU H H 1 8.325 . . 1 . . . . A 28 LEU H . 31134 1 151 . 1 . 1 16 16 LEU HA H 1 3.906 . . 1 . . . . A 28 LEU HA . 31134 1 152 . 1 . 1 16 16 LEU HB2 H 1 1.854 . . 2 . . . . A 28 LEU HB2 . 31134 1 153 . 1 . 1 16 16 LEU HB3 H 1 1.544 . . 2 . . . . A 28 LEU HB3 . 31134 1 154 . 1 . 1 16 16 LEU HG H 1 1.809 . . 1 . . . . A 28 LEU HG . 31134 1 155 . 1 . 1 16 16 LEU HD11 H 1 0.865 . . 1 . . . . A 28 LEU HD11 . 31134 1 156 . 1 . 1 16 16 LEU HD12 H 1 0.865 . . 1 . . . . A 28 LEU HD12 . 31134 1 157 . 1 . 1 16 16 LEU HD13 H 1 0.865 . . 1 . . . . A 28 LEU HD13 . 31134 1 158 . 1 . 1 16 16 LEU HD21 H 1 0.878 . . 1 . . . . A 28 LEU HD21 . 31134 1 159 . 1 . 1 16 16 LEU HD22 H 1 0.878 . . 1 . . . . A 28 LEU HD22 . 31134 1 160 . 1 . 1 16 16 LEU HD23 H 1 0.878 . . 1 . . . . A 28 LEU HD23 . 31134 1 161 . 1 . 1 16 16 LEU C C 13 178.725 . . 1 . . . . A 28 LEU C . 31134 1 162 . 1 . 1 16 16 LEU CA C 13 58.124 . . 1 . . . . A 28 LEU CA . 31134 1 163 . 1 . 1 16 16 LEU CB C 13 41.943 . . 1 . . . . A 28 LEU CB . 31134 1 164 . 1 . 1 16 16 LEU CG C 13 26.890 . . 1 . . . . A 28 LEU CG . 31134 1 165 . 1 . 1 16 16 LEU CD1 C 13 26.152 . . 1 . . . . A 28 LEU CD1 . 31134 1 166 . 1 . 1 16 16 LEU CD2 C 13 24.374 . . 1 . . . . A 28 LEU CD2 . 31134 1 167 . 1 . 1 16 16 LEU N N 15 119.702 . . 1 . . . . A 28 LEU N . 31134 1 168 . 1 . 1 17 17 LYS H H 1 7.477 . . 1 . . . . A 29 LYS H . 31134 1 169 . 1 . 1 17 17 LYS HA H 1 4.016 . . 1 . . . . A 29 LYS HA . 31134 1 170 . 1 . 1 17 17 LYS HB2 H 1 1.905 . . 1 . . . . A 29 LYS HB2 . 31134 1 171 . 1 . 1 17 17 LYS HB3 H 1 1.905 . . 1 . . . . A 29 LYS HB3 . 31134 1 172 . 1 . 1 17 17 LYS HG2 H 1 1.521 . . 2 . . . . A 29 LYS HG2 . 31134 1 173 . 1 . 1 17 17 LYS HG3 H 1 1.472 . . 2 . . . . A 29 LYS HG3 . 31134 1 174 . 1 . 1 17 17 LYS HD2 H 1 1.647 . . 1 . . . . A 29 LYS HD2 . 31134 1 175 . 1 . 1 17 17 LYS HD3 H 1 1.647 . . 1 . . . . A 29 LYS HD3 . 31134 1 176 . 1 . 1 17 17 LYS HE2 H 1 2.875 . . 1 . . . . A 29 LYS HE2 . 31134 1 177 . 1 . 1 17 17 LYS HE3 H 1 2.875 . . 1 . . . . A 29 LYS HE3 . 31134 1 178 . 1 . 1 17 17 LYS C C 13 179.640 . . 1 . . . . A 29 LYS C . 31134 1 179 . 1 . 1 17 17 LYS CA C 13 58.609 . . 1 . . . . A 29 LYS CA . 31134 1 180 . 1 . 1 17 17 LYS CB C 13 31.681 . . 1 . . . . A 29 LYS CB . 31134 1 181 . 1 . 1 17 17 LYS CG C 13 24.765 . . 1 . . . . A 29 LYS CG . 31134 1 182 . 1 . 1 17 17 LYS CD C 13 28.743 . . 1 . . . . A 29 LYS CD . 31134 1 183 . 1 . 1 17 17 LYS CE C 13 41.858 . . 1 . . . . A 29 LYS CE . 31134 1 184 . 1 . 1 17 17 LYS N N 15 118.626 . . 1 . . . . A 29 LYS N . 31134 1 185 . 1 . 1 18 18 ASP H H 1 7.974 . . 1 . . . . A 30 ASP H . 31134 1 186 . 1 . 1 18 18 ASP HA H 1 4.346 . . 1 . . . . A 30 ASP HA . 31134 1 187 . 1 . 1 18 18 ASP HB2 H 1 2.776 . . 2 . . . . A 30 ASP HB2 . 31134 1 188 . 1 . 1 18 18 ASP HB3 H 1 2.700 . . 2 . . . . A 30 ASP HB3 . 31134 1 189 . 1 . 1 18 18 ASP C C 13 178.296 . . 1 . . . . A 30 ASP C . 31134 1 190 . 1 . 1 18 18 ASP CA C 13 56.998 . . 1 . . . . A 30 ASP CA . 31134 1 191 . 1 . 1 18 18 ASP CB C 13 40.111 . . 1 . . . . A 30 ASP CB . 31134 1 192 . 1 . 1 18 18 ASP N N 15 120.677 . . 1 . . . . A 30 ASP N . 31134 1 193 . 1 . 1 19 19 LEU H H 1 7.885 . . 1 . . . . A 31 LEU H . 31134 1 194 . 1 . 1 19 19 LEU HA H 1 4.129 . . 1 . . . . A 31 LEU HA . 31134 1 195 . 1 . 1 19 19 LEU HB2 H 1 1.917 . . 2 . . . . A 31 LEU HB2 . 31134 1 196 . 1 . 1 19 19 LEU HB3 H 1 1.543 . . 2 . . . . A 31 LEU HB3 . 31134 1 197 . 1 . 1 19 19 LEU HG H 1 1.898 . . 1 . . . . A 31 LEU HG . 31134 1 198 . 1 . 1 19 19 LEU HD11 H 1 0.894 . . 1 . . . . A 31 LEU HD11 . 31134 1 199 . 1 . 1 19 19 LEU HD12 H 1 0.894 . . 1 . . . . A 31 LEU HD12 . 31134 1 200 . 1 . 1 19 19 LEU HD13 H 1 0.894 . . 1 . . . . A 31 LEU HD13 . 31134 1 201 . 1 . 1 19 19 LEU HD21 H 1 0.913 . . 1 . . . . A 31 LEU HD21 . 31134 1 202 . 1 . 1 19 19 LEU HD22 H 1 0.913 . . 1 . . . . A 31 LEU HD22 . 31134 1 203 . 1 . 1 19 19 LEU HD23 H 1 0.913 . . 1 . . . . A 31 LEU HD23 . 31134 1 204 . 1 . 1 19 19 LEU C C 13 179.236 . . 1 . . . . A 31 LEU C . 31134 1 205 . 1 . 1 19 19 LEU CA C 13 57.319 . . 1 . . . . A 31 LEU CA . 31134 1 206 . 1 . 1 19 19 LEU CB C 13 42.303 . . 1 . . . . A 31 LEU CB . 31134 1 207 . 1 . 1 19 19 LEU CG C 13 26.943 . . 1 . . . . A 31 LEU CG . 31134 1 208 . 1 . 1 19 19 LEU CD1 C 13 26.142 . . 1 . . . . A 31 LEU CD1 . 31134 1 209 . 1 . 1 19 19 LEU CD2 C 13 23.999 . . 1 . . . . A 31 LEU CD2 . 31134 1 210 . 1 . 1 19 19 LEU N N 15 119.706 . . 1 . . . . A 31 LEU N . 31134 1 211 . 1 . 1 20 20 GLU H H 1 7.611 . . 1 . . . . A 32 GLU H . 31134 1 212 . 1 . 1 20 20 GLU HA H 1 4.125 . . 1 . . . . A 32 GLU HA . 31134 1 213 . 1 . 1 20 20 GLU HB2 H 1 2.089 . . 1 . . . . A 32 GLU HB2 . 31134 1 214 . 1 . 1 20 20 GLU HB3 H 1 2.089 . . 1 . . . . A 32 GLU HB3 . 31134 1 215 . 1 . 1 20 20 GLU HG2 H 1 2.455 . . 2 . . . . A 32 GLU HG2 . 31134 1 216 . 1 . 1 20 20 GLU HG3 H 1 2.200 . . 2 . . . . A 32 GLU HG3 . 31134 1 217 . 1 . 1 20 20 GLU C C 13 177.525 . . 1 . . . . A 32 GLU C . 31134 1 218 . 1 . 1 20 20 GLU CA C 13 58.011 . . 1 . . . . A 32 GLU CA . 31134 1 219 . 1 . 1 20 20 GLU CB C 13 29.329 . . 1 . . . . A 32 GLU CB . 31134 1 220 . 1 . 1 20 20 GLU CG C 13 36.432 . . 1 . . . . A 32 GLU CG . 31134 1 221 . 1 . 1 20 20 GLU N N 15 117.580 . . 1 . . . . A 32 GLU N . 31134 1 222 . 1 . 1 21 21 ARG H H 1 7.526 . . 1 . . . . A 33 ARG H . 31134 1 223 . 1 . 1 21 21 ARG HA H 1 4.283 . . 1 . . . . A 33 ARG HA . 31134 1 224 . 1 . 1 21 21 ARG HB2 H 1 1.987 . . 2 . . . . A 33 ARG HB2 . 31134 1 225 . 1 . 1 21 21 ARG HB3 H 1 1.856 . . 2 . . . . A 33 ARG HB3 . 31134 1 226 . 1 . 1 21 21 ARG HG2 H 1 1.718 . . 2 . . . . A 33 ARG HG2 . 31134 1 227 . 1 . 1 21 21 ARG HG3 H 1 1.616 . . 2 . . . . A 33 ARG HG3 . 31134 1 228 . 1 . 1 21 21 ARG HD2 H 1 3.195 . . 1 . . . . A 33 ARG HD2 . 31134 1 229 . 1 . 1 21 21 ARG HD3 H 1 3.195 . . 1 . . . . A 33 ARG HD3 . 31134 1 230 . 1 . 1 21 21 ARG C C 13 177.139 . . 1 . . . . A 33 ARG C . 31134 1 231 . 1 . 1 21 21 ARG CA C 13 57.058 . . 1 . . . . A 33 ARG CA . 31134 1 232 . 1 . 1 21 21 ARG CB C 13 30.893 . . 1 . . . . A 33 ARG CB . 31134 1 233 . 1 . 1 21 21 ARG CG C 13 27.075 . . 1 . . . . A 33 ARG CG . 31134 1 234 . 1 . 1 21 21 ARG CD C 13 43.360 . . 1 . . . . A 33 ARG CD . 31134 1 235 . 1 . 1 21 21 ARG N N 15 118.314 . . 1 . . . . A 33 ARG N . 31134 1 236 . 1 . 1 22 22 ASP H H 1 7.957 . . 1 . . . . A 34 ASP H . 31134 1 237 . 1 . 1 22 22 ASP HA H 1 4.638 . . 1 . . . . A 34 ASP HA . 31134 1 238 . 1 . 1 22 22 ASP HB2 H 1 2.740 . . 2 . . . . A 34 ASP HB2 . 31134 1 239 . 1 . 1 22 22 ASP HB3 H 1 2.659 . . 2 . . . . A 34 ASP HB3 . 31134 1 240 . 1 . 1 22 22 ASP C C 13 176.738 . . 1 . . . . A 34 ASP C . 31134 1 241 . 1 . 1 22 22 ASP CA C 13 55.074 . . 1 . . . . A 34 ASP CA . 31134 1 242 . 1 . 1 22 22 ASP CB C 13 41.394 . . 1 . . . . A 34 ASP CB . 31134 1 243 . 1 . 1 22 22 ASP N N 15 118.557 . . 1 . . . . A 34 ASP N . 31134 1 244 . 1 . 1 23 23 SER H H 1 8.086 . . 1 . . . . A 35 SER H . 31134 1 245 . 1 . 1 23 23 SER HA H 1 4.383 . . 1 . . . . A 35 SER HA . 31134 1 246 . 1 . 1 23 23 SER HB2 H 1 3.938 . . 2 . . . . A 35 SER HB2 . 31134 1 247 . 1 . 1 23 23 SER HB3 H 1 3.860 . . 2 . . . . A 35 SER HB3 . 31134 1 248 . 1 . 1 23 23 SER CA C 13 58.824 . . 1 . . . . A 35 SER CA . 31134 1 249 . 1 . 1 23 23 SER CB C 13 63.137 . . 1 . . . . A 35 SER CB . 31134 1 250 . 1 . 1 23 23 SER N N 15 115.331 . . 1 . . . . A 35 SER N . 31134 1 251 . 1 . 1 24 24 LEU H H 1 8.317 . . 1 . . . . A 36 LEU H . 31134 1 252 . 1 . 1 24 24 LEU HA H 1 4.446 . . 1 . . . . A 36 LEU HA . 31134 1 253 . 1 . 1 24 24 LEU HB2 H 1 1.760 . . 2 . . . . A 36 LEU HB2 . 31134 1 254 . 1 . 1 24 24 LEU HB3 H 1 1.627 . . 2 . . . . A 36 LEU HB3 . 31134 1 255 . 1 . 1 24 24 LEU HG H 1 1.670 . . 1 . . . . A 36 LEU HG . 31134 1 256 . 1 . 1 24 24 LEU HD11 H 1 0.929 . . 2 . . . . A 36 LEU HD11 . 31134 1 257 . 1 . 1 24 24 LEU HD12 H 1 0.929 . . 2 . . . . A 36 LEU HD12 . 31134 1 258 . 1 . 1 24 24 LEU HD13 H 1 0.929 . . 2 . . . . A 36 LEU HD13 . 31134 1 259 . 1 . 1 24 24 LEU HD21 H 1 0.874 . . 2 . . . . A 36 LEU HD21 . 31134 1 260 . 1 . 1 24 24 LEU HD22 H 1 0.874 . . 2 . . . . A 36 LEU HD22 . 31134 1 261 . 1 . 1 24 24 LEU HD23 H 1 0.874 . . 2 . . . . A 36 LEU HD23 . 31134 1 262 . 1 . 1 24 24 LEU C C 13 178.056 . . 1 . . . . A 36 LEU C . 31134 1 263 . 1 . 1 24 24 LEU CA C 13 55.296 . . 1 . . . . A 36 LEU CA . 31134 1 264 . 1 . 1 24 24 LEU CB C 13 43.590 . . 1 . . . . A 36 LEU CB . 31134 1 265 . 1 . 1 24 24 LEU CG C 13 27.108 . . 1 . . . . A 36 LEU CG . 31134 1 266 . 1 . 1 24 24 LEU CD1 C 13 25.456 . . 2 . . . . A 36 LEU CD1 . 31134 1 267 . 1 . 1 24 24 LEU CD2 C 13 23.102 . . 2 . . . . A 36 LEU CD2 . 31134 1 268 . 1 . 1 24 24 LEU N N 15 123.536 . . 1 . . . . A 36 LEU N . 31134 1 269 . 1 . 1 25 25 THR H H 1 7.940 . . 1 . . . . A 37 THR H . 31134 1 270 . 1 . 1 25 25 THR HA H 1 4.507 . . 1 . . . . A 37 THR HA . 31134 1 271 . 1 . 1 25 25 THR HB H 1 4.559 . . 1 . . . . A 37 THR HB . 31134 1 272 . 1 . 1 25 25 THR HG21 H 1 1.303 . . 1 . . . . A 37 THR HG21 . 31134 1 273 . 1 . 1 25 25 THR HG22 H 1 1.303 . . 1 . . . . A 37 THR HG22 . 31134 1 274 . 1 . 1 25 25 THR HG23 H 1 1.303 . . 1 . . . . A 37 THR HG23 . 31134 1 275 . 1 . 1 25 25 THR C C 13 174.836 . . 1 . . . . A 37 THR C . 31134 1 276 . 1 . 1 25 25 THR CA C 13 60.383 . . 1 . . . . A 37 THR CA . 31134 1 277 . 1 . 1 25 25 THR CB C 13 71.513 . . 1 . . . . A 37 THR CB . 31134 1 278 . 1 . 1 25 25 THR CG2 C 13 21.927 . . 1 . . . . A 37 THR CG2 . 31134 1 279 . 1 . 1 25 25 THR N N 15 109.722 . . 1 . . . . A 37 THR N . 31134 1 280 . 1 . 1 26 26 GLU H H 1 8.859 . . 1 . . . . A 38 GLU H . 31134 1 281 . 1 . 1 26 26 GLU HA H 1 4.034 . . 1 . . . . A 38 GLU HA . 31134 1 282 . 1 . 1 26 26 GLU HB2 H 1 2.051 . . 1 . . . . A 38 GLU HB2 . 31134 1 283 . 1 . 1 26 26 GLU HB3 H 1 2.051 . . 1 . . . . A 38 GLU HB3 . 31134 1 284 . 1 . 1 26 26 GLU HG2 H 1 2.338 . . 1 . . . . A 38 GLU HG2 . 31134 1 285 . 1 . 1 26 26 GLU HG3 H 1 2.338 . . 1 . . . . A 38 GLU HG3 . 31134 1 286 . 1 . 1 26 26 GLU C C 13 178.353 . . 1 . . . . A 38 GLU C . 31134 1 287 . 1 . 1 26 26 GLU CA C 13 59.858 . . 1 . . . . A 38 GLU CA . 31134 1 288 . 1 . 1 26 26 GLU CB C 13 29.622 . . 1 . . . . A 38 GLU CB . 31134 1 289 . 1 . 1 26 26 GLU CG C 13 36.680 . . 1 . . . . A 38 GLU CG . 31134 1 290 . 1 . 1 26 26 GLU N N 15 123.172 . . 1 . . . . A 38 GLU N . 31134 1 291 . 1 . 1 27 27 LYS H H 1 8.538 . . 1 . . . . A 39 LYS H . 31134 1 292 . 1 . 1 27 27 LYS HA H 1 3.951 . . 1 . . . . A 39 LYS HA . 31134 1 293 . 1 . 1 27 27 LYS HB2 H 1 1.878 . . 2 . . . . A 39 LYS HB2 . 31134 1 294 . 1 . 1 27 27 LYS HB3 H 1 1.764 . . 2 . . . . A 39 LYS HB3 . 31134 1 295 . 1 . 1 27 27 LYS HG2 H 1 1.446 . . 2 . . . . A 39 LYS HG2 . 31134 1 296 . 1 . 1 27 27 LYS HG3 H 1 1.390 . . 2 . . . . A 39 LYS HG3 . 31134 1 297 . 1 . 1 27 27 LYS HD2 H 1 1.656 . . 1 . . . . A 39 LYS HD2 . 31134 1 298 . 1 . 1 27 27 LYS HD3 H 1 1.656 . . 1 . . . . A 39 LYS HD3 . 31134 1 299 . 1 . 1 27 27 LYS HE2 H 1 2.952 . . 1 . . . . A 39 LYS HE2 . 31134 1 300 . 1 . 1 27 27 LYS HE3 H 1 2.952 . . 1 . . . . A 39 LYS HE3 . 31134 1 301 . 1 . 1 27 27 LYS C C 13 178.315 . . 1 . . . . A 39 LYS C . 31134 1 302 . 1 . 1 27 27 LYS CA C 13 59.957 . . 1 . . . . A 39 LYS CA . 31134 1 303 . 1 . 1 27 27 LYS CB C 13 32.401 . . 1 . . . . A 39 LYS CB . 31134 1 304 . 1 . 1 27 27 LYS CG C 13 24.931 . . 1 . . . . A 39 LYS CG . 31134 1 305 . 1 . 1 27 27 LYS CD C 13 29.146 . . 1 . . . . A 39 LYS CD . 31134 1 306 . 1 . 1 27 27 LYS CE C 13 41.972 . . 1 . . . . A 39 LYS CE . 31134 1 307 . 1 . 1 27 27 LYS N N 15 117.856 . . 1 . . . . A 39 LYS N . 31134 1 308 . 1 . 1 28 28 GLU H H 1 7.605 . . 1 . . . . A 40 GLU H . 31134 1 309 . 1 . 1 28 28 GLU HA H 1 4.029 . . 1 . . . . A 40 GLU HA . 31134 1 310 . 1 . 1 28 28 GLU HB2 H 1 2.116 . . 1 . . . . A 40 GLU HB2 . 31134 1 311 . 1 . 1 28 28 GLU HB3 H 1 2.116 . . 1 . . . . A 40 GLU HB3 . 31134 1 312 . 1 . 1 28 28 GLU HG2 H 1 2.320 . . 2 . . . . A 40 GLU HG2 . 31134 1 313 . 1 . 1 28 28 GLU HG3 H 1 2.288 . . 2 . . . . A 40 GLU HG3 . 31134 1 314 . 1 . 1 28 28 GLU C C 13 177.989 . . 1 . . . . A 40 GLU C . 31134 1 315 . 1 . 1 28 28 GLU CA C 13 58.904 . . 1 . . . . A 40 GLU CA . 31134 1 316 . 1 . 1 28 28 GLU CB C 13 30.159 . . 1 . . . . A 40 GLU CB . 31134 1 317 . 1 . 1 28 28 GLU CG C 13 36.871 . . 1 . . . . A 40 GLU CG . 31134 1 318 . 1 . 1 28 28 GLU N N 15 118.511 . . 1 . . . . A 40 GLU N . 31134 1 319 . 1 . 1 29 29 CYS H H 1 8.438 . . 1 . . . . A 41 CYS H . 31134 1 320 . 1 . 1 29 29 CYS HA H 1 4.003 . . 1 . . . . A 41 CYS HA . 31134 1 321 . 1 . 1 29 29 CYS HB2 H 1 3.116 . . 2 . . . . A 41 CYS HB2 . 31134 1 322 . 1 . 1 29 29 CYS HB3 H 1 3.090 . . 2 . . . . A 41 CYS HB3 . 31134 1 323 . 1 . 1 29 29 CYS HG H 1 2.109 . . 1 . . . . A 41 CYS HG . 31134 1 324 . 1 . 1 29 29 CYS C C 13 176.588 . . 1 . . . . A 41 CYS C . 31134 1 325 . 1 . 1 29 29 CYS CA C 13 62.204 . . 1 . . . . A 41 CYS CA . 31134 1 326 . 1 . 1 29 29 CYS CB C 13 26.955 . . 1 . . . . A 41 CYS CB . 31134 1 327 . 1 . 1 29 29 CYS N N 15 119.610 . . 1 . . . . A 41 CYS N . 31134 1 328 . 1 . 1 30 30 VAL H H 1 8.466 . . 1 . . . . A 42 VAL H . 31134 1 329 . 1 . 1 30 30 VAL HA H 1 3.428 . . 1 . . . . A 42 VAL HA . 31134 1 330 . 1 . 1 30 30 VAL HB H 1 2.078 . . 1 . . . . A 42 VAL HB . 31134 1 331 . 1 . 1 30 30 VAL HG11 H 1 1.037 . . 1 . . . . A 42 VAL HG11 . 31134 1 332 . 1 . 1 30 30 VAL HG12 H 1 1.037 . . 1 . . . . A 42 VAL HG12 . 31134 1 333 . 1 . 1 30 30 VAL HG13 H 1 1.037 . . 1 . . . . A 42 VAL HG13 . 31134 1 334 . 1 . 1 30 30 VAL HG21 H 1 0.883 . . 1 . . . . A 42 VAL HG21 . 31134 1 335 . 1 . 1 30 30 VAL HG22 H 1 0.883 . . 1 . . . . A 42 VAL HG22 . 31134 1 336 . 1 . 1 30 30 VAL HG23 H 1 0.883 . . 1 . . . . A 42 VAL HG23 . 31134 1 337 . 1 . 1 30 30 VAL CA C 13 67.424 . . 1 . . . . A 42 VAL CA . 31134 1 338 . 1 . 1 30 30 VAL CB C 13 31.512 . . 1 . . . . A 42 VAL CB . 31134 1 339 . 1 . 1 30 30 VAL CG1 C 13 24.138 . . 1 . . . . A 42 VAL CG1 . 31134 1 340 . 1 . 1 30 30 VAL CG2 C 13 21.862 . . 1 . . . . A 42 VAL CG2 . 31134 1 341 . 1 . 1 30 30 VAL N N 15 118.131 . . 1 . . . . A 42 VAL N . 31134 1 342 . 1 . 1 31 31 LYS H H 1 7.802 . . 1 . . . . A 43 LYS H . 31134 1 343 . 1 . 1 31 31 LYS HA H 1 3.940 . . 1 . . . . A 43 LYS HA . 31134 1 344 . 1 . 1 31 31 LYS HB2 H 1 1.953 . . 1 . . . . A 43 LYS HB2 . 31134 1 345 . 1 . 1 31 31 LYS HB3 H 1 1.953 . . 1 . . . . A 43 LYS HB3 . 31134 1 346 . 1 . 1 31 31 LYS HG2 H 1 1.395 . . 1 . . . . A 43 LYS HG2 . 31134 1 347 . 1 . 1 31 31 LYS HG3 H 1 1.395 . . 1 . . . . A 43 LYS HG3 . 31134 1 348 . 1 . 1 31 31 LYS HD2 H 1 1.713 . . 1 . . . . A 43 LYS HD2 . 31134 1 349 . 1 . 1 31 31 LYS HD3 H 1 1.713 . . 1 . . . . A 43 LYS HD3 . 31134 1 350 . 1 . 1 31 31 LYS HE2 H 1 2.928 . . 1 . . . . A 43 LYS HE2 . 31134 1 351 . 1 . 1 31 31 LYS HE3 H 1 2.928 . . 1 . . . . A 43 LYS HE3 . 31134 1 352 . 1 . 1 31 31 LYS C C 13 179.343 . . 1 . . . . A 43 LYS C . 31134 1 353 . 1 . 1 31 31 LYS CA C 13 60.076 . . 1 . . . . A 43 LYS CA . 31134 1 354 . 1 . 1 31 31 LYS CB C 13 32.035 . . 1 . . . . A 43 LYS CB . 31134 1 355 . 1 . 1 31 31 LYS CG C 13 24.906 . . 1 . . . . A 43 LYS CG . 31134 1 356 . 1 . 1 31 31 LYS CD C 13 29.259 . . 1 . . . . A 43 LYS CD . 31134 1 357 . 1 . 1 31 31 LYS CE C 13 41.718 . . 1 . . . . A 43 LYS CE . 31134 1 358 . 1 . 1 31 31 LYS N N 15 119.074 . . 1 . . . . A 43 LYS N . 31134 1 359 . 1 . 1 32 32 GLU H H 1 8.190 . . 1 . . . . A 44 GLU H . 31134 1 360 . 1 . 1 32 32 GLU HA H 1 4.262 . . 1 . . . . A 44 GLU HA . 31134 1 361 . 1 . 1 32 32 GLU HB2 H 1 2.095 . . 1 . . . . A 44 GLU HB2 . 31134 1 362 . 1 . 1 32 32 GLU HB3 H 1 2.095 . . 1 . . . . A 44 GLU HB3 . 31134 1 363 . 1 . 1 32 32 GLU HG2 H 1 2.448 . . 2 . . . . A 44 GLU HG2 . 31134 1 364 . 1 . 1 32 32 GLU HG3 H 1 2.385 . . 2 . . . . A 44 GLU HG3 . 31134 1 365 . 1 . 1 32 32 GLU C C 13 179.848 . . 1 . . . . A 44 GLU C . 31134 1 366 . 1 . 1 32 32 GLU CA C 13 58.625 . . 1 . . . . A 44 GLU CA . 31134 1 367 . 1 . 1 32 32 GLU CB C 13 29.441 . . 1 . . . . A 44 GLU CB . 31134 1 368 . 1 . 1 32 32 GLU CG C 13 35.665 . . 1 . . . . A 44 GLU CG . 31134 1 369 . 1 . 1 32 32 GLU N N 15 118.013 . . 1 . . . . A 44 GLU N . 31134 1 370 . 1 . 1 33 33 LYS H H 1 8.749 . . 1 . . . . A 45 LYS H . 31134 1 371 . 1 . 1 33 33 LYS HA H 1 3.764 . . 1 . . . . A 45 LYS HA . 31134 1 372 . 1 . 1 33 33 LYS HB2 H 1 2.006 . . 2 . . . . A 45 LYS HB2 . 31134 1 373 . 1 . 1 33 33 LYS HB3 H 1 1.586 . . 2 . . . . A 45 LYS HB3 . 31134 1 374 . 1 . 1 33 33 LYS HG2 H 1 1.827 . . 2 . . . . A 45 LYS HG2 . 31134 1 375 . 1 . 1 33 33 LYS HG3 H 1 1.165 . . 2 . . . . A 45 LYS HG3 . 31134 1 376 . 1 . 1 33 33 LYS HD2 H 1 1.544 . . 1 . . . . A 45 LYS HD2 . 31134 1 377 . 1 . 1 33 33 LYS HD3 H 1 1.544 . . 1 . . . . A 45 LYS HD3 . 31134 1 378 . 1 . 1 33 33 LYS HE2 H 1 2.788 . . 1 . . . . A 45 LYS HE2 . 31134 1 379 . 1 . 1 33 33 LYS HE3 H 1 2.788 . . 1 . . . . A 45 LYS HE3 . 31134 1 380 . 1 . 1 33 33 LYS C C 13 178.216 . . 1 . . . . A 45 LYS C . 31134 1 381 . 1 . 1 33 33 LYS CA C 13 60.998 . . 1 . . . . A 45 LYS CA . 31134 1 382 . 1 . 1 33 33 LYS CB C 13 33.007 . . 1 . . . . A 45 LYS CB . 31134 1 383 . 1 . 1 33 33 LYS CG C 13 27.063 . . 1 . . . . A 45 LYS CG . 31134 1 384 . 1 . 1 33 33 LYS CD C 13 30.670 . . 1 . . . . A 45 LYS CD . 31134 1 385 . 1 . 1 33 33 LYS CE C 13 43.352 . . 1 . . . . A 45 LYS CE . 31134 1 386 . 1 . 1 33 33 LYS N N 15 121.771 . . 1 . . . . A 45 LYS N . 31134 1 387 . 1 . 1 34 34 LEU H H 1 8.464 . . 1 . . . . A 46 LEU H . 31134 1 388 . 1 . 1 34 34 LEU HA H 1 3.911 . . 1 . . . . A 46 LEU HA . 31134 1 389 . 1 . 1 34 34 LEU HB2 H 1 1.849 . . 2 . . . . A 46 LEU HB2 . 31134 1 390 . 1 . 1 34 34 LEU HB3 H 1 1.598 . . 2 . . . . A 46 LEU HB3 . 31134 1 391 . 1 . 1 34 34 LEU HG H 1 1.818 . . 1 . . . . A 46 LEU HG . 31134 1 392 . 1 . 1 34 34 LEU HD11 H 1 0.913 . . 1 . . . . A 46 LEU HD11 . 31134 1 393 . 1 . 1 34 34 LEU HD12 H 1 0.913 . . 1 . . . . A 46 LEU HD12 . 31134 1 394 . 1 . 1 34 34 LEU HD13 H 1 0.913 . . 1 . . . . A 46 LEU HD13 . 31134 1 395 . 1 . 1 34 34 LEU HD21 H 1 0.857 . . 1 . . . . A 46 LEU HD21 . 31134 1 396 . 1 . 1 34 34 LEU HD22 H 1 0.857 . . 1 . . . . A 46 LEU HD22 . 31134 1 397 . 1 . 1 34 34 LEU HD23 H 1 0.857 . . 1 . . . . A 46 LEU HD23 . 31134 1 398 . 1 . 1 34 34 LEU C C 13 178.964 . . 1 . . . . A 46 LEU C . 31134 1 399 . 1 . 1 34 34 LEU CA C 13 58.453 . . 1 . . . . A 46 LEU CA . 31134 1 400 . 1 . 1 34 34 LEU CB C 13 41.263 . . 1 . . . . A 46 LEU CB . 31134 1 401 . 1 . 1 34 34 LEU CG C 13 26.951 . . 1 . . . . A 46 LEU CG . 31134 1 402 . 1 . 1 34 34 LEU CD1 C 13 25.628 . . 1 . . . . A 46 LEU CD1 . 31134 1 403 . 1 . 1 34 34 LEU CD2 C 13 24.294 . . 1 . . . . A 46 LEU CD2 . 31134 1 404 . 1 . 1 34 34 LEU N N 15 118.515 . . 1 . . . . A 46 LEU N . 31134 1 405 . 1 . 1 35 35 ASN H H 1 7.766 . . 1 . . . . A 47 ASN H . 31134 1 406 . 1 . 1 35 35 ASN HA H 1 4.478 . . 1 . . . . A 47 ASN HA . 31134 1 407 . 1 . 1 35 35 ASN HB2 H 1 2.903 . . 1 . . . . A 47 ASN HB2 . 31134 1 408 . 1 . 1 35 35 ASN HB3 H 1 2.903 . . 1 . . . . A 47 ASN HB3 . 31134 1 409 . 1 . 1 35 35 ASN HD21 H 1 7.696 . . 2 . . . . A 47 ASN HD21 . 31134 1 410 . 1 . 1 35 35 ASN HD22 H 1 6.819 . . 2 . . . . A 47 ASN HD22 . 31134 1 411 . 1 . 1 35 35 ASN C C 13 177.639 . . 1 . . . . A 47 ASN C . 31134 1 412 . 1 . 1 35 35 ASN CA C 13 55.925 . . 1 . . . . A 47 ASN CA . 31134 1 413 . 1 . 1 35 35 ASN CB C 13 38.433 . . 1 . . . . A 47 ASN CB . 31134 1 414 . 1 . 1 35 35 ASN N N 15 116.739 . . 1 . . . . A 47 ASN N . 31134 1 415 . 1 . 1 35 35 ASN ND2 N 15 112.710 . . 1 . . . . A 47 ASN ND2 . 31134 1 416 . 1 . 1 36 36 LEU H H 1 7.967 . . 1 . . . . A 48 LEU H . 31134 1 417 . 1 . 1 36 36 LEU HA H 1 4.257 . . 1 . . . . A 48 LEU HA . 31134 1 418 . 1 . 1 36 36 LEU HB2 H 1 1.853 . . 2 . . . . A 48 LEU HB2 . 31134 1 419 . 1 . 1 36 36 LEU HB3 H 1 1.660 . . 2 . . . . A 48 LEU HB3 . 31134 1 420 . 1 . 1 36 36 LEU HG H 1 1.770 . . 1 . . . . A 48 LEU HG . 31134 1 421 . 1 . 1 36 36 LEU HD11 H 1 0.934 . . 1 . . . . A 48 LEU HD11 . 31134 1 422 . 1 . 1 36 36 LEU HD12 H 1 0.934 . . 1 . . . . A 48 LEU HD12 . 31134 1 423 . 1 . 1 36 36 LEU HD13 H 1 0.934 . . 1 . . . . A 48 LEU HD13 . 31134 1 424 . 1 . 1 36 36 LEU HD21 H 1 0.934 . . 1 . . . . A 48 LEU HD21 . 31134 1 425 . 1 . 1 36 36 LEU HD22 H 1 0.934 . . 1 . . . . A 48 LEU HD22 . 31134 1 426 . 1 . 1 36 36 LEU HD23 H 1 0.934 . . 1 . . . . A 48 LEU HD23 . 31134 1 427 . 1 . 1 36 36 LEU C C 13 178.863 . . 1 . . . . A 48 LEU C . 31134 1 428 . 1 . 1 36 36 LEU CA C 13 57.207 . . 1 . . . . A 48 LEU CA . 31134 1 429 . 1 . 1 36 36 LEU CB C 13 43.065 . . 1 . . . . A 48 LEU CB . 31134 1 430 . 1 . 1 36 36 LEU CG C 13 27.103 . . 1 . . . . A 48 LEU CG . 31134 1 431 . 1 . 1 36 36 LEU CD1 C 13 25.118 . . 1 . . . . A 48 LEU CD1 . 31134 1 432 . 1 . 1 36 36 LEU CD2 C 13 25.118 . . 1 . . . . A 48 LEU CD2 . 31134 1 433 . 1 . 1 36 36 LEU N N 15 119.838 . . 1 . . . . A 48 LEU N . 31134 1 434 . 1 . 1 37 37 LEU H H 1 8.197 . . 1 . . . . A 49 LEU H . 31134 1 435 . 1 . 1 37 37 LEU HA H 1 4.499 . . 1 . . . . A 49 LEU HA . 31134 1 436 . 1 . 1 37 37 LEU HB2 H 1 1.832 . . 2 . . . . A 49 LEU HB2 . 31134 1 437 . 1 . 1 37 37 LEU HB3 H 1 1.537 . . 2 . . . . A 49 LEU HB3 . 31134 1 438 . 1 . 1 37 37 LEU HG H 1 1.868 . . 1 . . . . A 49 LEU HG . 31134 1 439 . 1 . 1 37 37 LEU HD11 H 1 0.823 . . 1 . . . . A 49 LEU HD11 . 31134 1 440 . 1 . 1 37 37 LEU HD12 H 1 0.823 . . 1 . . . . A 49 LEU HD12 . 31134 1 441 . 1 . 1 37 37 LEU HD13 H 1 0.823 . . 1 . . . . A 49 LEU HD13 . 31134 1 442 . 1 . 1 37 37 LEU HD21 H 1 0.828 . . 1 . . . . A 49 LEU HD21 . 31134 1 443 . 1 . 1 37 37 LEU HD22 H 1 0.828 . . 1 . . . . A 49 LEU HD22 . 31134 1 444 . 1 . 1 37 37 LEU HD23 H 1 0.828 . . 1 . . . . A 49 LEU HD23 . 31134 1 445 . 1 . 1 37 37 LEU C C 13 178.469 . . 1 . . . . A 49 LEU C . 31134 1 446 . 1 . 1 37 37 LEU CA C 13 55.616 . . 1 . . . . A 49 LEU CA . 31134 1 447 . 1 . 1 37 37 LEU CB C 13 43.435 . . 1 . . . . A 49 LEU CB . 31134 1 448 . 1 . 1 37 37 LEU CG C 13 26.930 . . 1 . . . . A 49 LEU CG . 31134 1 449 . 1 . 1 37 37 LEU CD1 C 13 26.049 . . 1 . . . . A 49 LEU CD1 . 31134 1 450 . 1 . 1 37 37 LEU CD2 C 13 23.725 . . 1 . . . . A 49 LEU CD2 . 31134 1 451 . 1 . 1 37 37 LEU N N 15 114.280 . . 1 . . . . A 49 LEU N . 31134 1 452 . 1 . 1 38 38 HIS H H 1 7.858 . . 1 . . . . A 50 HIS H . 31134 1 453 . 1 . 1 38 38 HIS HA H 1 3.926 . . 1 . . . . A 50 HIS HA . 31134 1 454 . 1 . 1 38 38 HIS HB2 H 1 3.483 . . 2 . . . . A 50 HIS HB2 . 31134 1 455 . 1 . 1 38 38 HIS HB3 H 1 3.155 . . 2 . . . . A 50 HIS HB3 . 31134 1 456 . 1 . 1 38 38 HIS HD2 H 1 6.961 . . 1 . . . . A 50 HIS HD2 . 31134 1 457 . 1 . 1 38 38 HIS C C 13 176.767 . . 1 . . . . A 50 HIS C . 31134 1 458 . 1 . 1 38 38 HIS CA C 13 62.125 . . 1 . . . . A 50 HIS CA . 31134 1 459 . 1 . 1 38 38 HIS CB C 13 30.628 . . 1 . . . . A 50 HIS CB . 31134 1 460 . 1 . 1 38 38 HIS N N 15 119.141 . . 1 . . . . A 50 HIS N . 31134 1 461 . 1 . 1 39 39 GLU H H 1 8.563 . . 1 . . . . A 51 GLU H . 31134 1 462 . 1 . 1 39 39 GLU HA H 1 3.918 . . 1 . . . . A 51 GLU HA . 31134 1 463 . 1 . 1 39 39 GLU HB2 H 1 1.585 . . 2 . . . . A 51 GLU HB2 . 31134 1 464 . 1 . 1 39 39 GLU HB3 H 1 1.496 . . 2 . . . . A 51 GLU HB3 . 31134 1 465 . 1 . 1 39 39 GLU HG2 H 1 1.761 . . 2 . . . . A 51 GLU HG2 . 31134 1 466 . 1 . 1 39 39 GLU HG3 H 1 1.545 . . 2 . . . . A 51 GLU HG3 . 31134 1 467 . 1 . 1 39 39 GLU C C 13 176.645 . . 1 . . . . A 51 GLU C . 31134 1 468 . 1 . 1 39 39 GLU CA C 13 57.788 . . 1 . . . . A 51 GLU CA . 31134 1 469 . 1 . 1 39 39 GLU CB C 13 29.242 . . 1 . . . . A 51 GLU CB . 31134 1 470 . 1 . 1 39 39 GLU CG C 13 35.754 . . 1 . . . . A 51 GLU CG . 31134 1 471 . 1 . 1 39 39 GLU N N 15 113.849 . . 1 . . . . A 51 GLU N . 31134 1 472 . 1 . 1 40 40 PHE H H 1 8.177 . . 1 . . . . A 52 PHE H . 31134 1 473 . 1 . 1 40 40 PHE HA H 1 4.499 . . 1 . . . . A 52 PHE HA . 31134 1 474 . 1 . 1 40 40 PHE HB2 H 1 3.397 . . 1 . . . . A 52 PHE HB2 . 31134 1 475 . 1 . 1 40 40 PHE HB3 H 1 2.754 . . 1 . . . . A 52 PHE HB3 . 31134 1 476 . 1 . 1 40 40 PHE HD1 H 1 7.433 . . 1 . . . . A 52 PHE HD1 . 31134 1 477 . 1 . 1 40 40 PHE HD2 H 1 7.433 . . 1 . . . . A 52 PHE HD2 . 31134 1 478 . 1 . 1 40 40 PHE HE1 H 1 7.294 . . 1 . . . . A 52 PHE HE1 . 31134 1 479 . 1 . 1 40 40 PHE HE2 H 1 7.294 . . 1 . . . . A 52 PHE HE2 . 31134 1 480 . 1 . 1 40 40 PHE C C 13 175.518 . . 1 . . . . A 52 PHE C . 31134 1 481 . 1 . 1 40 40 PHE CA C 13 57.903 . . 1 . . . . A 52 PHE CA . 31134 1 482 . 1 . 1 40 40 PHE CB C 13 40.232 . . 1 . . . . A 52 PHE CB . 31134 1 483 . 1 . 1 40 40 PHE CD1 C 13 131.756 . . 1 . . . . A 52 PHE CD1 . 31134 1 484 . 1 . 1 40 40 PHE CD2 C 13 131.756 . . 1 . . . . A 52 PHE CD2 . 31134 1 485 . 1 . 1 40 40 PHE CE1 C 13 130.300 . . 1 . . . . A 52 PHE CE1 . 31134 1 486 . 1 . 1 40 40 PHE CE2 C 13 130.300 . . 1 . . . . A 52 PHE CE2 . 31134 1 487 . 1 . 1 40 40 PHE N N 15 117.289 . . 1 . . . . A 52 PHE N . 31134 1 488 . 1 . 1 41 41 LEU H H 1 7.106 . . 1 . . . . A 53 LEU H . 31134 1 489 . 1 . 1 41 41 LEU HA H 1 4.373 . . 1 . . . . A 53 LEU HA . 31134 1 490 . 1 . 1 41 41 LEU HB2 H 1 1.631 . . 2 . . . . A 53 LEU HB2 . 31134 1 491 . 1 . 1 41 41 LEU HB3 H 1 1.269 . . 2 . . . . A 53 LEU HB3 . 31134 1 492 . 1 . 1 41 41 LEU HG H 1 1.943 . . 1 . . . . A 53 LEU HG . 31134 1 493 . 1 . 1 41 41 LEU HD11 H 1 0.714 . . 1 . . . . A 53 LEU HD11 . 31134 1 494 . 1 . 1 41 41 LEU HD12 H 1 0.714 . . 1 . . . . A 53 LEU HD12 . 31134 1 495 . 1 . 1 41 41 LEU HD13 H 1 0.714 . . 1 . . . . A 53 LEU HD13 . 31134 1 496 . 1 . 1 41 41 LEU HD21 H 1 0.821 . . 1 . . . . A 53 LEU HD21 . 31134 1 497 . 1 . 1 41 41 LEU HD22 H 1 0.821 . . 1 . . . . A 53 LEU HD22 . 31134 1 498 . 1 . 1 41 41 LEU HD23 H 1 0.821 . . 1 . . . . A 53 LEU HD23 . 31134 1 499 . 1 . 1 41 41 LEU C C 13 177.013 . . 1 . . . . A 53 LEU C . 31134 1 500 . 1 . 1 41 41 LEU CA C 13 54.269 . . 1 . . . . A 53 LEU CA . 31134 1 501 . 1 . 1 41 41 LEU CB C 13 43.144 . . 1 . . . . A 53 LEU CB . 31134 1 502 . 1 . 1 41 41 LEU CG C 13 25.619 . . 1 . . . . A 53 LEU CG . 31134 1 503 . 1 . 1 41 41 LEU CD1 C 13 25.967 . . 1 . . . . A 53 LEU CD1 . 31134 1 504 . 1 . 1 41 41 LEU CD2 C 13 22.581 . . 1 . . . . A 53 LEU CD2 . 31134 1 505 . 1 . 1 41 41 LEU N N 15 118.493 . . 1 . . . . A 53 LEU N . 31134 1 506 . 1 . 1 42 42 GLN H H 1 8.833 . . 1 . . . . A 54 GLN H . 31134 1 507 . 1 . 1 42 42 GLN HA H 1 4.335 . . 1 . . . . A 54 GLN HA . 31134 1 508 . 1 . 1 42 42 GLN HB2 H 1 2.415 . . 2 . . . . A 54 GLN HB2 . 31134 1 509 . 1 . 1 42 42 GLN HB3 H 1 2.023 . . 2 . . . . A 54 GLN HB3 . 31134 1 510 . 1 . 1 42 42 GLN HG2 H 1 2.603 . . 1 . . . . A 54 GLN HG2 . 31134 1 511 . 1 . 1 42 42 GLN HG3 H 1 2.603 . . 1 . . . . A 54 GLN HG3 . 31134 1 512 . 1 . 1 42 42 GLN HE21 H 1 7.793 . . 2 . . . . A 54 GLN HE21 . 31134 1 513 . 1 . 1 42 42 GLN HE22 H 1 6.938 . . 2 . . . . A 54 GLN HE22 . 31134 1 514 . 1 . 1 42 42 GLN CA C 13 55.837 . . 1 . . . . A 54 GLN CA . 31134 1 515 . 1 . 1 42 42 GLN CB C 13 29.539 . . 1 . . . . A 54 GLN CB . 31134 1 516 . 1 . 1 42 42 GLN CG C 13 34.454 . . 1 . . . . A 54 GLN CG . 31134 1 517 . 1 . 1 42 42 GLN N N 15 120.299 . . 1 . . . . A 54 GLN N . 31134 1 518 . 1 . 1 42 42 GLN NE2 N 15 113.340 . . 1 . . . . A 54 GLN NE2 . 31134 1 519 . 1 . 1 43 43 THR HA H 1 3.637 . . 1 . . . . A 55 THR HA . 31134 1 520 . 1 . 1 43 43 THR HB H 1 4.084 . . 1 . . . . A 55 THR HB . 31134 1 521 . 1 . 1 43 43 THR HG21 H 1 1.225 . . 1 . . . . A 55 THR HG21 . 31134 1 522 . 1 . 1 43 43 THR HG22 H 1 1.225 . . 1 . . . . A 55 THR HG22 . 31134 1 523 . 1 . 1 43 43 THR HG23 H 1 1.225 . . 1 . . . . A 55 THR HG23 . 31134 1 524 . 1 . 1 43 43 THR C C 13 175.284 . . 1 . . . . A 55 THR C . 31134 1 525 . 1 . 1 43 43 THR CA C 13 67.365 . . 1 . . . . A 55 THR CA . 31134 1 526 . 1 . 1 43 43 THR CB C 13 69.019 . . 1 . . . . A 55 THR CB . 31134 1 527 . 1 . 1 43 43 THR CG2 C 13 21.992 . . 1 . . . . A 55 THR CG2 . 31134 1 528 . 1 . 1 44 44 GLU H H 1 9.285 . . 1 . . . . A 56 GLU H . 31134 1 529 . 1 . 1 44 44 GLU HA H 1 4.096 . . 1 . . . . A 56 GLU HA . 31134 1 530 . 1 . 1 44 44 GLU HB2 H 1 2.056 . . 2 . . . . A 56 GLU HB2 . 31134 1 531 . 1 . 1 44 44 GLU HB3 H 1 1.969 . . 2 . . . . A 56 GLU HB3 . 31134 1 532 . 1 . 1 44 44 GLU HG2 H 1 2.296 . . 1 . . . . A 56 GLU HG2 . 31134 1 533 . 1 . 1 44 44 GLU HG3 H 1 2.296 . . 1 . . . . A 56 GLU HG3 . 31134 1 534 . 1 . 1 44 44 GLU C C 13 179.096 . . 1 . . . . A 56 GLU C . 31134 1 535 . 1 . 1 44 44 GLU CA C 13 60.163 . . 1 . . . . A 56 GLU CA . 31134 1 536 . 1 . 1 44 44 GLU CB C 13 29.036 . . 1 . . . . A 56 GLU CB . 31134 1 537 . 1 . 1 44 44 GLU CG C 13 36.472 . . 1 . . . . A 56 GLU CG . 31134 1 538 . 1 . 1 44 44 GLU N N 15 119.069 . . 1 . . . . A 56 GLU N . 31134 1 539 . 1 . 1 45 45 ILE H H 1 7.142 . . 1 . . . . A 57 ILE H . 31134 1 540 . 1 . 1 45 45 ILE HA H 1 3.936 . . 1 . . . . A 57 ILE HA . 31134 1 541 . 1 . 1 45 45 ILE HB H 1 2.163 . . 1 . . . . A 57 ILE HB . 31134 1 542 . 1 . 1 45 45 ILE HG12 H 1 1.619 . . 1 . . . . A 57 ILE HG12 . 31134 1 543 . 1 . 1 45 45 ILE HG13 H 1 1.382 . . 1 . . . . A 57 ILE HG13 . 31134 1 544 . 1 . 1 45 45 ILE HG21 H 1 0.941 . . 1 . . . . A 57 ILE HG21 . 31134 1 545 . 1 . 1 45 45 ILE HG22 H 1 0.941 . . 1 . . . . A 57 ILE HG22 . 31134 1 546 . 1 . 1 45 45 ILE HG23 H 1 0.941 . . 1 . . . . A 57 ILE HG23 . 31134 1 547 . 1 . 1 45 45 ILE HD11 H 1 0.819 . . 1 . . . . A 57 ILE HD11 . 31134 1 548 . 1 . 1 45 45 ILE HD12 H 1 0.819 . . 1 . . . . A 57 ILE HD12 . 31134 1 549 . 1 . 1 45 45 ILE HD13 H 1 0.819 . . 1 . . . . A 57 ILE HD13 . 31134 1 550 . 1 . 1 45 45 ILE C C 13 177.880 . . 1 . . . . A 57 ILE C . 31134 1 551 . 1 . 1 45 45 ILE CA C 13 62.740 . . 1 . . . . A 57 ILE CA . 31134 1 552 . 1 . 1 45 45 ILE CB C 13 36.202 . . 1 . . . . A 57 ILE CB . 31134 1 553 . 1 . 1 45 45 ILE CG1 C 13 28.101 . . 1 . . . . A 57 ILE CG1 . 31134 1 554 . 1 . 1 45 45 ILE CG2 C 13 18.230 . . 1 . . . . A 57 ILE CG2 . 31134 1 555 . 1 . 1 45 45 ILE CD1 C 13 11.047 . . 1 . . . . A 57 ILE CD1 . 31134 1 556 . 1 . 1 45 45 ILE N N 15 119.018 . . 1 . . . . A 57 ILE N . 31134 1 557 . 1 . 1 46 46 LYS H H 1 8.065 . . 1 . . . . A 58 LYS H . 31134 1 558 . 1 . 1 46 46 LYS HA H 1 3.859 . . 1 . . . . A 58 LYS HA . 31134 1 559 . 1 . 1 46 46 LYS HB2 H 1 1.911 . . 2 . . . . A 58 LYS HB2 . 31134 1 560 . 1 . 1 46 46 LYS HB3 H 1 1.833 . . 2 . . . . A 58 LYS HB3 . 31134 1 561 . 1 . 1 46 46 LYS HG2 H 1 1.369 . . 2 . . . . A 58 LYS HG2 . 31134 1 562 . 1 . 1 46 46 LYS HG3 H 1 1.095 . . 2 . . . . A 58 LYS HG3 . 31134 1 563 . 1 . 1 46 46 LYS HD2 H 1 1.572 . . 2 . . . . A 58 LYS HD2 . 31134 1 564 . 1 . 1 46 46 LYS HD3 H 1 1.503 . . 2 . . . . A 58 LYS HD3 . 31134 1 565 . 1 . 1 46 46 LYS HE2 H 1 2.841 . . 2 . . . . A 58 LYS HE2 . 31134 1 566 . 1 . 1 46 46 LYS HE3 H 1 2.670 . . 2 . . . . A 58 LYS HE3 . 31134 1 567 . 1 . 1 46 46 LYS C C 13 179.668 . . 1 . . . . A 58 LYS C . 31134 1 568 . 1 . 1 46 46 LYS CA C 13 61.132 . . 1 . . . . A 58 LYS CA . 31134 1 569 . 1 . 1 46 46 LYS CB C 13 32.058 . . 1 . . . . A 58 LYS CB . 31134 1 570 . 1 . 1 46 46 LYS CG C 13 26.597 . . 1 . . . . A 58 LYS CG . 31134 1 571 . 1 . 1 46 46 LYS CD C 13 29.590 . . 1 . . . . A 58 LYS CD . 31134 1 572 . 1 . 1 46 46 LYS CE C 13 41.656 . . 1 . . . . A 58 LYS CE . 31134 1 573 . 1 . 1 46 46 LYS N N 15 120.817 . . 1 . . . . A 58 LYS N . 31134 1 574 . 1 . 1 47 47 ASN H H 1 8.548 . . 1 . . . . A 59 ASN H . 31134 1 575 . 1 . 1 47 47 ASN HA H 1 4.462 . . 1 . . . . A 59 ASN HA . 31134 1 576 . 1 . 1 47 47 ASN HB2 H 1 2.913 . . 1 . . . . A 59 ASN HB2 . 31134 1 577 . 1 . 1 47 47 ASN HB3 H 1 2.913 . . 1 . . . . A 59 ASN HB3 . 31134 1 578 . 1 . 1 47 47 ASN HD21 H 1 7.634 . . 2 . . . . A 59 ASN HD21 . 31134 1 579 . 1 . 1 47 47 ASN HD22 H 1 6.845 . . 2 . . . . A 59 ASN HD22 . 31134 1 580 . 1 . 1 47 47 ASN C C 13 178.187 . . 1 . . . . A 59 ASN C . 31134 1 581 . 1 . 1 47 47 ASN CA C 13 55.963 . . 1 . . . . A 59 ASN CA . 31134 1 582 . 1 . 1 47 47 ASN CB C 13 37.334 . . 1 . . . . A 59 ASN CB . 31134 1 583 . 1 . 1 47 47 ASN N N 15 118.126 . . 1 . . . . A 59 ASN N . 31134 1 584 . 1 . 1 47 47 ASN ND2 N 15 111.284 . . 1 . . . . A 59 ASN ND2 . 31134 1 585 . 1 . 1 48 48 GLN H H 1 7.762 . . 1 . . . . A 60 GLN H . 31134 1 586 . 1 . 1 48 48 GLN HA H 1 4.157 . . 1 . . . . A 60 GLN HA . 31134 1 587 . 1 . 1 48 48 GLN HB2 H 1 2.243 . . 2 . . . . A 60 GLN HB2 . 31134 1 588 . 1 . 1 48 48 GLN HB3 H 1 2.131 . . 2 . . . . A 60 GLN HB3 . 31134 1 589 . 1 . 1 48 48 GLN HG2 H 1 2.660 . . 2 . . . . A 60 GLN HG2 . 31134 1 590 . 1 . 1 48 48 GLN HG3 H 1 2.368 . . 2 . . . . A 60 GLN HG3 . 31134 1 591 . 1 . 1 48 48 GLN HE21 H 1 7.247 . . 2 . . . . A 60 GLN HE21 . 31134 1 592 . 1 . 1 48 48 GLN HE22 H 1 6.772 . . 2 . . . . A 60 GLN HE22 . 31134 1 593 . 1 . 1 48 48 GLN C C 13 179.184 . . 1 . . . . A 60 GLN C . 31134 1 594 . 1 . 1 48 48 GLN CA C 13 59.344 . . 1 . . . . A 60 GLN CA . 31134 1 595 . 1 . 1 48 48 GLN CB C 13 29.256 . . 1 . . . . A 60 GLN CB . 31134 1 596 . 1 . 1 48 48 GLN CG C 13 34.747 . . 1 . . . . A 60 GLN CG . 31134 1 597 . 1 . 1 48 48 GLN N N 15 121.199 . . 1 . . . . A 60 GLN N . 31134 1 598 . 1 . 1 48 48 GLN NE2 N 15 110.333 . . 1 . . . . A 60 GLN NE2 . 31134 1 599 . 1 . 1 49 49 LEU H H 1 8.637 . . 1 . . . . A 61 LEU H . 31134 1 600 . 1 . 1 49 49 LEU HA H 1 4.020 . . 1 . . . . A 61 LEU HA . 31134 1 601 . 1 . 1 49 49 LEU HB2 H 1 2.091 . . 2 . . . . A 61 LEU HB2 . 31134 1 602 . 1 . 1 49 49 LEU HB3 H 1 1.638 . . 2 . . . . A 61 LEU HB3 . 31134 1 603 . 1 . 1 49 49 LEU HG H 1 1.814 . . 1 . . . . A 61 LEU HG . 31134 1 604 . 1 . 1 49 49 LEU HD11 H 1 0.883 . . 1 . . . . A 61 LEU HD11 . 31134 1 605 . 1 . 1 49 49 LEU HD12 H 1 0.883 . . 1 . . . . A 61 LEU HD12 . 31134 1 606 . 1 . 1 49 49 LEU HD13 H 1 0.883 . . 1 . . . . A 61 LEU HD13 . 31134 1 607 . 1 . 1 49 49 LEU HD21 H 1 0.883 . . 1 . . . . A 61 LEU HD21 . 31134 1 608 . 1 . 1 49 49 LEU HD22 H 1 0.883 . . 1 . . . . A 61 LEU HD22 . 31134 1 609 . 1 . 1 49 49 LEU HD23 H 1 0.883 . . 1 . . . . A 61 LEU HD23 . 31134 1 610 . 1 . 1 49 49 LEU C C 13 179.885 . . 1 . . . . A 61 LEU C . 31134 1 611 . 1 . 1 49 49 LEU CA C 13 58.528 . . 1 . . . . A 61 LEU CA . 31134 1 612 . 1 . 1 49 49 LEU CB C 13 41.160 . . 1 . . . . A 61 LEU CB . 31134 1 613 . 1 . 1 49 49 LEU CG C 13 27.103 . . 1 . . . . A 61 LEU CG . 31134 1 614 . 1 . 1 49 49 LEU CD1 C 13 24.812 . . 1 . . . . A 61 LEU CD1 . 31134 1 615 . 1 . 1 49 49 LEU CD2 C 13 24.624 . . 1 . . . . A 61 LEU CD2 . 31134 1 616 . 1 . 1 49 49 LEU N N 15 120.787 . . 1 . . . . A 61 LEU N . 31134 1 617 . 1 . 1 50 50 CYS H H 1 8.210 . . 1 . . . . A 62 CYS H . 31134 1 618 . 1 . 1 50 50 CYS HA H 1 4.324 . . 1 . . . . A 62 CYS HA . 31134 1 619 . 1 . 1 50 50 CYS HB2 H 1 3.111 . . 1 . . . . A 62 CYS HB2 . 31134 1 620 . 1 . 1 50 50 CYS HB3 H 1 3.111 . . 1 . . . . A 62 CYS HB3 . 31134 1 621 . 1 . 1 50 50 CYS HG H 1 2.284 . . 1 . . . . A 62 CYS HG . 31134 1 622 . 1 . 1 50 50 CYS C C 13 177.373 . . 1 . . . . A 62 CYS C . 31134 1 623 . 1 . 1 50 50 CYS CA C 13 62.809 . . 1 . . . . A 62 CYS CA . 31134 1 624 . 1 . 1 50 50 CYS CB C 13 26.415 . . 1 . . . . A 62 CYS CB . 31134 1 625 . 1 . 1 50 50 CYS N N 15 120.377 . . 1 . . . . A 62 CYS N . 31134 1 626 . 1 . 1 51 51 ASP H H 1 7.877 . . 1 . . . . A 63 ASP H . 31134 1 627 . 1 . 1 51 51 ASP HA H 1 4.442 . . 1 . . . . A 63 ASP HA . 31134 1 628 . 1 . 1 51 51 ASP HB2 H 1 2.777 . . 1 . . . . A 63 ASP HB2 . 31134 1 629 . 1 . 1 51 51 ASP HB3 H 1 2.777 . . 1 . . . . A 63 ASP HB3 . 31134 1 630 . 1 . 1 51 51 ASP C C 13 178.504 . . 1 . . . . A 63 ASP C . 31134 1 631 . 1 . 1 51 51 ASP CA C 13 57.787 . . 1 . . . . A 63 ASP CA . 31134 1 632 . 1 . 1 51 51 ASP CB C 13 41.155 . . 1 . . . . A 63 ASP CB . 31134 1 633 . 1 . 1 51 51 ASP N N 15 121.673 . . 1 . . . . A 63 ASP N . 31134 1 634 . 1 . 1 52 52 LEU H H 1 8.167 . . 1 . . . . A 64 LEU H . 31134 1 635 . 1 . 1 52 52 LEU HA H 1 4.031 . . 1 . . . . A 64 LEU HA . 31134 1 636 . 1 . 1 52 52 LEU HB2 H 1 2.141 . . 2 . . . . A 64 LEU HB2 . 31134 1 637 . 1 . 1 52 52 LEU HB3 H 1 1.495 . . 2 . . . . A 64 LEU HB3 . 31134 1 638 . 1 . 1 52 52 LEU HG H 1 2.010 . . 1 . . . . A 64 LEU HG . 31134 1 639 . 1 . 1 52 52 LEU HD11 H 1 0.763 . . 1 . . . . A 64 LEU HD11 . 31134 1 640 . 1 . 1 52 52 LEU HD12 H 1 0.763 . . 1 . . . . A 64 LEU HD12 . 31134 1 641 . 1 . 1 52 52 LEU HD13 H 1 0.763 . . 1 . . . . A 64 LEU HD13 . 31134 1 642 . 1 . 1 52 52 LEU HD21 H 1 0.867 . . 1 . . . . A 64 LEU HD21 . 31134 1 643 . 1 . 1 52 52 LEU HD22 H 1 0.867 . . 1 . . . . A 64 LEU HD22 . 31134 1 644 . 1 . 1 52 52 LEU HD23 H 1 0.867 . . 1 . . . . A 64 LEU HD23 . 31134 1 645 . 1 . 1 52 52 LEU CA C 13 58.262 . . 1 . . . . A 64 LEU CA . 31134 1 646 . 1 . 1 52 52 LEU CB C 13 41.959 . . 1 . . . . A 64 LEU CB . 31134 1 647 . 1 . 1 52 52 LEU CG C 13 26.890 . . 1 . . . . A 64 LEU CG . 31134 1 648 . 1 . 1 52 52 LEU CD1 C 13 26.585 . . 1 . . . . A 64 LEU CD1 . 31134 1 649 . 1 . 1 52 52 LEU CD2 C 13 23.775 . . 1 . . . . A 64 LEU CD2 . 31134 1 650 . 1 . 1 52 52 LEU N N 15 119.136 . . 1 . . . . A 64 LEU N . 31134 1 651 . 1 . 1 53 53 GLU H H 1 8.160 . . 1 . . . . A 65 GLU H . 31134 1 652 . 1 . 1 53 53 GLU HA H 1 3.845 . . 1 . . . . A 65 GLU HA . 31134 1 653 . 1 . 1 53 53 GLU HB2 H 1 2.276 . . 1 . . . . A 65 GLU HB2 . 31134 1 654 . 1 . 1 53 53 GLU HB3 H 1 2.276 . . 1 . . . . A 65 GLU HB3 . 31134 1 655 . 1 . 1 53 53 GLU HG2 H 1 2.269 . . 1 . . . . A 65 GLU HG2 . 31134 1 656 . 1 . 1 53 53 GLU HG3 H 1 2.269 . . 1 . . . . A 65 GLU HG3 . 31134 1 657 . 1 . 1 53 53 GLU C C 13 178.848 . . 1 . . . . A 65 GLU C . 31134 1 658 . 1 . 1 53 53 GLU CA C 13 59.849 . . 1 . . . . A 65 GLU CA . 31134 1 659 . 1 . 1 53 53 GLU CB C 13 29.103 . . 1 . . . . A 65 GLU CB . 31134 1 660 . 1 . 1 53 53 GLU CG C 13 36.638 . . 1 . . . . A 65 GLU CG . 31134 1 661 . 1 . 1 53 53 GLU N N 15 119.413 . . 1 . . . . A 65 GLU N . 31134 1 662 . 1 . 1 54 54 THR H H 1 8.286 . . 1 . . . . A 66 THR H . 31134 1 663 . 1 . 1 54 54 THR HA H 1 3.865 . . 1 . . . . A 66 THR HA . 31134 1 664 . 1 . 1 54 54 THR HB H 1 4.451 . . 1 . . . . A 66 THR HB . 31134 1 665 . 1 . 1 54 54 THR HG21 H 1 1.223 . . 1 . . . . A 66 THR HG21 . 31134 1 666 . 1 . 1 54 54 THR HG22 H 1 1.223 . . 1 . . . . A 66 THR HG22 . 31134 1 667 . 1 . 1 54 54 THR HG23 H 1 1.223 . . 1 . . . . A 66 THR HG23 . 31134 1 668 . 1 . 1 54 54 THR C C 13 176.059 . . 1 . . . . A 66 THR C . 31134 1 669 . 1 . 1 54 54 THR CA C 13 66.827 . . 1 . . . . A 66 THR CA . 31134 1 670 . 1 . 1 54 54 THR CB C 13 68.461 . . 1 . . . . A 66 THR CB . 31134 1 671 . 1 . 1 54 54 THR CG2 C 13 21.969 . . 1 . . . . A 66 THR CG2 . 31134 1 672 . 1 . 1 54 54 THR N N 15 117.616 . . 1 . . . . A 66 THR N . 31134 1 673 . 1 . 1 55 55 LYS H H 1 8.012 . . 1 . . . . A 67 LYS H . 31134 1 674 . 1 . 1 55 55 LYS HA H 1 3.883 . . 1 . . . . A 67 LYS HA . 31134 1 675 . 1 . 1 55 55 LYS HB2 H 1 2.036 . . 2 . . . . A 67 LYS HB2 . 31134 1 676 . 1 . 1 55 55 LYS HB3 H 1 1.615 . . 2 . . . . A 67 LYS HB3 . 31134 1 677 . 1 . 1 55 55 LYS HG2 H 1 1.689 . . 2 . . . . A 67 LYS HG2 . 31134 1 678 . 1 . 1 55 55 LYS HG3 H 1 1.481 . . 2 . . . . A 67 LYS HG3 . 31134 1 679 . 1 . 1 55 55 LYS HD2 H 1 1.585 . . 1 . . . . A 67 LYS HD2 . 31134 1 680 . 1 . 1 55 55 LYS HD3 H 1 1.585 . . 1 . . . . A 67 LYS HD3 . 31134 1 681 . 1 . 1 55 55 LYS HE2 H 1 2.959 . . 1 . . . . A 67 LYS HE2 . 31134 1 682 . 1 . 1 55 55 LYS HE3 H 1 2.959 . . 1 . . . . A 67 LYS HE3 . 31134 1 683 . 1 . 1 55 55 LYS C C 13 179.010 . . 1 . . . . A 67 LYS C . 31134 1 684 . 1 . 1 55 55 LYS CA C 13 60.340 . . 1 . . . . A 67 LYS CA . 31134 1 685 . 1 . 1 55 55 LYS CB C 13 33.266 . . 1 . . . . A 67 LYS CB . 31134 1 686 . 1 . 1 55 55 LYS CG C 13 26.200 . . 1 . . . . A 67 LYS CG . 31134 1 687 . 1 . 1 55 55 LYS CD C 13 29.265 . . 1 . . . . A 67 LYS CD . 31134 1 688 . 1 . 1 55 55 LYS CE C 13 41.636 . . 1 . . . . A 67 LYS CE . 31134 1 689 . 1 . 1 55 55 LYS N N 15 120.852 . . 1 . . . . A 67 LYS N . 31134 1 690 . 1 . 1 56 56 LEU H H 1 8.173 . . 1 . . . . A 68 LEU H . 31134 1 691 . 1 . 1 56 56 LEU HA H 1 4.302 . . 1 . . . . A 68 LEU HA . 31134 1 692 . 1 . 1 56 56 LEU HB2 H 1 1.851 . . 2 . . . . A 68 LEU HB2 . 31134 1 693 . 1 . 1 56 56 LEU HB3 H 1 1.098 . . 2 . . . . A 68 LEU HB3 . 31134 1 694 . 1 . 1 56 56 LEU HG H 1 1.238 . . 1 . . . . A 68 LEU HG . 31134 1 695 . 1 . 1 56 56 LEU HD11 H 1 0.156 . . 1 . . . . A 68 LEU HD11 . 31134 1 696 . 1 . 1 56 56 LEU HD12 H 1 0.156 . . 1 . . . . A 68 LEU HD12 . 31134 1 697 . 1 . 1 56 56 LEU HD13 H 1 0.156 . . 1 . . . . A 68 LEU HD13 . 31134 1 698 . 1 . 1 56 56 LEU HD21 H 1 0.648 . . 1 . . . . A 68 LEU HD21 . 31134 1 699 . 1 . 1 56 56 LEU HD22 H 1 0.648 . . 1 . . . . A 68 LEU HD22 . 31134 1 700 . 1 . 1 56 56 LEU HD23 H 1 0.648 . . 1 . . . . A 68 LEU HD23 . 31134 1 701 . 1 . 1 56 56 LEU C C 13 180.717 . . 1 . . . . A 68 LEU C . 31134 1 702 . 1 . 1 56 56 LEU CA C 13 58.079 . . 1 . . . . A 68 LEU CA . 31134 1 703 . 1 . 1 56 56 LEU CB C 13 41.827 . . 1 . . . . A 68 LEU CB . 31134 1 704 . 1 . 1 56 56 LEU CG C 13 26.567 . . 1 . . . . A 68 LEU CG . 31134 1 705 . 1 . 1 56 56 LEU CD1 C 13 24.760 . . 1 . . . . A 68 LEU CD1 . 31134 1 706 . 1 . 1 56 56 LEU CD2 C 13 22.999 . . 1 . . . . A 68 LEU CD2 . 31134 1 707 . 1 . 1 56 56 LEU N N 15 121.581 . . 1 . . . . A 68 LEU N . 31134 1 708 . 1 . 1 57 57 ARG H H 1 8.323 . . 1 . . . . A 69 ARG H . 31134 1 709 . 1 . 1 57 57 ARG HA H 1 4.005 . . 1 . . . . A 69 ARG HA . 31134 1 710 . 1 . 1 57 57 ARG HB2 H 1 1.950 . . 1 . . . . A 69 ARG HB2 . 31134 1 711 . 1 . 1 57 57 ARG HB3 H 1 1.950 . . 1 . . . . A 69 ARG HB3 . 31134 1 712 . 1 . 1 57 57 ARG HG2 H 1 1.768 . . 2 . . . . A 69 ARG HG2 . 31134 1 713 . 1 . 1 57 57 ARG HG3 H 1 1.648 . . 2 . . . . A 69 ARG HG3 . 31134 1 714 . 1 . 1 57 57 ARG HD2 H 1 3.182 . . 1 . . . . A 69 ARG HD2 . 31134 1 715 . 1 . 1 57 57 ARG HD3 H 1 3.182 . . 1 . . . . A 69 ARG HD3 . 31134 1 716 . 1 . 1 57 57 ARG C C 13 178.460 . . 1 . . . . A 69 ARG C . 31134 1 717 . 1 . 1 57 57 ARG CA C 13 59.197 . . 1 . . . . A 69 ARG CA . 31134 1 718 . 1 . 1 57 57 ARG CB C 13 29.859 . . 1 . . . . A 69 ARG CB . 31134 1 719 . 1 . 1 57 57 ARG CG C 13 27.679 . . 1 . . . . A 69 ARG CG . 31134 1 720 . 1 . 1 57 57 ARG CD C 13 43.313 . . 1 . . . . A 69 ARG CD . 31134 1 721 . 1 . 1 57 57 ARG N N 15 121.309 . . 1 . . . . A 69 ARG N . 31134 1 722 . 1 . 1 58 58 LYS H H 1 7.871 . . 1 . . . . A 70 LYS H . 31134 1 723 . 1 . 1 58 58 LYS HA H 1 4.270 . . 1 . . . . A 70 LYS HA . 31134 1 724 . 1 . 1 58 58 LYS HB2 H 1 2.068 . . 2 . . . . A 70 LYS HB2 . 31134 1 725 . 1 . 1 58 58 LYS HB3 H 1 1.712 . . 2 . . . . A 70 LYS HB3 . 31134 1 726 . 1 . 1 58 58 LYS HG2 H 1 1.638 . . 2 . . . . A 70 LYS HG2 . 31134 1 727 . 1 . 1 58 58 LYS HG3 H 1 1.446 . . 2 . . . . A 70 LYS HG3 . 31134 1 728 . 1 . 1 58 58 LYS HD2 H 1 1.596 . . 1 . . . . A 70 LYS HD2 . 31134 1 729 . 1 . 1 58 58 LYS HD3 H 1 1.596 . . 1 . . . . A 70 LYS HD3 . 31134 1 730 . 1 . 1 58 58 LYS HE2 H 1 2.906 . . 1 . . . . A 70 LYS HE2 . 31134 1 731 . 1 . 1 58 58 LYS HE3 H 1 2.906 . . 1 . . . . A 70 LYS HE3 . 31134 1 732 . 1 . 1 58 58 LYS C C 13 175.199 . . 1 . . . . A 70 LYS C . 31134 1 733 . 1 . 1 58 58 LYS CA C 13 56.544 . . 1 . . . . A 70 LYS CA . 31134 1 734 . 1 . 1 58 58 LYS CB C 13 32.730 . . 1 . . . . A 70 LYS CB . 31134 1 735 . 1 . 1 58 58 LYS CG C 13 25.502 . . 1 . . . . A 70 LYS CG . 31134 1 736 . 1 . 1 58 58 LYS CD C 13 29.238 . . 1 . . . . A 70 LYS CD . 31134 1 737 . 1 . 1 58 58 LYS CE C 13 41.788 . . 1 . . . . A 70 LYS CE . 31134 1 738 . 1 . 1 58 58 LYS N N 15 116.518 . . 1 . . . . A 70 LYS N . 31134 1 739 . 1 . 1 59 59 GLU H H 1 8.049 . . 1 . . . . A 71 GLU H . 31134 1 740 . 1 . 1 59 59 GLU HA H 1 4.040 . . 1 . . . . A 71 GLU HA . 31134 1 741 . 1 . 1 59 59 GLU HB2 H 1 2.301 . . 2 . . . . A 71 GLU HB2 . 31134 1 742 . 1 . 1 59 59 GLU HB3 H 1 2.231 . . 2 . . . . A 71 GLU HB3 . 31134 1 743 . 1 . 1 59 59 GLU HG2 H 1 2.216 . . 2 . . . . A 71 GLU HG2 . 31134 1 744 . 1 . 1 59 59 GLU HG3 H 1 2.135 . . 2 . . . . A 71 GLU HG3 . 31134 1 745 . 1 . 1 59 59 GLU C C 13 175.908 . . 1 . . . . A 71 GLU C . 31134 1 746 . 1 . 1 59 59 GLU CA C 13 57.829 . . 1 . . . . A 71 GLU CA . 31134 1 747 . 1 . 1 59 59 GLU CB C 13 26.391 . . 1 . . . . A 71 GLU CB . 31134 1 748 . 1 . 1 59 59 GLU CG C 13 36.894 . . 1 . . . . A 71 GLU CG . 31134 1 749 . 1 . 1 59 59 GLU N N 15 113.702 . . 1 . . . . A 71 GLU N . 31134 1 750 . 1 . 1 60 60 GLU H H 1 8.421 . . 1 . . . . A 72 GLU H . 31134 1 751 . 1 . 1 60 60 GLU HA H 1 4.243 . . 1 . . . . A 72 GLU HA . 31134 1 752 . 1 . 1 60 60 GLU HB2 H 1 2.081 . . 2 . . . . A 72 GLU HB2 . 31134 1 753 . 1 . 1 60 60 GLU HB3 H 1 1.805 . . 2 . . . . A 72 GLU HB3 . 31134 1 754 . 1 . 1 60 60 GLU HG2 H 1 2.213 . . 1 . . . . A 72 GLU HG2 . 31134 1 755 . 1 . 1 60 60 GLU HG3 H 1 2.213 . . 1 . . . . A 72 GLU HG3 . 31134 1 756 . 1 . 1 60 60 GLU C C 13 175.952 . . 1 . . . . A 72 GLU C . 31134 1 757 . 1 . 1 60 60 GLU CA C 13 56.936 . . 1 . . . . A 72 GLU CA . 31134 1 758 . 1 . 1 60 60 GLU CB C 13 30.715 . . 1 . . . . A 72 GLU CB . 31134 1 759 . 1 . 1 60 60 GLU CG C 13 36.729 . . 1 . . . . A 72 GLU CG . 31134 1 760 . 1 . 1 60 60 GLU N N 15 117.116 . . 1 . . . . A 72 GLU N . 31134 1 761 . 1 . 1 61 61 LEU H H 1 7.049 . . 1 . . . . A 73 LEU H . 31134 1 762 . 1 . 1 61 61 LEU HA H 1 4.598 . . 1 . . . . A 73 LEU HA . 31134 1 763 . 1 . 1 61 61 LEU HB2 H 1 1.515 . . 2 . . . . A 73 LEU HB2 . 31134 1 764 . 1 . 1 61 61 LEU HB3 H 1 1.257 . . 2 . . . . A 73 LEU HB3 . 31134 1 765 . 1 . 1 61 61 LEU HG H 1 1.730 . . 1 . . . . A 73 LEU HG . 31134 1 766 . 1 . 1 61 61 LEU HD11 H 1 0.976 . . 1 . . . . A 73 LEU HD11 . 31134 1 767 . 1 . 1 61 61 LEU HD12 H 1 0.976 . . 1 . . . . A 73 LEU HD12 . 31134 1 768 . 1 . 1 61 61 LEU HD13 H 1 0.976 . . 1 . . . . A 73 LEU HD13 . 31134 1 769 . 1 . 1 61 61 LEU HD21 H 1 0.976 . . 1 . . . . A 73 LEU HD21 . 31134 1 770 . 1 . 1 61 61 LEU HD22 H 1 0.976 . . 1 . . . . A 73 LEU HD22 . 31134 1 771 . 1 . 1 61 61 LEU HD23 H 1 0.976 . . 1 . . . . A 73 LEU HD23 . 31134 1 772 . 1 . 1 61 61 LEU C C 13 175.032 . . 1 . . . . A 73 LEU C . 31134 1 773 . 1 . 1 61 61 LEU CA C 13 52.994 . . 1 . . . . A 73 LEU CA . 31134 1 774 . 1 . 1 61 61 LEU CB C 13 46.893 . . 1 . . . . A 73 LEU CB . 31134 1 775 . 1 . 1 61 61 LEU CG C 13 26.974 . . 1 . . . . A 73 LEU CG . 31134 1 776 . 1 . 1 61 61 LEU CD1 C 13 25.566 . . 1 . . . . A 73 LEU CD1 . 31134 1 777 . 1 . 1 61 61 LEU CD2 C 13 25.566 . . 1 . . . . A 73 LEU CD2 . 31134 1 778 . 1 . 1 61 61 LEU N N 15 119.259 . . 1 . . . . A 73 LEU N . 31134 1 779 . 1 . 1 62 62 SER H H 1 8.390 . . 1 . . . . A 74 SER H . 31134 1 780 . 1 . 1 62 62 SER HA H 1 4.485 . . 1 . . . . A 74 SER HA . 31134 1 781 . 1 . 1 62 62 SER HB2 H 1 4.381 . . 2 . . . . A 74 SER HB2 . 31134 1 782 . 1 . 1 62 62 SER HB3 H 1 4.037 . . 2 . . . . A 74 SER HB3 . 31134 1 783 . 1 . 1 62 62 SER C C 13 174.504 . . 1 . . . . A 74 SER C . 31134 1 784 . 1 . 1 62 62 SER CA C 13 56.613 . . 1 . . . . A 74 SER CA . 31134 1 785 . 1 . 1 62 62 SER CB C 13 65.338 . . 1 . . . . A 74 SER CB . 31134 1 786 . 1 . 1 62 62 SER N N 15 117.541 . . 1 . . . . A 74 SER N . 31134 1 787 . 1 . 1 63 63 GLU H H 1 9.101 . . 1 . . . . A 75 GLU H . 31134 1 788 . 1 . 1 63 63 GLU HA H 1 3.918 . . 1 . . . . A 75 GLU HA . 31134 1 789 . 1 . 1 63 63 GLU HB2 H 1 2.101 . . 1 . . . . A 75 GLU HB2 . 31134 1 790 . 1 . 1 63 63 GLU HB3 H 1 2.101 . . 1 . . . . A 75 GLU HB3 . 31134 1 791 . 1 . 1 63 63 GLU HG2 H 1 2.293 . . 2 . . . . A 75 GLU HG2 . 31134 1 792 . 1 . 1 63 63 GLU HG3 H 1 2.240 . . 2 . . . . A 75 GLU HG3 . 31134 1 793 . 1 . 1 63 63 GLU C C 13 178.417 . . 1 . . . . A 75 GLU C . 31134 1 794 . 1 . 1 63 63 GLU CA C 13 60.963 . . 1 . . . . A 75 GLU CA . 31134 1 795 . 1 . 1 63 63 GLU CB C 13 29.696 . . 1 . . . . A 75 GLU CB . 31134 1 796 . 1 . 1 63 63 GLU CG C 13 37.176 . . 1 . . . . A 75 GLU CG . 31134 1 797 . 1 . 1 63 63 GLU N N 15 122.158 . . 1 . . . . A 75 GLU N . 31134 1 798 . 1 . 1 64 64 GLU H H 1 8.867 . . 1 . . . . A 76 GLU H . 31134 1 799 . 1 . 1 64 64 GLU HA H 1 4.032 . . 1 . . . . A 76 GLU HA . 31134 1 800 . 1 . 1 64 64 GLU HB2 H 1 2.073 . . 2 . . . . A 76 GLU HB2 . 31134 1 801 . 1 . 1 64 64 GLU HB3 H 1 1.973 . . 2 . . . . A 76 GLU HB3 . 31134 1 802 . 1 . 1 64 64 GLU HG2 H 1 2.331 . . 1 . . . . A 76 GLU HG2 . 31134 1 803 . 1 . 1 64 64 GLU HG3 H 1 2.331 . . 1 . . . . A 76 GLU HG3 . 31134 1 804 . 1 . 1 64 64 GLU C C 13 179.572 . . 1 . . . . A 76 GLU C . 31134 1 805 . 1 . 1 64 64 GLU CA C 13 60.175 . . 1 . . . . A 76 GLU CA . 31134 1 806 . 1 . 1 64 64 GLU CB C 13 29.203 . . 1 . . . . A 76 GLU CB . 31134 1 807 . 1 . 1 64 64 GLU CG C 13 36.555 . . 1 . . . . A 76 GLU CG . 31134 1 808 . 1 . 1 64 64 GLU N N 15 117.639 . . 1 . . . . A 76 GLU N . 31134 1 809 . 1 . 1 65 65 GLY H H 1 8.441 . . 1 . . . . A 77 GLY H . 31134 1 810 . 1 . 1 65 65 GLY HA2 H 1 3.891 . . 2 . . . . A 77 GLY HA2 . 31134 1 811 . 1 . 1 65 65 GLY HA3 H 1 3.768 . . 2 . . . . A 77 GLY HA3 . 31134 1 812 . 1 . 1 65 65 GLY C C 13 176.260 . . 1 . . . . A 77 GLY C . 31134 1 813 . 1 . 1 65 65 GLY CA C 13 46.781 . . 1 . . . . A 77 GLY CA . 31134 1 814 . 1 . 1 65 65 GLY N N 15 110.765 . . 1 . . . . A 77 GLY N . 31134 1 815 . 1 . 1 66 66 TYR H H 1 8.864 . . 1 . . . . A 78 TYR H . 31134 1 816 . 1 . 1 66 66 TYR HA H 1 4.052 . . 1 . . . . A 78 TYR HA . 31134 1 817 . 1 . 1 66 66 TYR HB2 H 1 3.340 . . 2 . . . . A 78 TYR HB2 . 31134 1 818 . 1 . 1 66 66 TYR HB3 H 1 2.917 . . 2 . . . . A 78 TYR HB3 . 31134 1 819 . 1 . 1 66 66 TYR HD1 H 1 6.866 . . 1 . . . . A 78 TYR HD1 . 31134 1 820 . 1 . 1 66 66 TYR HD2 H 1 6.866 . . 1 . . . . A 78 TYR HD2 . 31134 1 821 . 1 . 1 66 66 TYR HE1 H 1 6.486 . . 1 . . . . A 78 TYR HE1 . 31134 1 822 . 1 . 1 66 66 TYR HE2 H 1 6.486 . . 1 . . . . A 78 TYR HE2 . 31134 1 823 . 1 . 1 66 66 TYR C C 13 175.916 . . 1 . . . . A 78 TYR C . 31134 1 824 . 1 . 1 66 66 TYR CA C 13 62.016 . . 1 . . . . A 78 TYR CA . 31134 1 825 . 1 . 1 66 66 TYR CB C 13 39.032 . . 1 . . . . A 78 TYR CB . 31134 1 826 . 1 . 1 66 66 TYR CD1 C 13 133.401 . . 1 . . . . A 78 TYR CD1 . 31134 1 827 . 1 . 1 66 66 TYR CD2 C 13 133.401 . . 1 . . . . A 78 TYR CD2 . 31134 1 828 . 1 . 1 66 66 TYR CE1 C 13 117.789 . . 1 . . . . A 78 TYR CE1 . 31134 1 829 . 1 . 1 66 66 TYR CE2 C 13 117.789 . . 1 . . . . A 78 TYR CE2 . 31134 1 830 . 1 . 1 66 66 TYR N N 15 123.652 . . 1 . . . . A 78 TYR N . 31134 1 831 . 1 . 1 67 67 LEU H H 1 8.557 . . 1 . . . . A 79 LEU H . 31134 1 832 . 1 . 1 67 67 LEU HA H 1 3.658 . . 1 . . . . A 79 LEU HA . 31134 1 833 . 1 . 1 67 67 LEU HB2 H 1 1.934 . . 2 . . . . A 79 LEU HB2 . 31134 1 834 . 1 . 1 67 67 LEU HB3 H 1 1.408 . . 2 . . . . A 79 LEU HB3 . 31134 1 835 . 1 . 1 67 67 LEU HG H 1 2.083 . . 1 . . . . A 79 LEU HG . 31134 1 836 . 1 . 1 67 67 LEU HD11 H 1 0.917 . . 1 . . . . A 79 LEU HD11 . 31134 1 837 . 1 . 1 67 67 LEU HD12 H 1 0.917 . . 1 . . . . A 79 LEU HD12 . 31134 1 838 . 1 . 1 67 67 LEU HD13 H 1 0.917 . . 1 . . . . A 79 LEU HD13 . 31134 1 839 . 1 . 1 67 67 LEU HD21 H 1 0.926 . . 1 . . . . A 79 LEU HD21 . 31134 1 840 . 1 . 1 67 67 LEU HD22 H 1 0.926 . . 1 . . . . A 79 LEU HD22 . 31134 1 841 . 1 . 1 67 67 LEU HD23 H 1 0.926 . . 1 . . . . A 79 LEU HD23 . 31134 1 842 . 1 . 1 67 67 LEU C C 13 178.849 . . 1 . . . . A 79 LEU C . 31134 1 843 . 1 . 1 67 67 LEU CA C 13 57.920 . . 1 . . . . A 79 LEU CA . 31134 1 844 . 1 . 1 67 67 LEU CB C 13 41.474 . . 1 . . . . A 79 LEU CB . 31134 1 845 . 1 . 1 67 67 LEU CG C 13 26.951 . . 1 . . . . A 79 LEU CG . 31134 1 846 . 1 . 1 67 67 LEU CD1 C 13 26.115 . . 1 . . . . A 79 LEU CD1 . 31134 1 847 . 1 . 1 67 67 LEU CD2 C 13 23.446 . . 1 . . . . A 79 LEU CD2 . 31134 1 848 . 1 . 1 67 67 LEU N N 15 119.267 . . 1 . . . . A 79 LEU N . 31134 1 849 . 1 . 1 68 68 ALA H H 1 7.814 . . 1 . . . . A 80 ALA H . 31134 1 850 . 1 . 1 68 68 ALA HA H 1 4.030 . . 1 . . . . A 80 ALA HA . 31134 1 851 . 1 . 1 68 68 ALA HB1 H 1 1.491 . . 1 . . . . A 80 ALA HB1 . 31134 1 852 . 1 . 1 68 68 ALA HB2 H 1 1.491 . . 1 . . . . A 80 ALA HB2 . 31134 1 853 . 1 . 1 68 68 ALA HB3 H 1 1.491 . . 1 . . . . A 80 ALA HB3 . 31134 1 854 . 1 . 1 68 68 ALA C C 13 181.108 . . 1 . . . . A 80 ALA C . 31134 1 855 . 1 . 1 68 68 ALA CA C 13 55.086 . . 1 . . . . A 80 ALA CA . 31134 1 856 . 1 . 1 68 68 ALA CB C 13 18.140 . . 1 . . . . A 80 ALA CB . 31134 1 857 . 1 . 1 68 68 ALA N N 15 119.324 . . 1 . . . . A 80 ALA N . 31134 1 858 . 1 . 1 69 69 LYS H H 1 7.808 . . 1 . . . . A 81 LYS H . 31134 1 859 . 1 . 1 69 69 LYS HA H 1 4.044 . . 1 . . . . A 81 LYS HA . 31134 1 860 . 1 . 1 69 69 LYS HB2 H 1 1.913 . . 2 . . . . A 81 LYS HB2 . 31134 1 861 . 1 . 1 69 69 LYS HB3 H 1 1.777 . . 2 . . . . A 81 LYS HB3 . 31134 1 862 . 1 . 1 69 69 LYS HG2 H 1 1.547 . . 2 . . . . A 81 LYS HG2 . 31134 1 863 . 1 . 1 69 69 LYS HG3 H 1 1.508 . . 2 . . . . A 81 LYS HG3 . 31134 1 864 . 1 . 1 69 69 LYS C C 13 179.581 . . 1 . . . . A 81 LYS C . 31134 1 865 . 1 . 1 69 69 LYS CA C 13 58.810 . . 1 . . . . A 81 LYS CA . 31134 1 866 . 1 . 1 69 69 LYS CB C 13 32.664 . . 1 . . . . A 81 LYS CB . 31134 1 867 . 1 . 1 69 69 LYS CG C 13 24.706 . . 1 . . . . A 81 LYS CG . 31134 1 868 . 1 . 1 69 69 LYS N N 15 119.044 . . 1 . . . . A 81 LYS N . 31134 1 869 . 1 . 1 70 70 VAL H H 1 8.534 . . 1 . . . . A 82 VAL H . 31134 1 870 . 1 . 1 70 70 VAL HA H 1 3.237 . . 1 . . . . A 82 VAL HA . 31134 1 871 . 1 . 1 70 70 VAL HB H 1 1.680 . . 1 . . . . A 82 VAL HB . 31134 1 872 . 1 . 1 70 70 VAL HG11 H 1 0.675 . . 1 . . . . A 82 VAL HG11 . 31134 1 873 . 1 . 1 70 70 VAL HG12 H 1 0.675 . . 1 . . . . A 82 VAL HG12 . 31134 1 874 . 1 . 1 70 70 VAL HG13 H 1 0.675 . . 1 . . . . A 82 VAL HG13 . 31134 1 875 . 1 . 1 70 70 VAL HG21 H 1 0.322 . . 1 . . . . A 82 VAL HG21 . 31134 1 876 . 1 . 1 70 70 VAL HG22 H 1 0.322 . . 1 . . . . A 82 VAL HG22 . 31134 1 877 . 1 . 1 70 70 VAL HG23 H 1 0.322 . . 1 . . . . A 82 VAL HG23 . 31134 1 878 . 1 . 1 70 70 VAL C C 13 177.640 . . 1 . . . . A 82 VAL C . 31134 1 879 . 1 . 1 70 70 VAL CA C 13 67.211 . . 1 . . . . A 82 VAL CA . 31134 1 880 . 1 . 1 70 70 VAL CB C 13 31.557 . . 1 . . . . A 82 VAL CB . 31134 1 881 . 1 . 1 70 70 VAL CG1 C 13 22.411 . . 1 . . . . A 82 VAL CG1 . 31134 1 882 . 1 . 1 70 70 VAL CG2 C 13 22.583 . . 1 . . . . A 82 VAL CG2 . 31134 1 883 . 1 . 1 70 70 VAL N N 15 121.224 . . 1 . . . . A 82 VAL N . 31134 1 884 . 1 . 1 71 71 LYS H H 1 8.185 . . 1 . . . . A 83 LYS H . 31134 1 885 . 1 . 1 71 71 LYS HA H 1 3.692 . . 1 . . . . A 83 LYS HA . 31134 1 886 . 1 . 1 71 71 LYS HB2 H 1 1.801 . . 1 . . . . A 83 LYS HB2 . 31134 1 887 . 1 . 1 71 71 LYS HB3 H 1 1.801 . . 1 . . . . A 83 LYS HB3 . 31134 1 888 . 1 . 1 71 71 LYS HG2 H 1 1.544 . . 2 . . . . A 83 LYS HG2 . 31134 1 889 . 1 . 1 71 71 LYS HG3 H 1 1.298 . . 2 . . . . A 83 LYS HG3 . 31134 1 890 . 1 . 1 71 71 LYS HD2 H 1 1.610 . . 1 . . . . A 83 LYS HD2 . 31134 1 891 . 1 . 1 71 71 LYS HD3 H 1 1.610 . . 1 . . . . A 83 LYS HD3 . 31134 1 892 . 1 . 1 71 71 LYS HE2 H 1 2.816 . . 1 . . . . A 83 LYS HE2 . 31134 1 893 . 1 . 1 71 71 LYS HE3 H 1 2.816 . . 1 . . . . A 83 LYS HE3 . 31134 1 894 . 1 . 1 71 71 LYS C C 13 178.832 . . 1 . . . . A 83 LYS C . 31134 1 895 . 1 . 1 71 71 LYS CA C 13 60.509 . . 1 . . . . A 83 LYS CA . 31134 1 896 . 1 . 1 71 71 LYS CB C 13 32.122 . . 1 . . . . A 83 LYS CB . 31134 1 897 . 1 . 1 71 71 LYS CG C 13 25.818 . . 1 . . . . A 83 LYS CG . 31134 1 898 . 1 . 1 71 71 LYS CD C 13 29.393 . . 1 . . . . A 83 LYS CD . 31134 1 899 . 1 . 1 71 71 LYS CE C 13 41.467 . . 1 . . . . A 83 LYS CE . 31134 1 900 . 1 . 1 71 71 LYS N N 15 118.154 . . 1 . . . . A 83 LYS N . 31134 1 901 . 1 . 1 72 72 SER H H 1 7.534 . . 1 . . . . A 84 SER H . 31134 1 902 . 1 . 1 72 72 SER HA H 1 4.186 . . 1 . . . . A 84 SER HA . 31134 1 903 . 1 . 1 72 72 SER HB2 H 1 3.938 . . 1 . . . . A 84 SER HB2 . 31134 1 904 . 1 . 1 72 72 SER HB3 H 1 3.938 . . 1 . . . . A 84 SER HB3 . 31134 1 905 . 1 . 1 72 72 SER C C 13 176.636 . . 1 . . . . A 84 SER C . 31134 1 906 . 1 . 1 72 72 SER CA C 13 61.527 . . 1 . . . . A 84 SER CA . 31134 1 907 . 1 . 1 72 72 SER CB C 13 62.941 . . 1 . . . . A 84 SER CB . 31134 1 908 . 1 . 1 72 72 SER N N 15 112.230 . . 1 . . . . A 84 SER N . 31134 1 909 . 1 . 1 73 73 LEU H H 1 7.708 . . 1 . . . . A 85 LEU H . 31134 1 910 . 1 . 1 73 73 LEU HA H 1 4.152 . . 1 . . . . A 85 LEU HA . 31134 1 911 . 1 . 1 73 73 LEU HB2 H 1 1.840 . . 2 . . . . A 85 LEU HB2 . 31134 1 912 . 1 . 1 73 73 LEU HB3 H 1 1.486 . . 2 . . . . A 85 LEU HB3 . 31134 1 913 . 1 . 1 73 73 LEU HG H 1 1.729 . . 1 . . . . A 85 LEU HG . 31134 1 914 . 1 . 1 73 73 LEU HD11 H 1 0.818 . . 1 . . . . A 85 LEU HD11 . 31134 1 915 . 1 . 1 73 73 LEU HD12 H 1 0.818 . . 1 . . . . A 85 LEU HD12 . 31134 1 916 . 1 . 1 73 73 LEU HD13 H 1 0.818 . . 1 . . . . A 85 LEU HD13 . 31134 1 917 . 1 . 1 73 73 LEU HD21 H 1 0.838 . . 1 . . . . A 85 LEU HD21 . 31134 1 918 . 1 . 1 73 73 LEU HD22 H 1 0.838 . . 1 . . . . A 85 LEU HD22 . 31134 1 919 . 1 . 1 73 73 LEU HD23 H 1 0.838 . . 1 . . . . A 85 LEU HD23 . 31134 1 920 . 1 . 1 73 73 LEU C C 13 178.719 . . 1 . . . . A 85 LEU C . 31134 1 921 . 1 . 1 73 73 LEU CA C 13 57.670 . . 1 . . . . A 85 LEU CA . 31134 1 922 . 1 . 1 73 73 LEU CB C 13 42.341 . . 1 . . . . A 85 LEU CB . 31134 1 923 . 1 . 1 73 73 LEU CG C 13 26.917 . . 1 . . . . A 85 LEU CG . 31134 1 924 . 1 . 1 73 73 LEU CD1 C 13 25.549 . . 1 . . . . A 85 LEU CD1 . 31134 1 925 . 1 . 1 73 73 LEU CD2 C 13 23.975 . . 1 . . . . A 85 LEU CD2 . 31134 1 926 . 1 . 1 73 73 LEU N N 15 122.164 . . 1 . . . . A 85 LEU N . 31134 1 927 . 1 . 1 74 74 LEU H H 1 8.072 . . 1 . . . . A 86 LEU H . 31134 1 928 . 1 . 1 74 74 LEU HA H 1 4.041 . . 1 . . . . A 86 LEU HA . 31134 1 929 . 1 . 1 74 74 LEU HB2 H 1 1.762 . . 2 . . . . A 86 LEU HB2 . 31134 1 930 . 1 . 1 74 74 LEU HB3 H 1 1.355 . . 2 . . . . A 86 LEU HB3 . 31134 1 931 . 1 . 1 74 74 LEU HG H 1 1.851 . . 1 . . . . A 86 LEU HG . 31134 1 932 . 1 . 1 74 74 LEU HD11 H 1 0.713 . . 1 . . . . A 86 LEU HD11 . 31134 1 933 . 1 . 1 74 74 LEU HD12 H 1 0.713 . . 1 . . . . A 86 LEU HD12 . 31134 1 934 . 1 . 1 74 74 LEU HD13 H 1 0.713 . . 1 . . . . A 86 LEU HD13 . 31134 1 935 . 1 . 1 74 74 LEU HD21 H 1 0.719 . . 1 . . . . A 86 LEU HD21 . 31134 1 936 . 1 . 1 74 74 LEU HD22 H 1 0.719 . . 1 . . . . A 86 LEU HD22 . 31134 1 937 . 1 . 1 74 74 LEU HD23 H 1 0.719 . . 1 . . . . A 86 LEU HD23 . 31134 1 938 . 1 . 1 74 74 LEU C C 13 177.839 . . 1 . . . . A 86 LEU C . 31134 1 939 . 1 . 1 74 74 LEU CA C 13 56.726 . . 1 . . . . A 86 LEU CA . 31134 1 940 . 1 . 1 74 74 LEU CB C 13 41.662 . . 1 . . . . A 86 LEU CB . 31134 1 941 . 1 . 1 74 74 LEU CG C 13 26.503 . . 1 . . . . A 86 LEU CG . 31134 1 942 . 1 . 1 74 74 LEU CD1 C 13 25.686 . . 1 . . . . A 86 LEU CD1 . 31134 1 943 . 1 . 1 74 74 LEU CD2 C 13 22.597 . . 1 . . . . A 86 LEU CD2 . 31134 1 944 . 1 . 1 74 74 LEU N N 15 116.421 . . 1 . . . . A 86 LEU N . 31134 1 945 . 1 . 1 75 75 ASN H H 1 7.780 . . 1 . . . . A 87 ASN H . 31134 1 946 . 1 . 1 75 75 ASN HA H 1 4.576 . . 1 . . . . A 87 ASN HA . 31134 1 947 . 1 . 1 75 75 ASN HB2 H 1 2.851 . . 2 . . . . A 87 ASN HB2 . 31134 1 948 . 1 . 1 75 75 ASN HB3 H 1 2.813 . . 2 . . . . A 87 ASN HB3 . 31134 1 949 . 1 . 1 75 75 ASN HD21 H 1 7.506 . . 2 . . . . A 87 ASN HD21 . 31134 1 950 . 1 . 1 75 75 ASN HD22 H 1 6.808 . . 2 . . . . A 87 ASN HD22 . 31134 1 951 . 1 . 1 75 75 ASN C C 13 176.574 . . 1 . . . . A 87 ASN C . 31134 1 952 . 1 . 1 75 75 ASN CA C 13 54.261 . . 1 . . . . A 87 ASN CA . 31134 1 953 . 1 . 1 75 75 ASN CB C 13 38.719 . . 1 . . . . A 87 ASN CB . 31134 1 954 . 1 . 1 75 75 ASN N N 15 115.533 . . 1 . . . . A 87 ASN N . 31134 1 955 . 1 . 1 75 75 ASN ND2 N 15 111.358 . . 1 . . . . A 87 ASN ND2 . 31134 1 956 . 1 . 1 76 76 LYS H H 1 7.768 . . 1 . . . . A 88 LYS H . 31134 1 957 . 1 . 1 76 76 LYS HA H 1 4.167 . . 1 . . . . A 88 LYS HA . 31134 1 958 . 1 . 1 76 76 LYS HB2 H 1 1.891 . . 1 . . . . A 88 LYS HB2 . 31134 1 959 . 1 . 1 76 76 LYS HB3 H 1 1.891 . . 1 . . . . A 88 LYS HB3 . 31134 1 960 . 1 . 1 76 76 LYS HG2 H 1 1.463 . . 1 . . . . A 88 LYS HG2 . 31134 1 961 . 1 . 1 76 76 LYS HG3 H 1 1.463 . . 1 . . . . A 88 LYS HG3 . 31134 1 962 . 1 . 1 76 76 LYS HD2 H 1 1.640 . . 1 . . . . A 88 LYS HD2 . 31134 1 963 . 1 . 1 76 76 LYS HD3 H 1 1.640 . . 1 . . . . A 88 LYS HD3 . 31134 1 964 . 1 . 1 76 76 LYS CA C 13 58.130 . . 1 . . . . A 88 LYS CA . 31134 1 965 . 1 . 1 76 76 LYS CB C 13 32.687 . . 1 . . . . A 88 LYS CB . 31134 1 966 . 1 . 1 76 76 LYS CG C 13 24.771 . . 1 . . . . A 88 LYS CG . 31134 1 967 . 1 . 1 76 76 LYS CD C 13 29.067 . . 1 . . . . A 88 LYS CD . 31134 1 968 . 1 . 1 76 76 LYS CE C 13 41.834 . . 1 . . . . A 88 LYS CE . 31134 1 969 . 1 . 1 76 76 LYS N N 15 119.972 . . 1 . . . . A 88 LYS N . 31134 1 970 . 1 . 1 77 77 ASP H H 1 8.134 . . 1 . . . . A 89 ASP H . 31134 1 971 . 1 . 1 77 77 ASP HA H 1 4.620 . . 1 . . . . A 89 ASP HA . 31134 1 972 . 1 . 1 77 77 ASP HB2 H 1 2.712 . . 2 . . . . A 89 ASP HB2 . 31134 1 973 . 1 . 1 77 77 ASP HB3 H 1 2.611 . . 2 . . . . A 89 ASP HB3 . 31134 1 974 . 1 . 1 77 77 ASP C C 13 176.785 . . 1 . . . . A 89 ASP C . 31134 1 975 . 1 . 1 77 77 ASP CA C 13 55.826 . . 1 . . . . A 89 ASP CA . 31134 1 976 . 1 . 1 77 77 ASP CB C 13 41.565 . . 1 . . . . A 89 ASP CB . 31134 1 977 . 1 . 1 77 77 ASP N N 15 119.205 . . 1 . . . . A 89 ASP N . 31134 1 978 . 1 . 1 78 78 LEU H H 1 7.926 . . 1 . . . . A 90 LEU H . 31134 1 979 . 1 . 1 78 78 LEU HA H 1 4.355 . . 1 . . . . A 90 LEU HA . 31134 1 980 . 1 . 1 78 78 LEU HB2 H 1 1.702 . . 2 . . . . A 90 LEU HB2 . 31134 1 981 . 1 . 1 78 78 LEU HB3 H 1 1.564 . . 2 . . . . A 90 LEU HB3 . 31134 1 982 . 1 . 1 78 78 LEU HD11 H 1 0.871 . . 2 . . . . A 90 LEU HD11 . 31134 1 983 . 1 . 1 78 78 LEU HD12 H 1 0.871 . . 2 . . . . A 90 LEU HD12 . 31134 1 984 . 1 . 1 78 78 LEU HD13 H 1 0.871 . . 2 . . . . A 90 LEU HD13 . 31134 1 985 . 1 . 1 78 78 LEU HD21 H 1 0.853 . . 2 . . . . A 90 LEU HD21 . 31134 1 986 . 1 . 1 78 78 LEU HD22 H 1 0.853 . . 2 . . . . A 90 LEU HD22 . 31134 1 987 . 1 . 1 78 78 LEU HD23 H 1 0.853 . . 2 . . . . A 90 LEU HD23 . 31134 1 988 . 1 . 1 78 78 LEU CA C 13 55.502 . . 1 . . . . A 90 LEU CA . 31134 1 989 . 1 . 1 78 78 LEU CB C 13 42.306 . . 1 . . . . A 90 LEU CB . 31134 1 990 . 1 . 1 78 78 LEU CD1 C 13 26.118 . . 2 . . . . A 90 LEU CD1 . 31134 1 991 . 1 . 1 78 78 LEU CD2 C 13 23.871 . . 2 . . . . A 90 LEU CD2 . 31134 1 992 . 1 . 1 78 78 LEU N N 15 119.789 . . 1 . . . . A 90 LEU N . 31134 1 993 . 1 . 1 79 79 SER H H 1 8.091 . . 1 . . . . A 91 SER H . 31134 1 994 . 1 . 1 79 79 SER HA H 1 4.337 . . 1 . . . . A 91 SER HA . 31134 1 995 . 1 . 1 79 79 SER HB2 H 1 3.939 . . 2 . . . . A 91 SER HB2 . 31134 1 996 . 1 . 1 79 79 SER HB3 H 1 3.873 . . 2 . . . . A 91 SER HB3 . 31134 1 997 . 1 . 1 79 79 SER C C 13 174.721 . . 1 . . . . A 91 SER C . 31134 1 998 . 1 . 1 79 79 SER CA C 13 58.630 . . 1 . . . . A 91 SER CA . 31134 1 999 . 1 . 1 79 79 SER CB C 13 63.107 . . 1 . . . . A 91 SER CB . 31134 1 1000 . 1 . 1 79 79 SER N N 15 114.987 . . 1 . . . . A 91 SER N . 31134 1 1001 . 1 . 1 80 80 LEU H H 1 8.041 . . 1 . . . . A 92 LEU H . 31134 1 1002 . 1 . 1 80 80 LEU HA H 1 4.326 . . 1 . . . . A 92 LEU HA . 31134 1 1003 . 1 . 1 80 80 LEU HB2 H 1 1.662 . . 2 . . . . A 92 LEU HB2 . 31134 1 1004 . 1 . 1 80 80 LEU HB3 H 1 1.554 . . 2 . . . . A 92 LEU HB3 . 31134 1 1005 . 1 . 1 80 80 LEU HG H 1 1.594 . . 1 . . . . A 92 LEU HG . 31134 1 1006 . 1 . 1 80 80 LEU HD11 H 1 0.853 . . 2 . . . . A 92 LEU HD11 . 31134 1 1007 . 1 . 1 80 80 LEU HD12 H 1 0.853 . . 2 . . . . A 92 LEU HD12 . 31134 1 1008 . 1 . 1 80 80 LEU HD13 H 1 0.853 . . 2 . . . . A 92 LEU HD13 . 31134 1 1009 . 1 . 1 80 80 LEU HD21 H 1 0.787 . . 2 . . . . A 92 LEU HD21 . 31134 1 1010 . 1 . 1 80 80 LEU HD22 H 1 0.787 . . 2 . . . . A 92 LEU HD22 . 31134 1 1011 . 1 . 1 80 80 LEU HD23 H 1 0.787 . . 2 . . . . A 92 LEU HD23 . 31134 1 1012 . 1 . 1 80 80 LEU CA C 13 55.308 . . 1 . . . . A 92 LEU CA . 31134 1 1013 . 1 . 1 80 80 LEU CB C 13 42.032 . . 1 . . . . A 92 LEU CB . 31134 1 1014 . 1 . 1 80 80 LEU CG C 13 26.814 . . 1 . . . . A 92 LEU CG . 31134 1 1015 . 1 . 1 80 80 LEU CD1 C 13 25.747 . . 2 . . . . A 92 LEU CD1 . 31134 1 1016 . 1 . 1 80 80 LEU CD2 C 13 23.477 . . 2 . . . . A 92 LEU CD2 . 31134 1 1017 . 1 . 1 80 80 LEU N N 15 122.106 . . 1 . . . . A 92 LEU N . 31134 1 1018 . 1 . 1 81 81 GLU H H 1 8.270 . . 1 . . . . A 93 GLU H . 31134 1 1019 . 1 . 1 81 81 GLU HB2 H 1 2.010 . . 2 . . . . A 93 GLU HB2 . 31134 1 1020 . 1 . 1 81 81 GLU HB3 H 1 1.877 . . 2 . . . . A 93 GLU HB3 . 31134 1 1021 . 1 . 1 81 81 GLU HG2 H 1 2.187 . . 1 . . . . A 93 GLU HG2 . 31134 1 1022 . 1 . 1 81 81 GLU HG3 H 1 2.187 . . 1 . . . . A 93 GLU HG3 . 31134 1 1023 . 1 . 1 81 81 GLU C C 13 176.302 . . 1 . . . . A 93 GLU C . 31134 1 1024 . 1 . 1 81 81 GLU CA C 13 56.661 . . 1 . . . . A 93 GLU CA . 31134 1 1025 . 1 . 1 81 81 GLU CB C 13 30.291 . . 1 . . . . A 93 GLU CB . 31134 1 1026 . 1 . 1 81 81 GLU N N 15 120.132 . . 1 . . . . A 93 GLU N . 31134 1 stop_ save_