data_15991 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15991 _Entry.Title ; Structure of the Core Binding Domain of sigma54 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-10-19 _Entry.Accession_date 2008-10-19 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.125 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Eunmi Hong . . . 15991 2 'David E.' Wemmer . . . 15991 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15991 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 419 15991 '15N chemical shifts' 126 15991 '1H chemical shifts' 975 15991 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-06-17 2008-10-19 update BMRB 'complete entry citation' 15991 1 . . 2009-05-29 2008-10-19 original author 'original release' 15991 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15991 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19426742 _Citation.Full_citation . _Citation.Title 'Structure of the RNA Polymerase Core-Binding Domain of sigma(54) Reveals a Likely Conformational Fracture Point.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 390 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 70 _Citation.Page_last 82 _Citation.Year 2009 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Eunmi Hong . . . 15991 1 2 Michaeleen Douclaff . . . 15991 1 3 David Wemmer . E. . 15991 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15991 _Assembly.ID 1 _Assembly.Name 'Core Binding Domain' _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 'subunit 1' 1 $Core_Binding_Domain A . yes native no no . . . 15991 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Core_Binding_Domain _Entity.Sf_category entity _Entity.Sf_framecode Core_Binding_Domain _Entity.Entry_ID 15991 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Core_Binding_Domain _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; YTPSELEELQQNIKLELEGK EQELALELLNYLNEKGFLSK SVEEISDVLRCSVEELEKVR QKVLRLEPLGVCSKDVWEFL ELQIEEIYPEEEEILKKALR DLKRGKKLKPEIKGKLSRLR LFPLSSSAEK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 130 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15990 . RNAP . . . . . 51.54 76 100.00 100.00 1.57e-33 . . . . 15991 1 2 no PDB 2K9L . "Structure Of The Core Binding Domain Of Sigma54" . . . . . 51.54 76 100.00 100.00 1.57e-33 . . . . 15991 1 3 no PDB 2K9M . "Structure Of The Core Binding Domain Of Sigma54" . . . . . 100.00 130 100.00 100.00 1.01e-79 . . . . 15991 1 4 no GB AAC06814 . "RNA polymerase sigma factor RpoN [Aquifex aeolicus VF5]" . . . . . 100.00 398 100.00 100.00 1.06e-77 . . . . 15991 1 5 no REF NP_213418 . "RNA polymerase sigma factor RpoN [Aquifex aeolicus VF5]" . . . . . 100.00 398 100.00 100.00 1.06e-77 . . . . 15991 1 6 no REF WP_010880356 . "RNA polymerase sigma-54 factor [Aquifex aeolicus]" . . . . . 100.00 398 100.00 100.00 1.06e-77 . . . . 15991 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 . TYR . 15991 1 2 . THR . 15991 1 3 . PRO . 15991 1 4 . SER . 15991 1 5 . GLU . 15991 1 6 . LEU . 15991 1 7 . GLU . 15991 1 8 . GLU . 15991 1 9 . LEU . 15991 1 10 . GLN . 15991 1 11 . GLN . 15991 1 12 . ASN . 15991 1 13 . ILE . 15991 1 14 . LYS . 15991 1 15 . LEU . 15991 1 16 . GLU . 15991 1 17 . LEU . 15991 1 18 . GLU . 15991 1 19 . GLY . 15991 1 20 . LYS . 15991 1 21 . GLU . 15991 1 22 . GLN . 15991 1 23 . GLU . 15991 1 24 . LEU . 15991 1 25 . ALA . 15991 1 26 . LEU . 15991 1 27 . GLU . 15991 1 28 . LEU . 15991 1 29 . LEU . 15991 1 30 . ASN . 15991 1 31 . TYR . 15991 1 32 . LEU . 15991 1 33 . ASN . 15991 1 34 . GLU . 15991 1 35 . LYS . 15991 1 36 . GLY . 15991 1 37 . PHE . 15991 1 38 . LEU . 15991 1 39 . SER . 15991 1 40 . LYS . 15991 1 41 . SER . 15991 1 42 . VAL . 15991 1 43 . GLU . 15991 1 44 . GLU . 15991 1 45 . ILE . 15991 1 46 . SER . 15991 1 47 . ASP . 15991 1 48 . VAL . 15991 1 49 . LEU . 15991 1 50 . ARG . 15991 1 51 . CYS . 15991 1 52 . SER . 15991 1 53 . VAL . 15991 1 54 . GLU . 15991 1 55 . GLU . 15991 1 56 . LEU . 15991 1 57 . GLU . 15991 1 58 . LYS . 15991 1 59 . VAL . 15991 1 60 . ARG . 15991 1 61 . GLN . 15991 1 62 . LYS . 15991 1 63 . VAL . 15991 1 64 . LEU . 15991 1 65 . ARG . 15991 1 66 . LEU . 15991 1 67 . GLU . 15991 1 68 . PRO . 15991 1 69 . LEU . 15991 1 70 . GLY . 15991 1 71 . VAL . 15991 1 72 . CYS . 15991 1 73 . SER . 15991 1 74 . LYS . 15991 1 75 . ASP . 15991 1 76 . VAL . 15991 1 77 . TRP . 15991 1 78 . GLU . 15991 1 79 . PHE . 15991 1 80 . LEU . 15991 1 81 . GLU . 15991 1 82 . LEU . 15991 1 83 . GLN . 15991 1 84 . ILE . 15991 1 85 . GLU . 15991 1 86 . GLU . 15991 1 87 . ILE . 15991 1 88 . TYR . 15991 1 89 . PRO . 15991 1 90 . GLU . 15991 1 91 . GLU . 15991 1 92 . GLU . 15991 1 93 . GLU . 15991 1 94 . ILE . 15991 1 95 . LEU . 15991 1 96 . LYS . 15991 1 97 . LYS . 15991 1 98 . ALA . 15991 1 99 . LEU . 15991 1 100 . ARG . 15991 1 101 . ASP . 15991 1 102 . LEU . 15991 1 103 . LYS . 15991 1 104 . ARG . 15991 1 105 . GLY . 15991 1 106 . LYS . 15991 1 107 . LYS . 15991 1 108 . LEU . 15991 1 109 . LYS . 15991 1 110 . PRO . 15991 1 111 . GLU . 15991 1 112 . ILE . 15991 1 113 . LYS . 15991 1 114 . GLY . 15991 1 115 . LYS . 15991 1 116 . LEU . 15991 1 117 . SER . 15991 1 118 . ARG . 15991 1 119 . LEU . 15991 1 120 . ARG . 15991 1 121 . LEU . 15991 1 122 . PHE . 15991 1 123 . PRO . 15991 1 124 . LEU . 15991 1 125 . SER . 15991 1 126 . SER . 15991 1 127 . SER . 15991 1 128 . ALA . 15991 1 129 . GLU . 15991 1 130 . LYS . 15991 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 . TYR 1 1 15991 1 . THR 2 2 15991 1 . PRO 3 3 15991 1 . SER 4 4 15991 1 . GLU 5 5 15991 1 . LEU 6 6 15991 1 . GLU 7 7 15991 1 . GLU 8 8 15991 1 . LEU 9 9 15991 1 . GLN 10 10 15991 1 . GLN 11 11 15991 1 . ASN 12 12 15991 1 . ILE 13 13 15991 1 . LYS 14 14 15991 1 . LEU 15 15 15991 1 . GLU 16 16 15991 1 . LEU 17 17 15991 1 . GLU 18 18 15991 1 . GLY 19 19 15991 1 . LYS 20 20 15991 1 . GLU 21 21 15991 1 . GLN 22 22 15991 1 . GLU 23 23 15991 1 . LEU 24 24 15991 1 . ALA 25 25 15991 1 . LEU 26 26 15991 1 . GLU 27 27 15991 1 . LEU 28 28 15991 1 . LEU 29 29 15991 1 . ASN 30 30 15991 1 . TYR 31 31 15991 1 . LEU 32 32 15991 1 . ASN 33 33 15991 1 . GLU 34 34 15991 1 . LYS 35 35 15991 1 . GLY 36 36 15991 1 . PHE 37 37 15991 1 . LEU 38 38 15991 1 . SER 39 39 15991 1 . LYS 40 40 15991 1 . SER 41 41 15991 1 . VAL 42 42 15991 1 . GLU 43 43 15991 1 . GLU 44 44 15991 1 . ILE 45 45 15991 1 . SER 46 46 15991 1 . ASP 47 47 15991 1 . VAL 48 48 15991 1 . LEU 49 49 15991 1 . ARG 50 50 15991 1 . CYS 51 51 15991 1 . SER 52 52 15991 1 . VAL 53 53 15991 1 . GLU 54 54 15991 1 . GLU 55 55 15991 1 . LEU 56 56 15991 1 . GLU 57 57 15991 1 . LYS 58 58 15991 1 . VAL 59 59 15991 1 . ARG 60 60 15991 1 . GLN 61 61 15991 1 . LYS 62 62 15991 1 . VAL 63 63 15991 1 . LEU 64 64 15991 1 . ARG 65 65 15991 1 . LEU 66 66 15991 1 . GLU 67 67 15991 1 . PRO 68 68 15991 1 . LEU 69 69 15991 1 . GLY 70 70 15991 1 . VAL 71 71 15991 1 . CYS 72 72 15991 1 . SER 73 73 15991 1 . LYS 74 74 15991 1 . ASP 75 75 15991 1 . VAL 76 76 15991 1 . TRP 77 77 15991 1 . GLU 78 78 15991 1 . PHE 79 79 15991 1 . LEU 80 80 15991 1 . GLU 81 81 15991 1 . LEU 82 82 15991 1 . GLN 83 83 15991 1 . ILE 84 84 15991 1 . GLU 85 85 15991 1 . GLU 86 86 15991 1 . ILE 87 87 15991 1 . TYR 88 88 15991 1 . PRO 89 89 15991 1 . GLU 90 90 15991 1 . GLU 91 91 15991 1 . GLU 92 92 15991 1 . GLU 93 93 15991 1 . ILE 94 94 15991 1 . LEU 95 95 15991 1 . LYS 96 96 15991 1 . LYS 97 97 15991 1 . ALA 98 98 15991 1 . LEU 99 99 15991 1 . ARG 100 100 15991 1 . ASP 101 101 15991 1 . LEU 102 102 15991 1 . LYS 103 103 15991 1 . ARG 104 104 15991 1 . GLY 105 105 15991 1 . LYS 106 106 15991 1 . LYS 107 107 15991 1 . LEU 108 108 15991 1 . LYS 109 109 15991 1 . PRO 110 110 15991 1 . GLU 111 111 15991 1 . ILE 112 112 15991 1 . LYS 113 113 15991 1 . GLY 114 114 15991 1 . LYS 115 115 15991 1 . LEU 116 116 15991 1 . SER 117 117 15991 1 . ARG 118 118 15991 1 . LEU 119 119 15991 1 . ARG 120 120 15991 1 . LEU 121 121 15991 1 . PHE 122 122 15991 1 . PRO 123 123 15991 1 . LEU 124 124 15991 1 . SER 125 125 15991 1 . SER 126 126 15991 1 . SER 127 127 15991 1 . ALA 128 128 15991 1 . GLU 129 129 15991 1 . LYS 130 130 15991 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 15991 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Core_Binding_Domain . 63363 organism . 'Aquifex aeolicus' 'Aquifex aeolicus' . . Bacteria . Aquifex aeolicus . . . . . . . . . . . . . . . . . . . . . 15991 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 15991 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Core_Binding_Domain . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET21b3-2 . . . . . . 15991 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15991 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 'Core Binding Domain' '[U-100% 13C; U-100% 15N]' . . 1 $Core_Binding_Domain . . 0.6-0.8 . . mM . . . . 15991 1 2 'Core Binding Domain' '[U-100% 15N]' . . 1 $Core_Binding_Domain . . 0.6-0.8 . . mM . . . . 15991 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15991 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 15991 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15991 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 'Core Binding Domain' '[U-100% 13C; U-100% 15N]' . . 1 $Core_Binding_Domain . . 0.6-0.8 . . mM . . . . 15991 2 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . 15991 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15991 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 15991 1 pH 7 . pH 15991 1 pressure 1 . atm 15991 1 temperature 303 . K 15991 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 15991 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 15991 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15991 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15991 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15991 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15991 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15991 _Software.ID 3 _Software.Name SPARKY _Software.Version 3.114 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15991 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15991 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15991 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15991 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15991 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 800 . . . 15991 1 2 spectrometer_2 Bruker DRX . 900 . . . 15991 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 15991 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 5 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15991 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15991 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 15991 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15991 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 15991 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15991 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15991 1 2 '3D HNCACB' . . . 15991 1 7 '3D HBHA(CO)NH' . . . 15991 1 9 '3D HCCH-TOCSY' . . . 15991 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 TYR HA H 1 4.733 0.020 . 1 . . . . 1 TYR HA . 15991 1 2 . 1 1 1 1 TYR HB2 H 1 3.116 0.020 . 2 . . . . 1 TYR HB2 . 15991 1 3 . 1 1 1 1 TYR HB3 H 1 2.998 0.020 . 2 . . . . 1 TYR HB3 . 15991 1 4 . 1 1 1 1 TYR HD1 H 1 7.175 0.020 . 1 . . . . 1 TYR HD1 . 15991 1 5 . 1 1 1 1 TYR HD2 H 1 7.175 0.020 . 1 . . . . 1 TYR HD2 . 15991 1 6 . 1 1 1 1 TYR HE1 H 1 6.884 0.020 . 1 . . . . 1 TYR HE1 . 15991 1 7 . 1 1 1 1 TYR HE2 H 1 6.884 0.020 . 1 . . . . 1 TYR HE2 . 15991 1 8 . 1 1 1 1 TYR CA C 13 58.467 0.400 . 1 . . . . 1 TYR CA . 15991 1 9 . 1 1 1 1 TYR CB C 13 39.692 0.400 . 1 . . . . 1 TYR CB . 15991 1 10 . 1 1 2 2 THR H H 1 8.212 0.020 . 1 . . . . 2 THR H . 15991 1 11 . 1 1 2 2 THR HA H 1 4.593 0.020 . 1 . . . . 2 THR HA . 15991 1 12 . 1 1 2 2 THR HB H 1 4.056 0.020 . 1 . . . . 2 THR HB . 15991 1 13 . 1 1 2 2 THR HG21 H 1 1.245 0.020 . 1 . . . . 2 THR HG2 . 15991 1 14 . 1 1 2 2 THR HG22 H 1 1.245 0.020 . 1 . . . . 2 THR HG2 . 15991 1 15 . 1 1 2 2 THR HG23 H 1 1.245 0.020 . 1 . . . . 2 THR HG2 . 15991 1 16 . 1 1 2 2 THR CA C 13 59.727 0.400 . 1 . . . . 2 THR CA . 15991 1 17 . 1 1 2 2 THR CB C 13 70.584 0.400 . 1 . . . . 2 THR CB . 15991 1 18 . 1 1 2 2 THR CG2 C 13 21.795 0.400 . 1 . . . . 2 THR CG2 . 15991 1 19 . 1 1 2 2 THR N N 15 122.354 0.400 . 1 . . . . 2 THR N . 15991 1 20 . 1 1 3 3 PRO HA H 1 4.490 0.020 . 1 . . . . 3 PRO HA . 15991 1 21 . 1 1 3 3 PRO HB2 H 1 2.473 0.020 . 2 . . . . 3 PRO HB2 . 15991 1 22 . 1 1 3 3 PRO HB3 H 1 2.064 0.020 . 2 . . . . 3 PRO HB3 . 15991 1 23 . 1 1 3 3 PRO HD2 H 1 3.719 0.020 . 2 . . . . 3 PRO HD2 . 15991 1 24 . 1 1 3 3 PRO HD3 H 1 3.719 0.020 . 2 . . . . 3 PRO HD3 . 15991 1 25 . 1 1 3 3 PRO HG2 H 1 2.100 0.020 . 2 . . . . 3 PRO HG2 . 15991 1 26 . 1 1 3 3 PRO HG3 H 1 2.100 0.020 . 2 . . . . 3 PRO HG3 . 15991 1 27 . 1 1 3 3 PRO CA C 13 63.480 0.400 . 1 . . . . 3 PRO CA . 15991 1 28 . 1 1 3 3 PRO CB C 13 32.679 0.400 . 1 . . . . 3 PRO CB . 15991 1 29 . 1 1 3 3 PRO CD C 13 51.577 0.400 . 1 . . . . 3 PRO CD . 15991 1 30 . 1 1 3 3 PRO CG C 13 27.932 0.400 . 1 . . . . 3 PRO CG . 15991 1 31 . 1 1 4 4 SER H H 1 8.741 0.020 . 1 . . . . 4 SER H . 15991 1 32 . 1 1 4 4 SER HA H 1 4.451 0.020 . 1 . . . . 4 SER HA . 15991 1 33 . 1 1 4 4 SER HB2 H 1 4.219 0.020 . 2 . . . . 4 SER HB2 . 15991 1 34 . 1 1 4 4 SER HB3 H 1 4.055 0.020 . 2 . . . . 4 SER HB3 . 15991 1 35 . 1 1 4 4 SER CA C 13 59.925 0.400 . 1 . . . . 4 SER CA . 15991 1 36 . 1 1 4 4 SER CB C 13 64.128 0.400 . 1 . . . . 4 SER CB . 15991 1 37 . 1 1 4 4 SER N N 15 119.415 0.400 . 1 . . . . 4 SER N . 15991 1 38 . 1 1 5 5 GLU H H 1 9.258 0.020 . 1 . . . . 5 GLU H . 15991 1 39 . 1 1 5 5 GLU HA H 1 4.236 0.020 . 1 . . . . 5 GLU HA . 15991 1 40 . 1 1 5 5 GLU HB2 H 1 2.161 0.020 . 2 . . . . 5 GLU HB2 . 15991 1 41 . 1 1 5 5 GLU HB3 H 1 1.991 0.020 . 2 . . . . 5 GLU HB3 . 15991 1 42 . 1 1 5 5 GLU HG2 H 1 2.526 0.020 . 2 . . . . 5 GLU HG2 . 15991 1 43 . 1 1 5 5 GLU HG3 H 1 2.526 0.020 . 2 . . . . 5 GLU HG3 . 15991 1 44 . 1 1 5 5 GLU CA C 13 60.445 0.400 . 1 . . . . 5 GLU CA . 15991 1 45 . 1 1 5 5 GLU CB C 13 30.710 0.400 . 1 . . . . 5 GLU CB . 15991 1 46 . 1 1 5 5 GLU CG C 13 37.711 0.400 . 1 . . . . 5 GLU CG . 15991 1 47 . 1 1 5 5 GLU N N 15 122.594 0.400 . 1 . . . . 5 GLU N . 15991 1 48 . 1 1 6 6 LEU H H 1 7.965 0.020 . 1 . . . . 6 LEU H . 15991 1 49 . 1 1 6 6 LEU HA H 1 4.219 0.020 . 1 . . . . 6 LEU HA . 15991 1 50 . 1 1 6 6 LEU HB2 H 1 1.744 0.020 . 2 . . . . 6 LEU HB2 . 15991 1 51 . 1 1 6 6 LEU HB3 H 1 1.621 0.020 . 2 . . . . 6 LEU HB3 . 15991 1 52 . 1 1 6 6 LEU HD11 H 1 0.991 0.020 . 2 . . . . 6 LEU HD1 . 15991 1 53 . 1 1 6 6 LEU HD12 H 1 0.991 0.020 . 2 . . . . 6 LEU HD1 . 15991 1 54 . 1 1 6 6 LEU HD13 H 1 0.991 0.020 . 2 . . . . 6 LEU HD1 . 15991 1 55 . 1 1 6 6 LEU HD21 H 1 0.930 0.020 . 2 . . . . 6 LEU HD2 . 15991 1 56 . 1 1 6 6 LEU HD22 H 1 0.930 0.020 . 2 . . . . 6 LEU HD2 . 15991 1 57 . 1 1 6 6 LEU HD23 H 1 0.930 0.020 . 2 . . . . 6 LEU HD2 . 15991 1 58 . 1 1 6 6 LEU HG H 1 1.711 0.020 . 1 . . . . 6 LEU HG . 15991 1 59 . 1 1 6 6 LEU CA C 13 57.414 0.400 . 1 . . . . 6 LEU CA . 15991 1 60 . 1 1 6 6 LEU CB C 13 42.415 0.400 . 1 . . . . 6 LEU CB . 15991 1 61 . 1 1 6 6 LEU CD1 C 13 25.450 0.400 . 1 . . . . 6 LEU CD1 . 15991 1 62 . 1 1 6 6 LEU CD2 C 13 24.897 0.400 . 1 . . . . 6 LEU CD2 . 15991 1 63 . 1 1 6 6 LEU CG C 13 27.926 0.400 . 1 . . . . 6 LEU CG . 15991 1 64 . 1 1 6 6 LEU N N 15 117.389 0.400 . 1 . . . . 6 LEU N . 15991 1 65 . 1 1 7 7 GLU H H 1 7.791 0.020 . 1 . . . . 7 GLU H . 15991 1 66 . 1 1 7 7 GLU HA H 1 4.118 0.020 . 1 . . . . 7 GLU HA . 15991 1 67 . 1 1 7 7 GLU HB2 H 1 2.269 0.020 . 2 . . . . 7 GLU HB2 . 15991 1 68 . 1 1 7 7 GLU HB3 H 1 2.153 0.020 . 2 . . . . 7 GLU HB3 . 15991 1 69 . 1 1 7 7 GLU HG2 H 1 2.389 0.020 . 2 . . . . 7 GLU HG2 . 15991 1 70 . 1 1 7 7 GLU HG3 H 1 2.389 0.020 . 2 . . . . 7 GLU HG3 . 15991 1 71 . 1 1 7 7 GLU CA C 13 60.228 0.400 . 1 . . . . 7 GLU CA . 15991 1 72 . 1 1 7 7 GLU CB C 13 30.039 0.400 . 1 . . . . 7 GLU CB . 15991 1 73 . 1 1 7 7 GLU CG C 13 36.400 0.400 . 1 . . . . 7 GLU CG . 15991 1 74 . 1 1 7 7 GLU N N 15 121.135 0.400 . 1 . . . . 7 GLU N . 15991 1 75 . 1 1 8 8 GLU H H 1 8.148 0.020 . 1 . . . . 8 GLU H . 15991 1 76 . 1 1 8 8 GLU HA H 1 4.072 0.020 . 1 . . . . 8 GLU HA . 15991 1 77 . 1 1 8 8 GLU HB2 H 1 2.213 0.020 . 2 . . . . 8 GLU HB2 . 15991 1 78 . 1 1 8 8 GLU HB3 H 1 2.134 0.020 . 2 . . . . 8 GLU HB3 . 15991 1 79 . 1 1 8 8 GLU HG2 H 1 2.351 0.020 . 2 . . . . 8 GLU HG2 . 15991 1 80 . 1 1 8 8 GLU HG3 H 1 2.276 0.020 . 2 . . . . 8 GLU HG3 . 15991 1 81 . 1 1 8 8 GLU CA C 13 60.098 0.400 . 1 . . . . 8 GLU CA . 15991 1 82 . 1 1 8 8 GLU CB C 13 29.960 0.400 . 1 . . . . 8 GLU CB . 15991 1 83 . 1 1 8 8 GLU CG C 13 36.357 0.400 . 1 . . . . 8 GLU CG . 15991 1 84 . 1 1 8 8 GLU N N 15 122.004 0.400 . 1 . . . . 8 GLU N . 15991 1 85 . 1 1 9 9 LEU H H 1 8.074 0.020 . 1 . . . . 9 LEU H . 15991 1 86 . 1 1 9 9 LEU HA H 1 4.546 0.020 . 1 . . . . 9 LEU HA . 15991 1 87 . 1 1 9 9 LEU HB2 H 1 2.052 0.020 . 2 . . . . 9 LEU HB2 . 15991 1 88 . 1 1 9 9 LEU HB3 H 1 1.694 0.020 . 2 . . . . 9 LEU HB3 . 15991 1 89 . 1 1 9 9 LEU HD11 H 1 0.927 0.020 . 2 . . . . 9 LEU HD1 . 15991 1 90 . 1 1 9 9 LEU HD12 H 1 0.927 0.020 . 2 . . . . 9 LEU HD1 . 15991 1 91 . 1 1 9 9 LEU HD13 H 1 0.927 0.020 . 2 . . . . 9 LEU HD1 . 15991 1 92 . 1 1 9 9 LEU HD21 H 1 1.076 0.020 . 2 . . . . 9 LEU HD2 . 15991 1 93 . 1 1 9 9 LEU HD22 H 1 1.076 0.020 . 2 . . . . 9 LEU HD2 . 15991 1 94 . 1 1 9 9 LEU HD23 H 1 1.076 0.020 . 2 . . . . 9 LEU HD2 . 15991 1 95 . 1 1 9 9 LEU HG H 1 0.797 0.020 . 1 . . . . 9 LEU HG . 15991 1 96 . 1 1 9 9 LEU CA C 13 58.449 0.400 . 1 . . . . 9 LEU CA . 15991 1 97 . 1 1 9 9 LEU CB C 13 42.575 0.400 . 1 . . . . 9 LEU CB . 15991 1 98 . 1 1 9 9 LEU CD1 C 13 28.330 0.400 . 1 . . . . 9 LEU CD1 . 15991 1 99 . 1 1 9 9 LEU CD2 C 13 24.470 0.400 . 1 . . . . 9 LEU CD2 . 15991 1 100 . 1 1 9 9 LEU N N 15 120.775 0.400 . 1 . . . . 9 LEU N . 15991 1 101 . 1 1 10 10 GLN H H 1 8.476 0.020 . 1 . . . . 10 GLN H . 15991 1 102 . 1 1 10 10 GLN HA H 1 3.784 0.020 . 1 . . . . 10 GLN HA . 15991 1 103 . 1 1 10 10 GLN HB2 H 1 2.357 0.020 . 2 . . . . 10 GLN HB2 . 15991 1 104 . 1 1 10 10 GLN HB3 H 1 2.066 0.020 . 2 . . . . 10 GLN HB3 . 15991 1 105 . 1 1 10 10 GLN HE21 H 1 6.913 0.020 . 2 . . . . 10 GLN HE21 . 15991 1 106 . 1 1 10 10 GLN HE22 H 1 6.810 0.020 . 2 . . . . 10 GLN HE22 . 15991 1 107 . 1 1 10 10 GLN HG2 H 1 2.590 0.020 . 2 . . . . 10 GLN HG2 . 15991 1 108 . 1 1 10 10 GLN HG3 H 1 2.135 0.020 . 2 . . . . 10 GLN HG3 . 15991 1 109 . 1 1 10 10 GLN CA C 13 60.672 0.400 . 1 . . . . 10 GLN CA . 15991 1 110 . 1 1 10 10 GLN CB C 13 28.981 0.400 . 1 . . . . 10 GLN CB . 15991 1 111 . 1 1 10 10 GLN CG C 13 35.798 0.400 . 1 . . . . 10 GLN CG . 15991 1 112 . 1 1 10 10 GLN N N 15 117.540 0.400 . 1 . . . . 10 GLN N . 15991 1 113 . 1 1 10 10 GLN NE2 N 15 110.018 0.400 . 1 . . . . 10 GLN NE2 . 15991 1 114 . 1 1 11 11 GLN H H 1 7.893 0.020 . 1 . . . . 11 GLN H . 15991 1 115 . 1 1 11 11 GLN HA H 1 4.131 0.020 . 1 . . . . 11 GLN HA . 15991 1 116 . 1 1 11 11 GLN HB2 H 1 2.348 0.020 . 2 . . . . 11 GLN HB2 . 15991 1 117 . 1 1 11 11 GLN HB3 H 1 2.288 0.020 . 2 . . . . 11 GLN HB3 . 15991 1 118 . 1 1 11 11 GLN HE21 H 1 7.511 0.020 . 2 . . . . 11 GLN HE21 . 15991 1 119 . 1 1 11 11 GLN HE22 H 1 6.945 0.020 . 2 . . . . 11 GLN HE22 . 15991 1 120 . 1 1 11 11 GLN HG2 H 1 2.543 0.020 . 2 . . . . 11 GLN HG2 . 15991 1 121 . 1 1 11 11 GLN HG3 H 1 2.543 0.020 . 2 . . . . 11 GLN HG3 . 15991 1 122 . 1 1 11 11 GLN CA C 13 59.315 0.400 . 1 . . . . 11 GLN CA . 15991 1 123 . 1 1 11 11 GLN CB C 13 28.618 0.400 . 1 . . . . 11 GLN CB . 15991 1 124 . 1 1 11 11 GLN CG C 13 34.334 0.400 . 1 . . . . 11 GLN CG . 15991 1 125 . 1 1 11 11 GLN N N 15 118.093 0.400 . 1 . . . . 11 GLN N . 15991 1 126 . 1 1 11 11 GLN NE2 N 15 112.015 0.400 . 1 . . . . 11 GLN NE2 . 15991 1 127 . 1 1 12 12 ASN H H 1 8.331 0.020 . 1 . . . . 12 ASN H . 15991 1 128 . 1 1 12 12 ASN HA H 1 4.883 0.020 . 1 . . . . 12 ASN HA . 15991 1 129 . 1 1 12 12 ASN HB2 H 1 3.130 0.020 . 2 . . . . 12 ASN HB2 . 15991 1 130 . 1 1 12 12 ASN HB3 H 1 2.966 0.020 . 2 . . . . 12 ASN HB3 . 15991 1 131 . 1 1 12 12 ASN HD21 H 1 8.234 0.020 . 2 . . . . 12 ASN HD21 . 15991 1 132 . 1 1 12 12 ASN HD22 H 1 7.539 0.020 . 2 . . . . 12 ASN HD22 . 15991 1 133 . 1 1 12 12 ASN CA C 13 56.868 0.400 . 1 . . . . 12 ASN CA . 15991 1 134 . 1 1 12 12 ASN CB C 13 38.580 0.400 . 1 . . . . 12 ASN CB . 15991 1 135 . 1 1 12 12 ASN N N 15 119.994 0.400 . 1 . . . . 12 ASN N . 15991 1 136 . 1 1 12 12 ASN ND2 N 15 116.894 0.400 . 1 . . . . 12 ASN ND2 . 15991 1 137 . 1 1 13 13 ILE H H 1 9.154 0.020 . 1 . . . . 13 ILE H . 15991 1 138 . 1 1 13 13 ILE HA H 1 3.514 0.020 . 1 . . . . 13 ILE HA . 15991 1 139 . 1 1 13 13 ILE HB H 1 2.137 0.020 . 1 . . . . 13 ILE HB . 15991 1 140 . 1 1 13 13 ILE HD11 H 1 0.827 0.020 . 1 . . . . 13 ILE HD1 . 15991 1 141 . 1 1 13 13 ILE HD12 H 1 0.827 0.020 . 1 . . . . 13 ILE HD1 . 15991 1 142 . 1 1 13 13 ILE HD13 H 1 0.827 0.020 . 1 . . . . 13 ILE HD1 . 15991 1 143 . 1 1 13 13 ILE HG12 H 1 1.975 0.020 . 2 . . . . 13 ILE HG12 . 15991 1 144 . 1 1 13 13 ILE HG13 H 1 0.746 0.020 . 2 . . . . 13 ILE HG13 . 15991 1 145 . 1 1 13 13 ILE HG21 H 1 0.911 0.020 . 1 . . . . 13 ILE HG2 . 15991 1 146 . 1 1 13 13 ILE HG22 H 1 0.911 0.020 . 1 . . . . 13 ILE HG2 . 15991 1 147 . 1 1 13 13 ILE HG23 H 1 0.911 0.020 . 1 . . . . 13 ILE HG2 . 15991 1 148 . 1 1 13 13 ILE CA C 13 66.858 0.400 . 1 . . . . 13 ILE CA . 15991 1 149 . 1 1 13 13 ILE CB C 13 38.818 0.400 . 1 . . . . 13 ILE CB . 15991 1 150 . 1 1 13 13 ILE CD1 C 13 15.838 0.400 . 1 . . . . 13 ILE CD1 . 15991 1 151 . 1 1 13 13 ILE CG1 C 13 31.112 0.400 . 1 . . . . 13 ILE CG1 . 15991 1 152 . 1 1 13 13 ILE CG2 C 13 19.391 0.400 . 1 . . . . 13 ILE CG2 . 15991 1 153 . 1 1 13 13 ILE N N 15 123.707 0.400 . 1 . . . . 13 ILE N . 15991 1 154 . 1 1 14 14 LYS H H 1 7.698 0.020 . 1 . . . . 14 LYS H . 15991 1 155 . 1 1 14 14 LYS HA H 1 4.120 0.020 . 1 . . . . 14 LYS HA . 15991 1 156 . 1 1 14 14 LYS HB2 H 1 1.992 0.020 . 2 . . . . 14 LYS HB2 . 15991 1 157 . 1 1 14 14 LYS HB3 H 1 1.992 0.020 . 2 . . . . 14 LYS HB3 . 15991 1 158 . 1 1 14 14 LYS HD2 H 1 1.769 0.020 . 2 . . . . 14 LYS HD2 . 15991 1 159 . 1 1 14 14 LYS HD3 H 1 1.724 0.020 . 2 . . . . 14 LYS HD3 . 15991 1 160 . 1 1 14 14 LYS HE2 H 1 2.946 0.020 . 2 . . . . 14 LYS HE2 . 15991 1 161 . 1 1 14 14 LYS HE3 H 1 2.946 0.020 . 2 . . . . 14 LYS HE3 . 15991 1 162 . 1 1 14 14 LYS HG2 H 1 1.782 0.020 . 2 . . . . 14 LYS HG2 . 15991 1 163 . 1 1 14 14 LYS HG3 H 1 1.365 0.020 . 2 . . . . 14 LYS HG3 . 15991 1 164 . 1 1 14 14 LYS CA C 13 59.383 0.400 . 1 . . . . 14 LYS CA . 15991 1 165 . 1 1 14 14 LYS CB C 13 32.700 0.400 . 1 . . . . 14 LYS CB . 15991 1 166 . 1 1 14 14 LYS CD C 13 29.874 0.400 . 1 . . . . 14 LYS CD . 15991 1 167 . 1 1 14 14 LYS CE C 13 42.566 0.400 . 1 . . . . 14 LYS CE . 15991 1 168 . 1 1 14 14 LYS CG C 13 27.258 0.400 . 1 . . . . 14 LYS CG . 15991 1 169 . 1 1 14 14 LYS N N 15 116.991 0.400 . 1 . . . . 14 LYS N . 15991 1 170 . 1 1 15 15 LEU H H 1 7.803 0.020 . 1 . . . . 15 LEU H . 15991 1 171 . 1 1 15 15 LEU HA H 1 4.444 0.020 . 1 . . . . 15 LEU HA . 15991 1 172 . 1 1 15 15 LEU HB2 H 1 2.063 0.020 . 2 . . . . 15 LEU HB2 . 15991 1 173 . 1 1 15 15 LEU HB3 H 1 1.780 0.020 . 2 . . . . 15 LEU HB3 . 15991 1 174 . 1 1 15 15 LEU HD11 H 1 1.048 0.020 . 2 . . . . 15 LEU HD1 . 15991 1 175 . 1 1 15 15 LEU HD12 H 1 1.048 0.020 . 2 . . . . 15 LEU HD1 . 15991 1 176 . 1 1 15 15 LEU HD13 H 1 1.048 0.020 . 2 . . . . 15 LEU HD1 . 15991 1 177 . 1 1 15 15 LEU HD21 H 1 1.016 0.020 . 2 . . . . 15 LEU HD2 . 15991 1 178 . 1 1 15 15 LEU HD22 H 1 1.016 0.020 . 2 . . . . 15 LEU HD2 . 15991 1 179 . 1 1 15 15 LEU HD23 H 1 1.016 0.020 . 2 . . . . 15 LEU HD2 . 15991 1 180 . 1 1 15 15 LEU HG H 1 1.906 0.020 . 1 . . . . 15 LEU HG . 15991 1 181 . 1 1 15 15 LEU CA C 13 57.093 0.400 . 1 . . . . 15 LEU CA . 15991 1 182 . 1 1 15 15 LEU CB C 13 44.113 0.400 . 1 . . . . 15 LEU CB . 15991 1 183 . 1 1 15 15 LEU CD1 C 13 25.601 0.400 . 1 . . . . 15 LEU CD1 . 15991 1 184 . 1 1 15 15 LEU CD2 C 13 23.922 0.400 . 1 . . . . 15 LEU CD2 . 15991 1 185 . 1 1 15 15 LEU CG C 13 27.576 0.400 . 1 . . . . 15 LEU CG . 15991 1 186 . 1 1 15 15 LEU N N 15 118.420 0.400 . 1 . . . . 15 LEU N . 15991 1 187 . 1 1 16 16 GLU H H 1 8.136 0.020 . 1 . . . . 16 GLU H . 15991 1 188 . 1 1 16 16 GLU HA H 1 4.537 0.020 . 1 . . . . 16 GLU HA . 15991 1 189 . 1 1 16 16 GLU HB2 H 1 2.234 0.020 . 2 . . . . 16 GLU HB2 . 15991 1 190 . 1 1 16 16 GLU HB3 H 1 1.953 0.020 . 2 . . . . 16 GLU HB3 . 15991 1 191 . 1 1 16 16 GLU HG2 H 1 2.473 0.020 . 2 . . . . 16 GLU HG2 . 15991 1 192 . 1 1 16 16 GLU HG3 H 1 2.341 0.020 . 2 . . . . 16 GLU HG3 . 15991 1 193 . 1 1 16 16 GLU CA C 13 58.240 0.400 . 1 . . . . 16 GLU CA . 15991 1 194 . 1 1 16 16 GLU CB C 13 31.942 0.400 . 1 . . . . 16 GLU CB . 15991 1 195 . 1 1 16 16 GLU CG C 13 36.683 0.400 . 1 . . . . 16 GLU CG . 15991 1 196 . 1 1 16 16 GLU N N 15 116.405 0.400 . 1 . . . . 16 GLU N . 15991 1 197 . 1 1 17 17 LEU H H 1 8.342 0.020 . 1 . . . . 17 LEU H . 15991 1 198 . 1 1 17 17 LEU HA H 1 5.035 0.020 . 1 . . . . 17 LEU HA . 15991 1 199 . 1 1 17 17 LEU HB2 H 1 1.972 0.020 . 2 . . . . 17 LEU HB2 . 15991 1 200 . 1 1 17 17 LEU HB3 H 1 1.329 0.020 . 2 . . . . 17 LEU HB3 . 15991 1 201 . 1 1 17 17 LEU HD11 H 1 0.895 0.020 . 2 . . . . 17 LEU HD1 . 15991 1 202 . 1 1 17 17 LEU HD12 H 1 0.895 0.020 . 2 . . . . 17 LEU HD1 . 15991 1 203 . 1 1 17 17 LEU HD13 H 1 0.895 0.020 . 2 . . . . 17 LEU HD1 . 15991 1 204 . 1 1 17 17 LEU HD21 H 1 1.010 0.020 . 2 . . . . 17 LEU HD2 . 15991 1 205 . 1 1 17 17 LEU HD22 H 1 1.010 0.020 . 2 . . . . 17 LEU HD2 . 15991 1 206 . 1 1 17 17 LEU HD23 H 1 1.010 0.020 . 2 . . . . 17 LEU HD2 . 15991 1 207 . 1 1 17 17 LEU HG H 1 1.808 0.020 . 1 . . . . 17 LEU HG . 15991 1 208 . 1 1 17 17 LEU CA C 13 54.248 0.400 . 1 . . . . 17 LEU CA . 15991 1 209 . 1 1 17 17 LEU CB C 13 43.516 0.400 . 1 . . . . 17 LEU CB . 15991 1 210 . 1 1 17 17 LEU CD1 C 13 27.046 0.400 . 1 . . . . 17 LEU CD1 . 15991 1 211 . 1 1 17 17 LEU CD2 C 13 25.287 0.400 . 1 . . . . 17 LEU CD2 . 15991 1 212 . 1 1 17 17 LEU CG C 13 28.573 0.400 . 1 . . . . 17 LEU CG . 15991 1 213 . 1 1 17 17 LEU N N 15 119.498 0.400 . 1 . . . . 17 LEU N . 15991 1 214 . 1 1 18 18 GLU H H 1 9.154 0.020 . 1 . . . . 18 GLU H . 15991 1 215 . 1 1 18 18 GLU HA H 1 4.846 0.020 . 1 . . . . 18 GLU HA . 15991 1 216 . 1 1 18 18 GLU HB2 H 1 2.126 0.020 . 2 . . . . 18 GLU HB2 . 15991 1 217 . 1 1 18 18 GLU HB3 H 1 2.037 0.020 . 2 . . . . 18 GLU HB3 . 15991 1 218 . 1 1 18 18 GLU HG2 H 1 2.309 0.020 . 2 . . . . 18 GLU HG2 . 15991 1 219 . 1 1 18 18 GLU HG3 H 1 2.234 0.020 . 2 . . . . 18 GLU HG3 . 15991 1 220 . 1 1 18 18 GLU CA C 13 55.021 0.400 . 1 . . . . 18 GLU CA . 15991 1 221 . 1 1 18 18 GLU CB C 13 34.542 0.400 . 1 . . . . 18 GLU CB . 15991 1 222 . 1 1 18 18 GLU CG C 13 36.465 0.400 . 1 . . . . 18 GLU CG . 15991 1 223 . 1 1 18 18 GLU N N 15 120.310 0.400 . 1 . . . . 18 GLU N . 15991 1 224 . 1 1 19 19 GLY H H 1 8.982 0.020 . 1 . . . . 19 GLY H . 15991 1 225 . 1 1 19 19 GLY HA2 H 1 4.031 0.020 . 2 . . . . 19 GLY HA2 . 15991 1 226 . 1 1 19 19 GLY HA3 H 1 3.898 0.020 . 2 . . . . 19 GLY HA3 . 15991 1 227 . 1 1 19 19 GLY CA C 13 47.155 0.400 . 1 . . . . 19 GLY CA . 15991 1 228 . 1 1 19 19 GLY N N 15 110.384 0.400 . 1 . . . . 19 GLY N . 15991 1 229 . 1 1 20 20 LYS HA H 1 4.208 0.020 . 1 . . . . 20 LYS HA . 15991 1 230 . 1 1 20 20 LYS HB2 H 1 2.019 0.020 . 2 . . . . 20 LYS HB2 . 15991 1 231 . 1 1 20 20 LYS HB3 H 1 2.019 0.020 . 2 . . . . 20 LYS HB3 . 15991 1 232 . 1 1 20 20 LYS HD2 H 1 1.844 0.020 . 2 . . . . 20 LYS HD2 . 15991 1 233 . 1 1 20 20 LYS HD3 H 1 1.844 0.020 . 2 . . . . 20 LYS HD3 . 15991 1 234 . 1 1 20 20 LYS HE2 H 1 3.036 0.020 . 2 . . . . 20 LYS HE2 . 15991 1 235 . 1 1 20 20 LYS HE3 H 1 3.036 0.020 . 2 . . . . 20 LYS HE3 . 15991 1 236 . 1 1 20 20 LYS HG2 H 1 1.618 0.020 . 2 . . . . 20 LYS HG2 . 15991 1 237 . 1 1 20 20 LYS HG3 H 1 1.618 0.020 . 2 . . . . 20 LYS HG3 . 15991 1 238 . 1 1 20 20 LYS CA C 13 58.696 0.400 . 1 . . . . 20 LYS CA . 15991 1 239 . 1 1 20 20 LYS CB C 13 32.710 0.400 . 1 . . . . 20 LYS CB . 15991 1 240 . 1 1 20 20 LYS CD C 13 29.097 0.400 . 1 . . . . 20 LYS CD . 15991 1 241 . 1 1 20 20 LYS CG C 13 24.906 0.400 . 1 . . . . 20 LYS CG . 15991 1 242 . 1 1 21 21 GLU H H 1 8.056 0.020 . 1 . . . . 21 GLU H . 15991 1 243 . 1 1 21 21 GLU HA H 1 4.012 0.020 . 1 . . . . 21 GLU HA . 15991 1 244 . 1 1 21 21 GLU HB2 H 1 2.476 0.020 . 2 . . . . 21 GLU HB2 . 15991 1 245 . 1 1 21 21 GLU HB3 H 1 2.095 0.020 . 2 . . . . 21 GLU HB3 . 15991 1 246 . 1 1 21 21 GLU HG2 H 1 2.766 0.020 . 2 . . . . 21 GLU HG2 . 15991 1 247 . 1 1 21 21 GLU HG3 H 1 2.199 0.020 . 2 . . . . 21 GLU HG3 . 15991 1 248 . 1 1 21 21 GLU CA C 13 60.956 0.400 . 1 . . . . 21 GLU CA . 15991 1 249 . 1 1 21 21 GLU CB C 13 30.252 0.400 . 1 . . . . 21 GLU CB . 15991 1 250 . 1 1 21 21 GLU CG C 13 37.946 0.400 . 1 . . . . 21 GLU CG . 15991 1 251 . 1 1 21 21 GLU N N 15 116.305 0.400 . 1 . . . . 21 GLU N . 15991 1 252 . 1 1 22 22 GLN H H 1 6.971 0.020 . 1 . . . . 22 GLN H . 15991 1 253 . 1 1 22 22 GLN HA H 1 3.574 0.020 . 1 . . . . 22 GLN HA . 15991 1 254 . 1 1 22 22 GLN HB2 H 1 2.244 0.020 . 2 . . . . 22 GLN HB2 . 15991 1 255 . 1 1 22 22 GLN HB3 H 1 1.594 0.020 . 2 . . . . 22 GLN HB3 . 15991 1 256 . 1 1 22 22 GLN HE21 H 1 7.774 0.020 . 2 . . . . 22 GLN HE21 . 15991 1 257 . 1 1 22 22 GLN HE22 H 1 7.180 0.020 . 2 . . . . 22 GLN HE22 . 15991 1 258 . 1 1 22 22 GLN HG2 H 1 2.285 0.020 . 2 . . . . 22 GLN HG2 . 15991 1 259 . 1 1 22 22 GLN HG3 H 1 1.995 0.020 . 2 . . . . 22 GLN HG3 . 15991 1 260 . 1 1 22 22 GLN CA C 13 59.565 0.400 . 1 . . . . 22 GLN CA . 15991 1 261 . 1 1 22 22 GLN CB C 13 30.242 0.400 . 1 . . . . 22 GLN CB . 15991 1 262 . 1 1 22 22 GLN CG C 13 36.100 0.400 . 1 . . . . 22 GLN CG . 15991 1 263 . 1 1 22 22 GLN N N 15 118.163 0.400 . 1 . . . . 22 GLN N . 15991 1 264 . 1 1 22 22 GLN NE2 N 15 113.232 0.400 . 1 . . . . 22 GLN NE2 . 15991 1 265 . 1 1 23 23 GLU H H 1 7.678 0.020 . 1 . . . . 23 GLU H . 15991 1 266 . 1 1 23 23 GLU HA H 1 4.004 0.020 . 1 . . . . 23 GLU HA . 15991 1 267 . 1 1 23 23 GLU HB2 H 1 2.257 0.020 . 2 . . . . 23 GLU HB2 . 15991 1 268 . 1 1 23 23 GLU HB3 H 1 2.257 0.020 . 2 . . . . 23 GLU HB3 . 15991 1 269 . 1 1 23 23 GLU HG2 H 1 2.497 0.020 . 2 . . . . 23 GLU HG2 . 15991 1 270 . 1 1 23 23 GLU HG3 H 1 2.254 0.020 . 2 . . . . 23 GLU HG3 . 15991 1 271 . 1 1 23 23 GLU CA C 13 60.035 0.400 . 1 . . . . 23 GLU CA . 15991 1 272 . 1 1 23 23 GLU CB C 13 30.425 0.400 . 1 . . . . 23 GLU CB . 15991 1 273 . 1 1 23 23 GLU CG C 13 36.763 0.400 . 1 . . . . 23 GLU CG . 15991 1 274 . 1 1 23 23 GLU N N 15 118.027 0.400 . 1 . . . . 23 GLU N . 15991 1 275 . 1 1 24 24 LEU H H 1 8.524 0.020 . 1 . . . . 24 LEU H . 15991 1 276 . 1 1 24 24 LEU HA H 1 4.068 0.020 . 1 . . . . 24 LEU HA . 15991 1 277 . 1 1 24 24 LEU HB2 H 1 2.036 0.020 . 2 . . . . 24 LEU HB2 . 15991 1 278 . 1 1 24 24 LEU HB3 H 1 1.375 0.020 . 2 . . . . 24 LEU HB3 . 15991 1 279 . 1 1 24 24 LEU HD11 H 1 0.957 0.020 . 2 . . . . 24 LEU HD1 . 15991 1 280 . 1 1 24 24 LEU HD12 H 1 0.957 0.020 . 2 . . . . 24 LEU HD1 . 15991 1 281 . 1 1 24 24 LEU HD13 H 1 0.957 0.020 . 2 . . . . 24 LEU HD1 . 15991 1 282 . 1 1 24 24 LEU HD21 H 1 0.981 0.020 . 2 . . . . 24 LEU HD2 . 15991 1 283 . 1 1 24 24 LEU HD22 H 1 0.981 0.020 . 2 . . . . 24 LEU HD2 . 15991 1 284 . 1 1 24 24 LEU HD23 H 1 0.981 0.020 . 2 . . . . 24 LEU HD2 . 15991 1 285 . 1 1 24 24 LEU CA C 13 58.116 0.400 . 1 . . . . 24 LEU CA . 15991 1 286 . 1 1 24 24 LEU CB C 13 42.760 0.400 . 1 . . . . 24 LEU CB . 15991 1 287 . 1 1 24 24 LEU CD1 C 13 26.523 0.400 . 1 . . . . 24 LEU CD1 . 15991 1 288 . 1 1 24 24 LEU CD2 C 13 23.462 0.400 . 1 . . . . 24 LEU CD2 . 15991 1 289 . 1 1 24 24 LEU N N 15 119.021 0.400 . 1 . . . . 24 LEU N . 15991 1 290 . 1 1 25 25 ALA H H 1 8.159 0.020 . 1 . . . . 25 ALA H . 15991 1 291 . 1 1 25 25 ALA HA H 1 3.807 0.020 . 1 . . . . 25 ALA HA . 15991 1 292 . 1 1 25 25 ALA HB1 H 1 1.370 0.020 . 1 . . . . 25 ALA HB . 15991 1 293 . 1 1 25 25 ALA HB2 H 1 1.370 0.020 . 1 . . . . 25 ALA HB . 15991 1 294 . 1 1 25 25 ALA HB3 H 1 1.370 0.020 . 1 . . . . 25 ALA HB . 15991 1 295 . 1 1 25 25 ALA CA C 13 55.984 0.400 . 1 . . . . 25 ALA CA . 15991 1 296 . 1 1 25 25 ALA CB C 13 20.760 0.400 . 1 . . . . 25 ALA CB . 15991 1 297 . 1 1 25 25 ALA N N 15 121.211 0.400 . 1 . . . . 25 ALA N . 15991 1 298 . 1 1 26 26 LEU H H 1 7.845 0.020 . 1 . . . . 26 LEU H . 15991 1 299 . 1 1 26 26 LEU HA H 1 4.073 0.020 . 1 . . . . 26 LEU HA . 15991 1 300 . 1 1 26 26 LEU HB2 H 1 2.039 0.020 . 2 . . . . 26 LEU HB2 . 15991 1 301 . 1 1 26 26 LEU HB3 H 1 1.492 0.020 . 2 . . . . 26 LEU HB3 . 15991 1 302 . 1 1 26 26 LEU HD11 H 1 0.964 0.020 . 2 . . . . 26 LEU HD1 . 15991 1 303 . 1 1 26 26 LEU HD12 H 1 0.964 0.020 . 2 . . . . 26 LEU HD1 . 15991 1 304 . 1 1 26 26 LEU HD13 H 1 0.964 0.020 . 2 . . . . 26 LEU HD1 . 15991 1 305 . 1 1 26 26 LEU HD21 H 1 0.954 0.020 . 2 . . . . 26 LEU HD2 . 15991 1 306 . 1 1 26 26 LEU HD22 H 1 0.954 0.020 . 2 . . . . 26 LEU HD2 . 15991 1 307 . 1 1 26 26 LEU HD23 H 1 0.954 0.020 . 2 . . . . 26 LEU HD2 . 15991 1 308 . 1 1 26 26 LEU HG H 1 2.018 0.020 . 1 . . . . 26 LEU HG . 15991 1 309 . 1 1 26 26 LEU CA C 13 57.918 0.400 . 1 . . . . 26 LEU CA . 15991 1 310 . 1 1 26 26 LEU CB C 13 41.678 0.400 . 1 . . . . 26 LEU CB . 15991 1 311 . 1 1 26 26 LEU CD1 C 13 26.349 0.400 . 1 . . . . 26 LEU CD1 . 15991 1 312 . 1 1 26 26 LEU CD2 C 13 23.071 0.400 . 1 . . . . 26 LEU CD2 . 15991 1 313 . 1 1 26 26 LEU CG C 13 27.176 0.400 . 1 . . . . 26 LEU CG . 15991 1 314 . 1 1 26 26 LEU N N 15 113.547 0.400 . 1 . . . . 26 LEU N . 15991 1 315 . 1 1 27 27 GLU H H 1 7.827 0.020 . 1 . . . . 27 GLU H . 15991 1 316 . 1 1 27 27 GLU HA H 1 4.276 0.020 . 1 . . . . 27 GLU HA . 15991 1 317 . 1 1 27 27 GLU HB2 H 1 2.279 0.020 . 2 . . . . 27 GLU HB2 . 15991 1 318 . 1 1 27 27 GLU HB3 H 1 2.279 0.020 . 2 . . . . 27 GLU HB3 . 15991 1 319 . 1 1 27 27 GLU HG2 H 1 2.602 0.020 . 2 . . . . 27 GLU HG2 . 15991 1 320 . 1 1 27 27 GLU HG3 H 1 2.490 0.020 . 2 . . . . 27 GLU HG3 . 15991 1 321 . 1 1 27 27 GLU CA C 13 59.198 0.400 . 1 . . . . 27 GLU CA . 15991 1 322 . 1 1 27 27 GLU CB C 13 30.321 0.400 . 1 . . . . 27 GLU CB . 15991 1 323 . 1 1 27 27 GLU CG C 13 36.130 0.400 . 1 . . . . 27 GLU CG . 15991 1 324 . 1 1 27 27 GLU N N 15 119.718 0.400 . 1 . . . . 27 GLU N . 15991 1 325 . 1 1 28 28 LEU H H 1 8.222 0.020 . 1 . . . . 28 LEU H . 15991 1 326 . 1 1 28 28 LEU HA H 1 4.122 0.020 . 1 . . . . 28 LEU HA . 15991 1 327 . 1 1 28 28 LEU HB2 H 1 2.230 0.020 . 2 . . . . 28 LEU HB2 . 15991 1 328 . 1 1 28 28 LEU HB3 H 1 1.901 0.020 . 2 . . . . 28 LEU HB3 . 15991 1 329 . 1 1 28 28 LEU HD11 H 1 0.971 0.020 . 2 . . . . 28 LEU HD1 . 15991 1 330 . 1 1 28 28 LEU HD12 H 1 0.971 0.020 . 2 . . . . 28 LEU HD1 . 15991 1 331 . 1 1 28 28 LEU HD13 H 1 0.971 0.020 . 2 . . . . 28 LEU HD1 . 15991 1 332 . 1 1 28 28 LEU HD21 H 1 0.940 0.020 . 2 . . . . 28 LEU HD2 . 15991 1 333 . 1 1 28 28 LEU HD22 H 1 0.940 0.020 . 2 . . . . 28 LEU HD2 . 15991 1 334 . 1 1 28 28 LEU HD23 H 1 0.940 0.020 . 2 . . . . 28 LEU HD2 . 15991 1 335 . 1 1 28 28 LEU CA C 13 58.879 0.400 . 1 . . . . 28 LEU CA . 15991 1 336 . 1 1 28 28 LEU CB C 13 42.746 0.400 . 1 . . . . 28 LEU CB . 15991 1 337 . 1 1 28 28 LEU CD1 C 13 25.872 0.400 . 1 . . . . 28 LEU CD1 . 15991 1 338 . 1 1 28 28 LEU CD2 C 13 24.994 0.400 . 1 . . . . 28 LEU CD2 . 15991 1 339 . 1 1 28 28 LEU N N 15 120.851 0.400 . 1 . . . . 28 LEU N . 15991 1 340 . 1 1 29 29 LEU H H 1 7.089 0.020 . 1 . . . . 29 LEU H . 15991 1 341 . 1 1 29 29 LEU HA H 1 3.966 0.020 . 1 . . . . 29 LEU HA . 15991 1 342 . 1 1 29 29 LEU HB2 H 1 1.912 0.020 . 2 . . . . 29 LEU HB2 . 15991 1 343 . 1 1 29 29 LEU HB3 H 1 1.602 0.020 . 2 . . . . 29 LEU HB3 . 15991 1 344 . 1 1 29 29 LEU HD11 H 1 0.952 0.020 . 2 . . . . 29 LEU HD1 . 15991 1 345 . 1 1 29 29 LEU HD12 H 1 0.952 0.020 . 2 . . . . 29 LEU HD1 . 15991 1 346 . 1 1 29 29 LEU HD13 H 1 0.952 0.020 . 2 . . . . 29 LEU HD1 . 15991 1 347 . 1 1 29 29 LEU HD21 H 1 0.740 0.020 . 2 . . . . 29 LEU HD2 . 15991 1 348 . 1 1 29 29 LEU HD22 H 1 0.740 0.020 . 2 . . . . 29 LEU HD2 . 15991 1 349 . 1 1 29 29 LEU HD23 H 1 0.740 0.020 . 2 . . . . 29 LEU HD2 . 15991 1 350 . 1 1 29 29 LEU HG H 1 2.220 0.020 . 1 . . . . 29 LEU HG . 15991 1 351 . 1 1 29 29 LEU CA C 13 56.483 0.400 . 1 . . . . 29 LEU CA . 15991 1 352 . 1 1 29 29 LEU CB C 13 40.386 0.400 . 1 . . . . 29 LEU CB . 15991 1 353 . 1 1 29 29 LEU CD1 C 13 24.699 0.400 . 1 . . . . 29 LEU CD1 . 15991 1 354 . 1 1 29 29 LEU CD2 C 13 23.270 0.400 . 1 . . . . 29 LEU CD2 . 15991 1 355 . 1 1 29 29 LEU CG C 13 27.244 0.400 . 1 . . . . 29 LEU CG . 15991 1 356 . 1 1 29 29 LEU N N 15 112.194 0.400 . 1 . . . . 29 LEU N . 15991 1 357 . 1 1 30 30 ASN H H 1 7.831 0.020 . 1 . . . . 30 ASN H . 15991 1 358 . 1 1 30 30 ASN HA H 1 4.612 0.020 . 1 . . . . 30 ASN HA . 15991 1 359 . 1 1 30 30 ASN HB2 H 1 2.706 0.020 . 2 . . . . 30 ASN HB2 . 15991 1 360 . 1 1 30 30 ASN HB3 H 1 2.546 0.020 . 2 . . . . 30 ASN HB3 . 15991 1 361 . 1 1 30 30 ASN HD21 H 1 7.465 0.020 . 2 . . . . 30 ASN HD21 . 15991 1 362 . 1 1 30 30 ASN HD22 H 1 7.080 0.020 . 2 . . . . 30 ASN HD22 . 15991 1 363 . 1 1 30 30 ASN CA C 13 54.584 0.400 . 1 . . . . 30 ASN CA . 15991 1 364 . 1 1 30 30 ASN CB C 13 38.563 0.400 . 1 . . . . 30 ASN CB . 15991 1 365 . 1 1 30 30 ASN N N 15 115.311 0.400 . 1 . . . . 30 ASN N . 15991 1 366 . 1 1 30 30 ASN ND2 N 15 116.096 0.400 . 1 . . . . 30 ASN ND2 . 15991 1 367 . 1 1 31 31 TYR H H 1 7.981 0.020 . 1 . . . . 31 TYR H . 15991 1 368 . 1 1 31 31 TYR HA H 1 4.629 0.020 . 1 . . . . 31 TYR HA . 15991 1 369 . 1 1 31 31 TYR HB2 H 1 3.372 0.020 . 2 . . . . 31 TYR HB2 . 15991 1 370 . 1 1 31 31 TYR HB3 H 1 2.884 0.020 . 2 . . . . 31 TYR HB3 . 15991 1 371 . 1 1 31 31 TYR HD1 H 1 7.189 0.020 . 1 . . . . 31 TYR HD1 . 15991 1 372 . 1 1 31 31 TYR HD2 H 1 7.189 0.020 . 1 . . . . 31 TYR HD2 . 15991 1 373 . 1 1 31 31 TYR HE1 H 1 6.842 0.020 . 1 . . . . 31 TYR HE1 . 15991 1 374 . 1 1 31 31 TYR HE2 H 1 6.842 0.020 . 1 . . . . 31 TYR HE2 . 15991 1 375 . 1 1 31 31 TYR CA C 13 58.227 0.400 . 1 . . . . 31 TYR CA . 15991 1 376 . 1 1 31 31 TYR CB C 13 39.063 0.400 . 1 . . . . 31 TYR CB . 15991 1 377 . 1 1 31 31 TYR N N 15 120.355 0.400 . 1 . . . . 31 TYR N . 15991 1 378 . 1 1 32 32 LEU H H 1 7.256 0.020 . 1 . . . . 32 LEU H . 15991 1 379 . 1 1 32 32 LEU HA H 1 5.211 0.020 . 1 . . . . 32 LEU HA . 15991 1 380 . 1 1 32 32 LEU HB2 H 1 1.795 0.020 . 2 . . . . 32 LEU HB2 . 15991 1 381 . 1 1 32 32 LEU HB3 H 1 1.560 0.020 . 2 . . . . 32 LEU HB3 . 15991 1 382 . 1 1 32 32 LEU HD11 H 1 0.920 0.020 . 2 . . . . 32 LEU HD1 . 15991 1 383 . 1 1 32 32 LEU HD12 H 1 0.920 0.020 . 2 . . . . 32 LEU HD1 . 15991 1 384 . 1 1 32 32 LEU HD13 H 1 0.920 0.020 . 2 . . . . 32 LEU HD1 . 15991 1 385 . 1 1 32 32 LEU HD21 H 1 0.849 0.020 . 2 . . . . 32 LEU HD2 . 15991 1 386 . 1 1 32 32 LEU HD22 H 1 0.849 0.020 . 2 . . . . 32 LEU HD2 . 15991 1 387 . 1 1 32 32 LEU HD23 H 1 0.849 0.020 . 2 . . . . 32 LEU HD2 . 15991 1 388 . 1 1 32 32 LEU HG H 1 1.834 0.020 . 1 . . . . 32 LEU HG . 15991 1 389 . 1 1 32 32 LEU CA C 13 53.942 0.400 . 1 . . . . 32 LEU CA . 15991 1 390 . 1 1 32 32 LEU CB C 13 46.037 0.400 . 1 . . . . 32 LEU CB . 15991 1 391 . 1 1 32 32 LEU CD1 C 13 27.876 0.400 . 1 . . . . 32 LEU CD1 . 15991 1 392 . 1 1 32 32 LEU CD2 C 13 24.226 0.400 . 1 . . . . 32 LEU CD2 . 15991 1 393 . 1 1 32 32 LEU N N 15 119.514 0.400 . 1 . . . . 32 LEU N . 15991 1 394 . 1 1 33 33 ASN H H 1 8.924 0.020 . 1 . . . . 33 ASN H . 15991 1 395 . 1 1 33 33 ASN HA H 1 5.075 0.020 . 1 . . . . 33 ASN HA . 15991 1 396 . 1 1 33 33 ASN HB2 H 1 3.614 0.020 . 2 . . . . 33 ASN HB2 . 15991 1 397 . 1 1 33 33 ASN HB3 H 1 2.899 0.020 . 2 . . . . 33 ASN HB3 . 15991 1 398 . 1 1 33 33 ASN HD21 H 1 7.917 0.020 . 2 . . . . 33 ASN HD21 . 15991 1 399 . 1 1 33 33 ASN HD22 H 1 6.651 0.020 . 2 . . . . 33 ASN HD22 . 15991 1 400 . 1 1 33 33 ASN CA C 13 50.793 0.400 . 1 . . . . 33 ASN CA . 15991 1 401 . 1 1 33 33 ASN CB C 13 39.154 0.400 . 1 . . . . 33 ASN CB . 15991 1 402 . 1 1 33 33 ASN N N 15 119.778 0.400 . 1 . . . . 33 ASN N . 15991 1 403 . 1 1 33 33 ASN ND2 N 15 111.671 0.400 . 1 . . . . 33 ASN ND2 . 15991 1 404 . 1 1 34 34 GLU HA H 1 4.118 0.020 . 1 . . . . 34 GLU HA . 15991 1 405 . 1 1 34 34 GLU HB2 H 1 2.121 0.020 . 2 . . . . 34 GLU HB2 . 15991 1 406 . 1 1 34 34 GLU HB3 H 1 2.121 0.020 . 2 . . . . 34 GLU HB3 . 15991 1 407 . 1 1 34 34 GLU HG2 H 1 2.280 0.020 . 2 . . . . 34 GLU HG2 . 15991 1 408 . 1 1 34 34 GLU HG3 H 1 2.280 0.020 . 2 . . . . 34 GLU HG3 . 15991 1 409 . 1 1 34 34 GLU CA C 13 59.118 0.400 . 1 . . . . 34 GLU CA . 15991 1 410 . 1 1 34 34 GLU CB C 13 29.420 0.400 . 1 . . . . 34 GLU CB . 15991 1 411 . 1 1 35 35 LYS H H 1 7.427 0.020 . 1 . . . . 35 LYS H . 15991 1 412 . 1 1 35 35 LYS HA H 1 4.299 0.020 . 1 . . . . 35 LYS HA . 15991 1 413 . 1 1 35 35 LYS HB2 H 1 1.732 0.020 . 2 . . . . 35 LYS HB2 . 15991 1 414 . 1 1 35 35 LYS HB3 H 1 1.732 0.020 . 2 . . . . 35 LYS HB3 . 15991 1 415 . 1 1 35 35 LYS HD2 H 1 1.216 0.020 . 2 . . . . 35 LYS HD2 . 15991 1 416 . 1 1 35 35 LYS HD3 H 1 1.146 0.020 . 2 . . . . 35 LYS HD3 . 15991 1 417 . 1 1 35 35 LYS HE2 H 1 2.566 0.020 . 2 . . . . 35 LYS HE2 . 15991 1 418 . 1 1 35 35 LYS HE3 H 1 2.467 0.020 . 2 . . . . 35 LYS HE3 . 15991 1 419 . 1 1 35 35 LYS HG2 H 1 1.201 0.020 . 2 . . . . 35 LYS HG2 . 15991 1 420 . 1 1 35 35 LYS HG3 H 1 0.970 0.020 . 2 . . . . 35 LYS HG3 . 15991 1 421 . 1 1 35 35 LYS CA C 13 55.781 0.400 . 1 . . . . 35 LYS CA . 15991 1 422 . 1 1 35 35 LYS CB C 13 34.297 0.400 . 1 . . . . 35 LYS CB . 15991 1 423 . 1 1 35 35 LYS CD C 13 28.790 0.400 . 1 . . . . 35 LYS CD . 15991 1 424 . 1 1 35 35 LYS CE C 13 42.355 0.400 . 1 . . . . 35 LYS CE . 15991 1 425 . 1 1 35 35 LYS N N 15 115.916 0.400 . 1 . . . . 35 LYS N . 15991 1 426 . 1 1 36 36 GLY H H 1 7.866 0.020 . 1 . . . . 36 GLY H . 15991 1 427 . 1 1 36 36 GLY HA2 H 1 4.090 0.020 . 2 . . . . 36 GLY HA2 . 15991 1 428 . 1 1 36 36 GLY HA3 H 1 3.368 0.020 . 2 . . . . 36 GLY HA3 . 15991 1 429 . 1 1 36 36 GLY CA C 13 45.915 0.400 . 1 . . . . 36 GLY CA . 15991 1 430 . 1 1 36 36 GLY N N 15 104.539 0.400 . 1 . . . . 36 GLY N . 15991 1 431 . 1 1 37 37 PHE H H 1 7.332 0.020 . 1 . . . . 37 PHE H . 15991 1 432 . 1 1 37 37 PHE HA H 1 5.434 0.020 . 1 . . . . 37 PHE HA . 15991 1 433 . 1 1 37 37 PHE HB2 H 1 3.261 0.020 . 2 . . . . 37 PHE HB2 . 15991 1 434 . 1 1 37 37 PHE HB3 H 1 2.697 0.020 . 2 . . . . 37 PHE HB3 . 15991 1 435 . 1 1 37 37 PHE HD1 H 1 7.088 0.020 . 1 . . . . 37 PHE HD1 . 15991 1 436 . 1 1 37 37 PHE HD2 H 1 7.088 0.020 . 1 . . . . 37 PHE HD2 . 15991 1 437 . 1 1 37 37 PHE HE1 H 1 7.204 0.020 . 1 . . . . 37 PHE HE1 . 15991 1 438 . 1 1 37 37 PHE HE2 H 1 7.204 0.020 . 1 . . . . 37 PHE HE2 . 15991 1 439 . 1 1 37 37 PHE CA C 13 55.387 0.400 . 1 . . . . 37 PHE CA . 15991 1 440 . 1 1 37 37 PHE CB C 13 40.611 0.400 . 1 . . . . 37 PHE CB . 15991 1 441 . 1 1 37 37 PHE N N 15 117.533 0.400 . 1 . . . . 37 PHE N . 15991 1 442 . 1 1 38 38 LEU H H 1 7.969 0.020 . 1 . . . . 38 LEU H . 15991 1 443 . 1 1 38 38 LEU HA H 1 4.729 0.020 . 1 . . . . 38 LEU HA . 15991 1 444 . 1 1 38 38 LEU HB2 H 1 2.050 0.020 . 2 . . . . 38 LEU HB2 . 15991 1 445 . 1 1 38 38 LEU HB3 H 1 1.742 0.020 . 2 . . . . 38 LEU HB3 . 15991 1 446 . 1 1 38 38 LEU HD11 H 1 1.033 0.020 . 2 . . . . 38 LEU HD1 . 15991 1 447 . 1 1 38 38 LEU HD12 H 1 1.033 0.020 . 2 . . . . 38 LEU HD1 . 15991 1 448 . 1 1 38 38 LEU HD13 H 1 1.033 0.020 . 2 . . . . 38 LEU HD1 . 15991 1 449 . 1 1 38 38 LEU HD21 H 1 0.852 0.020 . 2 . . . . 38 LEU HD2 . 15991 1 450 . 1 1 38 38 LEU HD22 H 1 0.852 0.020 . 2 . . . . 38 LEU HD2 . 15991 1 451 . 1 1 38 38 LEU HD23 H 1 0.852 0.020 . 2 . . . . 38 LEU HD2 . 15991 1 452 . 1 1 38 38 LEU HG H 1 1.788 0.020 . 1 . . . . 38 LEU HG . 15991 1 453 . 1 1 38 38 LEU CA C 13 55.994 0.400 . 1 . . . . 38 LEU CA . 15991 1 454 . 1 1 38 38 LEU CB C 13 43.437 0.400 . 1 . . . . 38 LEU CB . 15991 1 455 . 1 1 38 38 LEU CD1 C 13 26.623 0.400 . 1 . . . . 38 LEU CD1 . 15991 1 456 . 1 1 38 38 LEU CD2 C 13 24.188 0.400 . 1 . . . . 38 LEU CD2 . 15991 1 457 . 1 1 38 38 LEU N N 15 120.010 0.400 . 1 . . . . 38 LEU N . 15991 1 458 . 1 1 39 39 SER H H 1 9.349 0.020 . 1 . . . . 39 SER H . 15991 1 459 . 1 1 39 39 SER HA H 1 4.556 0.020 . 1 . . . . 39 SER HA . 15991 1 460 . 1 1 39 39 SER HB2 H 1 4.231 0.020 . 2 . . . . 39 SER HB2 . 15991 1 461 . 1 1 39 39 SER HB3 H 1 3.709 0.020 . 2 . . . . 39 SER HB3 . 15991 1 462 . 1 1 39 39 SER CA C 13 59.298 0.400 . 1 . . . . 39 SER CA . 15991 1 463 . 1 1 39 39 SER CB C 13 65.069 0.400 . 1 . . . . 39 SER CB . 15991 1 464 . 1 1 39 39 SER N N 15 118.732 0.400 . 1 . . . . 39 SER N . 15991 1 465 . 1 1 40 40 LYS H H 1 7.471 0.020 . 1 . . . . 40 LYS H . 15991 1 466 . 1 1 40 40 LYS HA H 1 4.773 0.020 . 1 . . . . 40 LYS HA . 15991 1 467 . 1 1 40 40 LYS HB2 H 1 1.971 0.020 . 2 . . . . 40 LYS HB2 . 15991 1 468 . 1 1 40 40 LYS HB3 H 1 1.569 0.020 . 2 . . . . 40 LYS HB3 . 15991 1 469 . 1 1 40 40 LYS HD2 H 1 1.695 0.020 . 2 . . . . 40 LYS HD2 . 15991 1 470 . 1 1 40 40 LYS HD3 H 1 1.695 0.020 . 2 . . . . 40 LYS HD3 . 15991 1 471 . 1 1 40 40 LYS HE2 H 1 3.176 0.020 . 2 . . . . 40 LYS HE2 . 15991 1 472 . 1 1 40 40 LYS HE3 H 1 3.176 0.020 . 2 . . . . 40 LYS HE3 . 15991 1 473 . 1 1 40 40 LYS HG2 H 1 1.676 0.020 . 2 . . . . 40 LYS HG2 . 15991 1 474 . 1 1 40 40 LYS HG3 H 1 1.676 0.020 . 2 . . . . 40 LYS HG3 . 15991 1 475 . 1 1 40 40 LYS CA C 13 54.458 0.400 . 1 . . . . 40 LYS CA . 15991 1 476 . 1 1 40 40 LYS CB C 13 38.254 0.400 . 1 . . . . 40 LYS CB . 15991 1 477 . 1 1 40 40 LYS CD C 13 29.528 0.400 . 1 . . . . 40 LYS CD . 15991 1 478 . 1 1 40 40 LYS CG C 13 25.733 0.400 . 1 . . . . 40 LYS CG . 15991 1 479 . 1 1 40 40 LYS N N 15 120.900 0.400 . 1 . . . . 40 LYS N . 15991 1 480 . 1 1 41 41 SER H H 1 8.667 0.020 . 1 . . . . 41 SER H . 15991 1 481 . 1 1 41 41 SER HA H 1 4.593 0.020 . 1 . . . . 41 SER HA . 15991 1 482 . 1 1 41 41 SER HB2 H 1 4.571 0.020 . 2 . . . . 41 SER HB2 . 15991 1 483 . 1 1 41 41 SER HB3 H 1 4.190 0.020 . 2 . . . . 41 SER HB3 . 15991 1 484 . 1 1 41 41 SER CA C 13 58.144 0.400 . 1 . . . . 41 SER CA . 15991 1 485 . 1 1 41 41 SER CB C 13 65.432 0.400 . 1 . . . . 41 SER CB . 15991 1 486 . 1 1 41 41 SER N N 15 115.551 0.400 . 1 . . . . 41 SER N . 15991 1 487 . 1 1 42 42 VAL H H 1 9.048 0.020 . 1 . . . . 42 VAL H . 15991 1 488 . 1 1 42 42 VAL HA H 1 3.607 0.020 . 1 . . . . 42 VAL HA . 15991 1 489 . 1 1 42 42 VAL HB H 1 2.138 0.020 . 1 . . . . 42 VAL HB . 15991 1 490 . 1 1 42 42 VAL HG11 H 1 1.148 0.020 . 2 . . . . 42 VAL HG1 . 15991 1 491 . 1 1 42 42 VAL HG12 H 1 1.148 0.020 . 2 . . . . 42 VAL HG1 . 15991 1 492 . 1 1 42 42 VAL HG13 H 1 1.148 0.020 . 2 . . . . 42 VAL HG1 . 15991 1 493 . 1 1 42 42 VAL HG21 H 1 1.098 0.020 . 2 . . . . 42 VAL HG2 . 15991 1 494 . 1 1 42 42 VAL HG22 H 1 1.098 0.020 . 2 . . . . 42 VAL HG2 . 15991 1 495 . 1 1 42 42 VAL HG23 H 1 1.098 0.020 . 2 . . . . 42 VAL HG2 . 15991 1 496 . 1 1 42 42 VAL CA C 13 67.360 0.400 . 1 . . . . 42 VAL CA . 15991 1 497 . 1 1 42 42 VAL CB C 13 32.076 0.400 . 1 . . . . 42 VAL CB . 15991 1 498 . 1 1 42 42 VAL CG1 C 13 23.153 0.400 . 1 . . . . 42 VAL CG1 . 15991 1 499 . 1 1 42 42 VAL CG2 C 13 22.544 0.400 . 1 . . . . 42 VAL CG2 . 15991 1 500 . 1 1 42 42 VAL N N 15 120.876 0.400 . 1 . . . . 42 VAL N . 15991 1 501 . 1 1 43 43 GLU H H 1 9.463 0.020 . 1 . . . . 43 GLU H . 15991 1 502 . 1 1 43 43 GLU HA H 1 3.916 0.020 . 1 . . . . 43 GLU HA . 15991 1 503 . 1 1 43 43 GLU HB2 H 1 2.213 0.020 . 2 . . . . 43 GLU HB2 . 15991 1 504 . 1 1 43 43 GLU HB3 H 1 2.023 0.020 . 2 . . . . 43 GLU HB3 . 15991 1 505 . 1 1 43 43 GLU HG2 H 1 2.614 0.020 . 2 . . . . 43 GLU HG2 . 15991 1 506 . 1 1 43 43 GLU HG3 H 1 2.318 0.020 . 2 . . . . 43 GLU HG3 . 15991 1 507 . 1 1 43 43 GLU CA C 13 61.879 0.400 . 1 . . . . 43 GLU CA . 15991 1 508 . 1 1 43 43 GLU CB C 13 29.222 0.400 . 1 . . . . 43 GLU CB . 15991 1 509 . 1 1 43 43 GLU CG C 13 37.995 0.400 . 1 . . . . 43 GLU CG . 15991 1 510 . 1 1 43 43 GLU N N 15 122.246 0.400 . 1 . . . . 43 GLU N . 15991 1 511 . 1 1 44 44 GLU H H 1 7.987 0.020 . 1 . . . . 44 GLU H . 15991 1 512 . 1 1 44 44 GLU HA H 1 4.134 0.020 . 1 . . . . 44 GLU HA . 15991 1 513 . 1 1 44 44 GLU HB2 H 1 2.261 0.020 . 2 . . . . 44 GLU HB2 . 15991 1 514 . 1 1 44 44 GLU HB3 H 1 2.037 0.020 . 2 . . . . 44 GLU HB3 . 15991 1 515 . 1 1 44 44 GLU HG2 H 1 2.417 0.020 . 2 . . . . 44 GLU HG2 . 15991 1 516 . 1 1 44 44 GLU HG3 H 1 2.318 0.020 . 2 . . . . 44 GLU HG3 . 15991 1 517 . 1 1 44 44 GLU CA C 13 60.058 0.400 . 1 . . . . 44 GLU CA . 15991 1 518 . 1 1 44 44 GLU CB C 13 30.513 0.400 . 1 . . . . 44 GLU CB . 15991 1 519 . 1 1 44 44 GLU CG C 13 37.790 0.400 . 1 . . . . 44 GLU CG . 15991 1 520 . 1 1 44 44 GLU N N 15 121.226 0.400 . 1 . . . . 44 GLU N . 15991 1 521 . 1 1 45 45 ILE H H 1 8.387 0.020 . 1 . . . . 45 ILE H . 15991 1 522 . 1 1 45 45 ILE HA H 1 3.218 0.020 . 1 . . . . 45 ILE HA . 15991 1 523 . 1 1 45 45 ILE HB H 1 1.419 0.020 . 1 . . . . 45 ILE HB . 15991 1 524 . 1 1 45 45 ILE HD11 H 1 0.648 0.020 . 1 . . . . 45 ILE HD1 . 15991 1 525 . 1 1 45 45 ILE HD12 H 1 0.648 0.020 . 1 . . . . 45 ILE HD1 . 15991 1 526 . 1 1 45 45 ILE HD13 H 1 0.648 0.020 . 1 . . . . 45 ILE HD1 . 15991 1 527 . 1 1 45 45 ILE HG12 H 1 1.600 0.020 . 2 . . . . 45 ILE HG12 . 15991 1 528 . 1 1 45 45 ILE HG13 H 1 -0.181 0.020 . 2 . . . . 45 ILE HG13 . 15991 1 529 . 1 1 45 45 ILE HG21 H 1 0.495 0.020 . 1 . . . . 45 ILE HG2 . 15991 1 530 . 1 1 45 45 ILE HG22 H 1 0.495 0.020 . 1 . . . . 45 ILE HG2 . 15991 1 531 . 1 1 45 45 ILE HG23 H 1 0.495 0.020 . 1 . . . . 45 ILE HG2 . 15991 1 532 . 1 1 45 45 ILE CA C 13 65.952 0.400 . 1 . . . . 45 ILE CA . 15991 1 533 . 1 1 45 45 ILE CB C 13 38.635 0.400 . 1 . . . . 45 ILE CB . 15991 1 534 . 1 1 45 45 ILE CD1 C 13 15.824 0.400 . 1 . . . . 45 ILE CD1 . 15991 1 535 . 1 1 45 45 ILE CG1 C 13 28.937 0.400 . 1 . . . . 45 ILE CG1 . 15991 1 536 . 1 1 45 45 ILE CG2 C 13 18.992 0.400 . 1 . . . . 45 ILE CG2 . 15991 1 537 . 1 1 45 45 ILE N N 15 120.875 0.400 . 1 . . . . 45 ILE N . 15991 1 538 . 1 1 46 46 SER H H 1 8.584 0.020 . 1 . . . . 46 SER H . 15991 1 539 . 1 1 46 46 SER HA H 1 4.208 0.020 . 1 . . . . 46 SER HA . 15991 1 540 . 1 1 46 46 SER HB2 H 1 4.083 0.020 . 2 . . . . 46 SER HB2 . 15991 1 541 . 1 1 46 46 SER HB3 H 1 3.899 0.020 . 2 . . . . 46 SER HB3 . 15991 1 542 . 1 1 46 46 SER CA C 13 62.842 0.400 . 1 . . . . 46 SER CA . 15991 1 543 . 1 1 46 46 SER CB C 13 62.379 0.400 . 1 . . . . 46 SER CB . 15991 1 544 . 1 1 46 46 SER N N 15 116.539 0.400 . 1 . . . . 46 SER N . 15991 1 545 . 1 1 47 47 ASP H H 1 7.279 0.020 . 1 . . . . 47 ASP H . 15991 1 546 . 1 1 47 47 ASP HA H 1 4.633 0.020 . 1 . . . . 47 ASP HA . 15991 1 547 . 1 1 47 47 ASP HB2 H 1 2.890 0.020 . 2 . . . . 47 ASP HB2 . 15991 1 548 . 1 1 47 47 ASP HB3 H 1 2.827 0.020 . 2 . . . . 47 ASP HB3 . 15991 1 549 . 1 1 47 47 ASP CA C 13 57.616 0.400 . 1 . . . . 47 ASP CA . 15991 1 550 . 1 1 47 47 ASP CB C 13 41.900 0.400 . 1 . . . . 47 ASP CB . 15991 1 551 . 1 1 47 47 ASP N N 15 121.159 0.400 . 1 . . . . 47 ASP N . 15991 1 552 . 1 1 48 48 VAL H H 1 7.517 0.020 . 1 . . . . 48 VAL H . 15991 1 553 . 1 1 48 48 VAL HA H 1 3.898 0.020 . 1 . . . . 48 VAL HA . 15991 1 554 . 1 1 48 48 VAL HB H 1 2.330 0.020 . 1 . . . . 48 VAL HB . 15991 1 555 . 1 1 48 48 VAL HG11 H 1 1.180 0.020 . 2 . . . . 48 VAL HG1 . 15991 1 556 . 1 1 48 48 VAL HG12 H 1 1.180 0.020 . 2 . . . . 48 VAL HG1 . 15991 1 557 . 1 1 48 48 VAL HG13 H 1 1.180 0.020 . 2 . . . . 48 VAL HG1 . 15991 1 558 . 1 1 48 48 VAL HG21 H 1 1.120 0.020 . 2 . . . . 48 VAL HG2 . 15991 1 559 . 1 1 48 48 VAL HG22 H 1 1.120 0.020 . 2 . . . . 48 VAL HG2 . 15991 1 560 . 1 1 48 48 VAL HG23 H 1 1.120 0.020 . 2 . . . . 48 VAL HG2 . 15991 1 561 . 1 1 48 48 VAL CA C 13 66.037 0.400 . 1 . . . . 48 VAL CA . 15991 1 562 . 1 1 48 48 VAL CB C 13 32.384 0.400 . 1 . . . . 48 VAL CB . 15991 1 563 . 1 1 48 48 VAL CG1 C 13 22.372 0.400 . 1 . . . . 48 VAL CG1 . 15991 1 564 . 1 1 48 48 VAL CG2 C 13 21.789 0.400 . 1 . . . . 48 VAL CG2 . 15991 1 565 . 1 1 48 48 VAL N N 15 119.948 0.400 . 1 . . . . 48 VAL N . 15991 1 566 . 1 1 49 49 LEU H H 1 8.318 0.020 . 1 . . . . 49 LEU H . 15991 1 567 . 1 1 49 49 LEU HA H 1 4.238 0.020 . 1 . . . . 49 LEU HA . 15991 1 568 . 1 1 49 49 LEU HB2 H 1 1.903 0.020 . 2 . . . . 49 LEU HB2 . 15991 1 569 . 1 1 49 49 LEU HB3 H 1 1.583 0.020 . 2 . . . . 49 LEU HB3 . 15991 1 570 . 1 1 49 49 LEU HD11 H 1 0.889 0.020 . 2 . . . . 49 LEU HD1 . 15991 1 571 . 1 1 49 49 LEU HD12 H 1 0.889 0.020 . 2 . . . . 49 LEU HD1 . 15991 1 572 . 1 1 49 49 LEU HD13 H 1 0.889 0.020 . 2 . . . . 49 LEU HD1 . 15991 1 573 . 1 1 49 49 LEU HD21 H 1 0.971 0.020 . 2 . . . . 49 LEU HD2 . 15991 1 574 . 1 1 49 49 LEU HD22 H 1 0.971 0.020 . 2 . . . . 49 LEU HD2 . 15991 1 575 . 1 1 49 49 LEU HD23 H 1 0.971 0.020 . 2 . . . . 49 LEU HD2 . 15991 1 576 . 1 1 49 49 LEU CA C 13 55.860 0.400 . 1 . . . . 49 LEU CA . 15991 1 577 . 1 1 49 49 LEU CB C 13 42.200 0.400 . 1 . . . . 49 LEU CB . 15991 1 578 . 1 1 49 49 LEU CD1 C 13 26.869 0.400 . 1 . . . . 49 LEU CD1 . 15991 1 579 . 1 1 49 49 LEU CD2 C 13 22.888 0.400 . 1 . . . . 49 LEU CD2 . 15991 1 580 . 1 1 49 49 LEU N N 15 118.149 0.400 . 1 . . . . 49 LEU N . 15991 1 581 . 1 1 50 50 ARG H H 1 8.060 0.020 . 1 . . . . 50 ARG H . 15991 1 582 . 1 1 50 50 ARG HA H 1 4.108 0.020 . 1 . . . . 50 ARG HA . 15991 1 583 . 1 1 50 50 ARG HB2 H 1 2.257 0.020 . 2 . . . . 50 ARG HB2 . 15991 1 584 . 1 1 50 50 ARG HB3 H 1 1.990 0.020 . 2 . . . . 50 ARG HB3 . 15991 1 585 . 1 1 50 50 ARG HD2 H 1 3.337 0.020 . 2 . . . . 50 ARG HD2 . 15991 1 586 . 1 1 50 50 ARG HD3 H 1 3.337 0.020 . 2 . . . . 50 ARG HD3 . 15991 1 587 . 1 1 50 50 ARG HG2 H 1 1.701 0.020 . 2 . . . . 50 ARG HG2 . 15991 1 588 . 1 1 50 50 ARG HG3 H 1 1.701 0.020 . 2 . . . . 50 ARG HG3 . 15991 1 589 . 1 1 50 50 ARG CA C 13 56.946 0.400 . 1 . . . . 50 ARG CA . 15991 1 590 . 1 1 50 50 ARG CB C 13 26.776 0.400 . 1 . . . . 50 ARG CB . 15991 1 591 . 1 1 50 50 ARG CD C 13 43.859 0.400 . 1 . . . . 50 ARG CD . 15991 1 592 . 1 1 50 50 ARG CG C 13 27.483 0.400 . 1 . . . . 50 ARG CG . 15991 1 593 . 1 1 50 50 ARG N N 15 116.065 0.400 . 1 . . . . 50 ARG N . 15991 1 594 . 1 1 51 51 CYS H H 1 8.319 0.020 . 1 . . . . 51 CYS H . 15991 1 595 . 1 1 51 51 CYS HA H 1 5.256 0.020 . 1 . . . . 51 CYS HA . 15991 1 596 . 1 1 51 51 CYS HB2 H 1 3.519 0.020 . 2 . . . . 51 CYS HB2 . 15991 1 597 . 1 1 51 51 CYS HB3 H 1 2.601 0.020 . 2 . . . . 51 CYS HB3 . 15991 1 598 . 1 1 51 51 CYS CA C 13 55.054 0.400 . 1 . . . . 51 CYS CA . 15991 1 599 . 1 1 51 51 CYS CB C 13 32.111 0.400 . 1 . . . . 51 CYS CB . 15991 1 600 . 1 1 51 51 CYS N N 15 115.935 0.400 . 1 . . . . 51 CYS N . 15991 1 601 . 1 1 52 52 SER H H 1 8.964 0.020 . 1 . . . . 52 SER H . 15991 1 602 . 1 1 52 52 SER HA H 1 4.774 0.020 . 1 . . . . 52 SER HA . 15991 1 603 . 1 1 52 52 SER HB2 H 1 4.434 0.020 . 2 . . . . 52 SER HB2 . 15991 1 604 . 1 1 52 52 SER HB3 H 1 4.098 0.020 . 2 . . . . 52 SER HB3 . 15991 1 605 . 1 1 52 52 SER CA C 13 57.680 0.400 . 1 . . . . 52 SER CA . 15991 1 606 . 1 1 52 52 SER CB C 13 65.201 0.400 . 1 . . . . 52 SER CB . 15991 1 607 . 1 1 52 52 SER N N 15 117.118 0.400 . 1 . . . . 52 SER N . 15991 1 608 . 1 1 53 53 VAL H H 1 8.882 0.020 . 1 . . . . 53 VAL H . 15991 1 609 . 1 1 53 53 VAL HA H 1 3.850 0.020 . 1 . . . . 53 VAL HA . 15991 1 610 . 1 1 53 53 VAL HB H 1 2.154 0.020 . 1 . . . . 53 VAL HB . 15991 1 611 . 1 1 53 53 VAL HG11 H 1 1.185 0.020 . 2 . . . . 53 VAL HG1 . 15991 1 612 . 1 1 53 53 VAL HG12 H 1 1.185 0.020 . 2 . . . . 53 VAL HG1 . 15991 1 613 . 1 1 53 53 VAL HG13 H 1 1.185 0.020 . 2 . . . . 53 VAL HG1 . 15991 1 614 . 1 1 53 53 VAL HG21 H 1 1.043 0.020 . 2 . . . . 53 VAL HG2 . 15991 1 615 . 1 1 53 53 VAL HG22 H 1 1.043 0.020 . 2 . . . . 53 VAL HG2 . 15991 1 616 . 1 1 53 53 VAL HG23 H 1 1.043 0.020 . 2 . . . . 53 VAL HG2 . 15991 1 617 . 1 1 53 53 VAL CA C 13 66.534 0.400 . 1 . . . . 53 VAL CA . 15991 1 618 . 1 1 53 53 VAL CB C 13 32.062 0.400 . 1 . . . . 53 VAL CB . 15991 1 619 . 1 1 53 53 VAL CG1 C 13 23.919 0.400 . 1 . . . . 53 VAL CG1 . 15991 1 620 . 1 1 53 53 VAL CG2 C 13 21.691 0.400 . 1 . . . . 53 VAL CG2 . 15991 1 621 . 1 1 53 53 VAL N N 15 125.459 0.400 . 1 . . . . 53 VAL N . 15991 1 622 . 1 1 54 54 GLU H H 1 8.545 0.020 . 1 . . . . 54 GLU H . 15991 1 623 . 1 1 54 54 GLU HA H 1 4.070 0.020 . 1 . . . . 54 GLU HA . 15991 1 624 . 1 1 54 54 GLU HB2 H 1 2.147 0.020 . 2 . . . . 54 GLU HB2 . 15991 1 625 . 1 1 54 54 GLU HB3 H 1 2.011 0.020 . 2 . . . . 54 GLU HB3 . 15991 1 626 . 1 1 54 54 GLU HG2 H 1 2.407 0.020 . 2 . . . . 54 GLU HG2 . 15991 1 627 . 1 1 54 54 GLU HG3 H 1 2.379 0.020 . 2 . . . . 54 GLU HG3 . 15991 1 628 . 1 1 54 54 GLU CA C 13 60.488 0.400 . 1 . . . . 54 GLU CA . 15991 1 629 . 1 1 54 54 GLU CB C 13 29.730 0.400 . 1 . . . . 54 GLU CB . 15991 1 630 . 1 1 54 54 GLU CG C 13 37.245 0.400 . 1 . . . . 54 GLU CG . 15991 1 631 . 1 1 54 54 GLU N N 15 118.744 0.400 . 1 . . . . 54 GLU N . 15991 1 632 . 1 1 55 55 GLU H H 1 7.908 0.020 . 1 . . . . 55 GLU H . 15991 1 633 . 1 1 55 55 GLU HA H 1 4.120 0.020 . 1 . . . . 55 GLU HA . 15991 1 634 . 1 1 55 55 GLU HB2 H 1 2.279 0.020 . 2 . . . . 55 GLU HB2 . 15991 1 635 . 1 1 55 55 GLU HB3 H 1 2.042 0.020 . 2 . . . . 55 GLU HB3 . 15991 1 636 . 1 1 55 55 GLU HG2 H 1 2.431 0.020 . 2 . . . . 55 GLU HG2 . 15991 1 637 . 1 1 55 55 GLU HG3 H 1 2.304 0.020 . 2 . . . . 55 GLU HG3 . 15991 1 638 . 1 1 55 55 GLU CA C 13 59.417 0.400 . 1 . . . . 55 GLU CA . 15991 1 639 . 1 1 55 55 GLU CB C 13 30.370 0.400 . 1 . . . . 55 GLU CB . 15991 1 640 . 1 1 55 55 GLU CG C 13 36.948 0.400 . 1 . . . . 55 GLU CG . 15991 1 641 . 1 1 55 55 GLU N N 15 120.086 0.400 . 1 . . . . 55 GLU N . 15991 1 642 . 1 1 56 56 LEU H H 1 7.956 0.020 . 1 . . . . 56 LEU H . 15991 1 643 . 1 1 56 56 LEU HA H 1 4.187 0.020 . 1 . . . . 56 LEU HA . 15991 1 644 . 1 1 56 56 LEU HB2 H 1 1.940 0.020 . 2 . . . . 56 LEU HB2 . 15991 1 645 . 1 1 56 56 LEU HB3 H 1 1.650 0.020 . 2 . . . . 56 LEU HB3 . 15991 1 646 . 1 1 56 56 LEU HD11 H 1 0.912 0.020 . 2 . . . . 56 LEU HD1 . 15991 1 647 . 1 1 56 56 LEU HD12 H 1 0.912 0.020 . 2 . . . . 56 LEU HD1 . 15991 1 648 . 1 1 56 56 LEU HD13 H 1 0.912 0.020 . 2 . . . . 56 LEU HD1 . 15991 1 649 . 1 1 56 56 LEU HD21 H 1 0.984 0.020 . 2 . . . . 56 LEU HD2 . 15991 1 650 . 1 1 56 56 LEU HD22 H 1 0.984 0.020 . 2 . . . . 56 LEU HD2 . 15991 1 651 . 1 1 56 56 LEU HD23 H 1 0.984 0.020 . 2 . . . . 56 LEU HD2 . 15991 1 652 . 1 1 56 56 LEU CA C 13 57.828 0.400 . 1 . . . . 56 LEU CA . 15991 1 653 . 1 1 56 56 LEU CB C 13 42.460 0.400 . 1 . . . . 56 LEU CB . 15991 1 654 . 1 1 56 56 LEU CD1 C 13 27.338 0.400 . 1 . . . . 56 LEU CD1 . 15991 1 655 . 1 1 56 56 LEU N N 15 121.358 0.400 . 1 . . . . 56 LEU N . 15991 1 656 . 1 1 57 57 GLU H H 1 9.025 0.020 . 1 . . . . 57 GLU H . 15991 1 657 . 1 1 57 57 GLU HA H 1 4.683 0.020 . 1 . . . . 57 GLU HA . 15991 1 658 . 1 1 57 57 GLU HB2 H 1 2.234 0.020 . 2 . . . . 57 GLU HB2 . 15991 1 659 . 1 1 57 57 GLU HB3 H 1 1.986 0.020 . 2 . . . . 57 GLU HB3 . 15991 1 660 . 1 1 57 57 GLU HG2 H 1 2.520 0.020 . 2 . . . . 57 GLU HG2 . 15991 1 661 . 1 1 57 57 GLU HG3 H 1 2.520 0.020 . 2 . . . . 57 GLU HG3 . 15991 1 662 . 1 1 57 57 GLU CA C 13 58.462 0.400 . 1 . . . . 57 GLU CA . 15991 1 663 . 1 1 57 57 GLU CB C 13 29.113 0.400 . 1 . . . . 57 GLU CB . 15991 1 664 . 1 1 57 57 GLU CG C 13 37.664 0.400 . 1 . . . . 57 GLU CG . 15991 1 665 . 1 1 57 57 GLU N N 15 121.275 0.400 . 1 . . . . 57 GLU N . 15991 1 666 . 1 1 58 58 LYS H H 1 7.791 0.020 . 1 . . . . 58 LYS H . 15991 1 667 . 1 1 58 58 LYS HA H 1 4.060 0.020 . 1 . . . . 58 LYS HA . 15991 1 668 . 1 1 58 58 LYS HB2 H 1 2.055 0.020 . 2 . . . . 58 LYS HB2 . 15991 1 669 . 1 1 58 58 LYS HB3 H 1 2.055 0.020 . 2 . . . . 58 LYS HB3 . 15991 1 670 . 1 1 58 58 LYS HD2 H 1 1.805 0.020 . 2 . . . . 58 LYS HD2 . 15991 1 671 . 1 1 58 58 LYS HD3 H 1 1.805 0.020 . 2 . . . . 58 LYS HD3 . 15991 1 672 . 1 1 58 58 LYS HE2 H 1 3.062 0.020 . 2 . . . . 58 LYS HE2 . 15991 1 673 . 1 1 58 58 LYS HE3 H 1 3.062 0.020 . 2 . . . . 58 LYS HE3 . 15991 1 674 . 1 1 58 58 LYS HG2 H 1 1.752 0.020 . 2 . . . . 58 LYS HG2 . 15991 1 675 . 1 1 58 58 LYS HG3 H 1 1.478 0.020 . 2 . . . . 58 LYS HG3 . 15991 1 676 . 1 1 58 58 LYS CA C 13 60.282 0.400 . 1 . . . . 58 LYS CA . 15991 1 677 . 1 1 58 58 LYS CB C 13 32.629 0.400 . 1 . . . . 58 LYS CB . 15991 1 678 . 1 1 58 58 LYS CD C 13 29.745 0.400 . 1 . . . . 58 LYS CD . 15991 1 679 . 1 1 58 58 LYS CG C 13 26.084 0.400 . 1 . . . . 58 LYS CG . 15991 1 680 . 1 1 58 58 LYS N N 15 119.508 0.400 . 1 . . . . 58 LYS N . 15991 1 681 . 1 1 59 59 VAL H H 1 7.595 0.020 . 1 . . . . 59 VAL H . 15991 1 682 . 1 1 59 59 VAL HA H 1 3.616 0.020 . 1 . . . . 59 VAL HA . 15991 1 683 . 1 1 59 59 VAL HB H 1 2.422 0.020 . 1 . . . . 59 VAL HB . 15991 1 684 . 1 1 59 59 VAL HG11 H 1 1.318 0.020 . 2 . . . . 59 VAL HG1 . 15991 1 685 . 1 1 59 59 VAL HG12 H 1 1.318 0.020 . 2 . . . . 59 VAL HG1 . 15991 1 686 . 1 1 59 59 VAL HG13 H 1 1.318 0.020 . 2 . . . . 59 VAL HG1 . 15991 1 687 . 1 1 59 59 VAL HG21 H 1 1.055 0.020 . 2 . . . . 59 VAL HG2 . 15991 1 688 . 1 1 59 59 VAL HG22 H 1 1.055 0.020 . 2 . . . . 59 VAL HG2 . 15991 1 689 . 1 1 59 59 VAL HG23 H 1 1.055 0.020 . 2 . . . . 59 VAL HG2 . 15991 1 690 . 1 1 59 59 VAL CA C 13 67.467 0.400 . 1 . . . . 59 VAL CA . 15991 1 691 . 1 1 59 59 VAL CB C 13 32.232 0.400 . 1 . . . . 59 VAL CB . 15991 1 692 . 1 1 59 59 VAL CG1 C 13 24.907 0.400 . 1 . . . . 59 VAL CG1 . 15991 1 693 . 1 1 59 59 VAL CG2 C 13 22.138 0.400 . 1 . . . . 59 VAL CG2 . 15991 1 694 . 1 1 59 59 VAL N N 15 119.280 0.400 . 1 . . . . 59 VAL N . 15991 1 695 . 1 1 60 60 ARG H H 1 9.266 0.020 . 1 . . . . 60 ARG H . 15991 1 696 . 1 1 60 60 ARG HA H 1 3.622 0.020 . 1 . . . . 60 ARG HA . 15991 1 697 . 1 1 60 60 ARG HB2 H 1 2.284 0.020 . 2 . . . . 60 ARG HB2 . 15991 1 698 . 1 1 60 60 ARG HB3 H 1 1.658 0.020 . 2 . . . . 60 ARG HB3 . 15991 1 699 . 1 1 60 60 ARG HG2 H 1 1.721 0.020 . 2 . . . . 60 ARG HG2 . 15991 1 700 . 1 1 60 60 ARG HG3 H 1 1.462 0.020 . 2 . . . . 60 ARG HG3 . 15991 1 701 . 1 1 60 60 ARG CA C 13 61.165 0.400 . 1 . . . . 60 ARG CA . 15991 1 702 . 1 1 60 60 ARG CB C 13 32.229 0.400 . 1 . . . . 60 ARG CB . 15991 1 703 . 1 1 60 60 ARG N N 15 123.719 0.400 . 1 . . . . 60 ARG N . 15991 1 704 . 1 1 61 61 GLN H H 1 8.527 0.020 . 1 . . . . 61 GLN H . 15991 1 705 . 1 1 61 61 GLN HA H 1 3.832 0.020 . 1 . . . . 61 GLN HA . 15991 1 706 . 1 1 61 61 GLN HB2 H 1 2.316 0.020 . 2 . . . . 61 GLN HB2 . 15991 1 707 . 1 1 61 61 GLN HB3 H 1 2.194 0.020 . 2 . . . . 61 GLN HB3 . 15991 1 708 . 1 1 61 61 GLN HE21 H 1 7.905 0.020 . 2 . . . . 61 GLN HE21 . 15991 1 709 . 1 1 61 61 GLN HE22 H 1 7.131 0.020 . 2 . . . . 61 GLN HE22 . 15991 1 710 . 1 1 61 61 GLN HG2 H 1 2.708 0.020 . 2 . . . . 61 GLN HG2 . 15991 1 711 . 1 1 61 61 GLN HG3 H 1 2.625 0.020 . 2 . . . . 61 GLN HG3 . 15991 1 712 . 1 1 61 61 GLN CA C 13 59.187 0.400 . 1 . . . . 61 GLN CA . 15991 1 713 . 1 1 61 61 GLN CB C 13 28.444 0.400 . 1 . . . . 61 GLN CB . 15991 1 714 . 1 1 61 61 GLN CG C 13 34.195 0.400 . 1 . . . . 61 GLN CG . 15991 1 715 . 1 1 61 61 GLN N N 15 114.116 0.400 . 1 . . . . 61 GLN N . 15991 1 716 . 1 1 61 61 GLN NE2 N 15 115.651 0.400 . 1 . . . . 61 GLN NE2 . 15991 1 717 . 1 1 62 62 LYS H H 1 7.407 0.020 . 1 . . . . 62 LYS H . 15991 1 718 . 1 1 62 62 LYS HA H 1 4.251 0.020 . 1 . . . . 62 LYS HA . 15991 1 719 . 1 1 62 62 LYS HB2 H 1 2.245 0.020 . 2 . . . . 62 LYS HB2 . 15991 1 720 . 1 1 62 62 LYS HB3 H 1 1.843 0.020 . 2 . . . . 62 LYS HB3 . 15991 1 721 . 1 1 62 62 LYS HD2 H 1 1.741 0.020 . 2 . . . . 62 LYS HD2 . 15991 1 722 . 1 1 62 62 LYS HD3 H 1 1.665 0.020 . 2 . . . . 62 LYS HD3 . 15991 1 723 . 1 1 62 62 LYS HE2 H 1 2.995 0.020 . 2 . . . . 62 LYS HE2 . 15991 1 724 . 1 1 62 62 LYS HE3 H 1 2.995 0.020 . 2 . . . . 62 LYS HE3 . 15991 1 725 . 1 1 62 62 LYS HG2 H 1 1.929 0.020 . 2 . . . . 62 LYS HG2 . 15991 1 726 . 1 1 62 62 LYS HG3 H 1 1.434 0.020 . 2 . . . . 62 LYS HG3 . 15991 1 727 . 1 1 62 62 LYS CA C 13 60.118 0.400 . 1 . . . . 62 LYS CA . 15991 1 728 . 1 1 62 62 LYS CB C 13 33.433 0.400 . 1 . . . . 62 LYS CB . 15991 1 729 . 1 1 62 62 LYS CD C 13 30.685 0.400 . 1 . . . . 62 LYS CD . 15991 1 730 . 1 1 62 62 LYS CG C 13 27.086 0.400 . 1 . . . . 62 LYS CG . 15991 1 731 . 1 1 62 62 LYS N N 15 117.899 0.400 . 1 . . . . 62 LYS N . 15991 1 732 . 1 1 63 63 VAL H H 1 8.342 0.020 . 1 . . . . 63 VAL H . 15991 1 733 . 1 1 63 63 VAL HA H 1 3.459 0.020 . 1 . . . . 63 VAL HA . 15991 1 734 . 1 1 63 63 VAL HB H 1 2.271 0.020 . 1 . . . . 63 VAL HB . 15991 1 735 . 1 1 63 63 VAL HG11 H 1 0.995 0.020 . 2 . . . . 63 VAL HG1 . 15991 1 736 . 1 1 63 63 VAL HG12 H 1 0.995 0.020 . 2 . . . . 63 VAL HG1 . 15991 1 737 . 1 1 63 63 VAL HG13 H 1 0.995 0.020 . 2 . . . . 63 VAL HG1 . 15991 1 738 . 1 1 63 63 VAL HG21 H 1 1.060 0.020 . 2 . . . . 63 VAL HG2 . 15991 1 739 . 1 1 63 63 VAL HG22 H 1 1.060 0.020 . 2 . . . . 63 VAL HG2 . 15991 1 740 . 1 1 63 63 VAL HG23 H 1 1.060 0.020 . 2 . . . . 63 VAL HG2 . 15991 1 741 . 1 1 63 63 VAL CA C 13 67.408 0.400 . 1 . . . . 63 VAL CA . 15991 1 742 . 1 1 63 63 VAL CB C 13 32.083 0.400 . 1 . . . . 63 VAL CB . 15991 1 743 . 1 1 63 63 VAL CG1 C 13 24.962 0.400 . 1 . . . . 63 VAL CG1 . 15991 1 744 . 1 1 63 63 VAL CG2 C 13 22.852 0.400 . 1 . . . . 63 VAL CG2 . 15991 1 745 . 1 1 63 63 VAL N N 15 122.169 0.400 . 1 . . . . 63 VAL N . 15991 1 746 . 1 1 64 64 LEU H H 1 8.440 0.020 . 1 . . . . 64 LEU H . 15991 1 747 . 1 1 64 64 LEU HA H 1 4.083 0.020 . 1 . . . . 64 LEU HA . 15991 1 748 . 1 1 64 64 LEU HB2 H 1 1.946 0.020 . 2 . . . . 64 LEU HB2 . 15991 1 749 . 1 1 64 64 LEU HB3 H 1 1.565 0.020 . 2 . . . . 64 LEU HB3 . 15991 1 750 . 1 1 64 64 LEU HD11 H 1 0.914 0.020 . 2 . . . . 64 LEU HD1 . 15991 1 751 . 1 1 64 64 LEU HD12 H 1 0.914 0.020 . 2 . . . . 64 LEU HD1 . 15991 1 752 . 1 1 64 64 LEU HD13 H 1 0.914 0.020 . 2 . . . . 64 LEU HD1 . 15991 1 753 . 1 1 64 64 LEU HD21 H 1 0.734 0.020 . 2 . . . . 64 LEU HD2 . 15991 1 754 . 1 1 64 64 LEU HD22 H 1 0.734 0.020 . 2 . . . . 64 LEU HD2 . 15991 1 755 . 1 1 64 64 LEU HD23 H 1 0.734 0.020 . 2 . . . . 64 LEU HD2 . 15991 1 756 . 1 1 64 64 LEU CA C 13 58.388 0.400 . 1 . . . . 64 LEU CA . 15991 1 757 . 1 1 64 64 LEU CB C 13 44.368 0.400 . 1 . . . . 64 LEU CB . 15991 1 758 . 1 1 64 64 LEU CD1 C 13 25.783 0.400 . 1 . . . . 64 LEU CD1 . 15991 1 759 . 1 1 64 64 LEU CD2 C 13 24.422 0.400 . 1 . . . . 64 LEU CD2 . 15991 1 760 . 1 1 64 64 LEU N N 15 117.605 0.400 . 1 . . . . 64 LEU N . 15991 1 761 . 1 1 65 65 ARG H H 1 6.693 0.020 . 1 . . . . 65 ARG H . 15991 1 762 . 1 1 65 65 ARG HA H 1 4.430 0.020 . 1 . . . . 65 ARG HA . 15991 1 763 . 1 1 65 65 ARG HB2 H 1 2.323 0.020 . 2 . . . . 65 ARG HB2 . 15991 1 764 . 1 1 65 65 ARG HB3 H 1 1.566 0.020 . 2 . . . . 65 ARG HB3 . 15991 1 765 . 1 1 65 65 ARG HD2 H 1 3.266 0.020 . 2 . . . . 65 ARG HD2 . 15991 1 766 . 1 1 65 65 ARG HD3 H 1 3.266 0.020 . 2 . . . . 65 ARG HD3 . 15991 1 767 . 1 1 65 65 ARG HE H 1 7.578 0.020 . 1 . . . . 65 ARG HE . 15991 1 768 . 1 1 65 65 ARG HG2 H 1 1.832 0.020 . 2 . . . . 65 ARG HG2 . 15991 1 769 . 1 1 65 65 ARG HG3 H 1 1.651 0.020 . 2 . . . . 65 ARG HG3 . 15991 1 770 . 1 1 65 65 ARG CA C 13 56.298 0.400 . 1 . . . . 65 ARG CA . 15991 1 771 . 1 1 65 65 ARG CB C 13 30.799 0.400 . 1 . . . . 65 ARG CB . 15991 1 772 . 1 1 65 65 ARG CD C 13 43.458 0.400 . 1 . . . . 65 ARG CD . 15991 1 773 . 1 1 65 65 ARG CG C 13 30.418 0.400 . 1 . . . . 65 ARG CG . 15991 1 774 . 1 1 65 65 ARG N N 15 111.719 0.400 . 1 . . . . 65 ARG N . 15991 1 775 . 1 1 65 65 ARG NE N 15 86.521 0.400 . 1 . . . . 65 ARG NE . 15991 1 776 . 1 1 66 66 LEU H H 1 7.557 0.020 . 1 . . . . 66 LEU H . 15991 1 777 . 1 1 66 66 LEU HA H 1 4.511 0.020 . 1 . . . . 66 LEU HA . 15991 1 778 . 1 1 66 66 LEU HB2 H 1 1.998 0.020 . 2 . . . . 66 LEU HB2 . 15991 1 779 . 1 1 66 66 LEU HB3 H 1 1.318 0.020 . 2 . . . . 66 LEU HB3 . 15991 1 780 . 1 1 66 66 LEU HD11 H 1 0.808 0.020 . 2 . . . . 66 LEU HD1 . 15991 1 781 . 1 1 66 66 LEU HD12 H 1 0.808 0.020 . 2 . . . . 66 LEU HD1 . 15991 1 782 . 1 1 66 66 LEU HD13 H 1 0.808 0.020 . 2 . . . . 66 LEU HD1 . 15991 1 783 . 1 1 66 66 LEU HD21 H 1 0.798 0.020 . 2 . . . . 66 LEU HD2 . 15991 1 784 . 1 1 66 66 LEU HD22 H 1 0.798 0.020 . 2 . . . . 66 LEU HD2 . 15991 1 785 . 1 1 66 66 LEU HD23 H 1 0.798 0.020 . 2 . . . . 66 LEU HD2 . 15991 1 786 . 1 1 66 66 LEU HG H 1 2.172 0.020 . 1 . . . . 66 LEU HG . 15991 1 787 . 1 1 66 66 LEU CA C 13 54.121 0.400 . 1 . . . . 66 LEU CA . 15991 1 788 . 1 1 66 66 LEU CB C 13 42.419 0.400 . 1 . . . . 66 LEU CB . 15991 1 789 . 1 1 66 66 LEU CD1 C 13 27.857 0.400 . 1 . . . . 66 LEU CD1 . 15991 1 790 . 1 1 66 66 LEU CD2 C 13 23.153 0.400 . 1 . . . . 66 LEU CD2 . 15991 1 791 . 1 1 66 66 LEU CG C 13 26.266 0.400 . 1 . . . . 66 LEU CG . 15991 1 792 . 1 1 66 66 LEU N N 15 122.677 0.400 . 1 . . . . 66 LEU N . 15991 1 793 . 1 1 67 67 GLU HA H 1 4.394 0.020 . 1 . . . . 67 GLU HA . 15991 1 794 . 1 1 67 67 GLU HB2 H 1 1.945 0.020 . 2 . . . . 67 GLU HB2 . 15991 1 795 . 1 1 67 67 GLU HB3 H 1 1.824 0.020 . 2 . . . . 67 GLU HB3 . 15991 1 796 . 1 1 67 67 GLU HG2 H 1 2.382 0.020 . 2 . . . . 67 GLU HG2 . 15991 1 797 . 1 1 67 67 GLU HG3 H 1 2.289 0.020 . 2 . . . . 67 GLU HG3 . 15991 1 798 . 1 1 67 67 GLU CA C 13 54.783 0.400 . 1 . . . . 67 GLU CA . 15991 1 799 . 1 1 67 67 GLU CB C 13 31.026 0.400 . 1 . . . . 67 GLU CB . 15991 1 800 . 1 1 67 67 GLU CG C 13 36.912 0.400 . 1 . . . . 67 GLU CG . 15991 1 801 . 1 1 68 68 PRO HA H 1 4.649 0.020 . 1 . . . . 68 PRO HA . 15991 1 802 . 1 1 68 68 PRO HB2 H 1 2.390 0.020 . 2 . . . . 68 PRO HB2 . 15991 1 803 . 1 1 68 68 PRO HB3 H 1 2.269 0.020 . 2 . . . . 68 PRO HB3 . 15991 1 804 . 1 1 68 68 PRO HD2 H 1 3.600 0.020 . 2 . . . . 68 PRO HD2 . 15991 1 805 . 1 1 68 68 PRO HD3 H 1 3.490 0.020 . 2 . . . . 68 PRO HD3 . 15991 1 806 . 1 1 68 68 PRO HG2 H 1 1.857 0.020 . 2 . . . . 68 PRO HG2 . 15991 1 807 . 1 1 68 68 PRO HG3 H 1 1.857 0.020 . 2 . . . . 68 PRO HG3 . 15991 1 808 . 1 1 68 68 PRO CA C 13 63.006 0.400 . 1 . . . . 68 PRO CA . 15991 1 809 . 1 1 68 68 PRO CB C 13 34.305 0.400 . 1 . . . . 68 PRO CB . 15991 1 810 . 1 1 68 68 PRO CD C 13 50.516 0.400 . 1 . . . . 68 PRO CD . 15991 1 811 . 1 1 68 68 PRO CG C 13 25.518 0.400 . 1 . . . . 68 PRO CG . 15991 1 812 . 1 1 69 69 LEU HA H 1 4.486 0.020 . 1 . . . . 69 LEU HA . 15991 1 813 . 1 1 69 69 LEU HB2 H 1 1.937 0.020 . 2 . . . . 69 LEU HB2 . 15991 1 814 . 1 1 69 69 LEU HB3 H 1 1.684 0.020 . 2 . . . . 69 LEU HB3 . 15991 1 815 . 1 1 69 69 LEU HD11 H 1 1.052 0.020 . 2 . . . . 69 LEU HD1 . 15991 1 816 . 1 1 69 69 LEU HD12 H 1 1.052 0.020 . 2 . . . . 69 LEU HD1 . 15991 1 817 . 1 1 69 69 LEU HD13 H 1 1.052 0.020 . 2 . . . . 69 LEU HD1 . 15991 1 818 . 1 1 69 69 LEU HD21 H 1 0.917 0.020 . 2 . . . . 69 LEU HD2 . 15991 1 819 . 1 1 69 69 LEU HD22 H 1 0.917 0.020 . 2 . . . . 69 LEU HD2 . 15991 1 820 . 1 1 69 69 LEU HD23 H 1 0.917 0.020 . 2 . . . . 69 LEU HD2 . 15991 1 821 . 1 1 69 69 LEU HG H 1 1.165 0.020 . 1 . . . . 69 LEU HG . 15991 1 822 . 1 1 69 69 LEU CA C 13 57.093 0.400 . 1 . . . . 69 LEU CA . 15991 1 823 . 1 1 69 69 LEU CB C 13 44.546 0.400 . 1 . . . . 69 LEU CB . 15991 1 824 . 1 1 69 69 LEU CD1 C 13 25.750 0.400 . 1 . . . . 69 LEU CD1 . 15991 1 825 . 1 1 69 69 LEU CD2 C 13 25.646 0.400 . 1 . . . . 69 LEU CD2 . 15991 1 826 . 1 1 70 70 GLY H H 1 9.295 0.020 . 1 . . . . 70 GLY H . 15991 1 827 . 1 1 70 70 GLY HA2 H 1 4.341 0.020 . 2 . . . . 70 GLY HA2 . 15991 1 828 . 1 1 70 70 GLY HA3 H 1 3.497 0.020 . 2 . . . . 70 GLY HA3 . 15991 1 829 . 1 1 70 70 GLY CA C 13 46.552 0.400 . 1 . . . . 70 GLY CA . 15991 1 830 . 1 1 70 70 GLY N N 15 108.643 0.400 . 1 . . . . 70 GLY N . 15991 1 831 . 1 1 71 71 VAL H H 1 7.726 0.020 . 1 . . . . 71 VAL H . 15991 1 832 . 1 1 71 71 VAL HA H 1 3.538 0.020 . 1 . . . . 71 VAL HA . 15991 1 833 . 1 1 71 71 VAL HB H 1 2.294 0.020 . 1 . . . . 71 VAL HB . 15991 1 834 . 1 1 71 71 VAL HG11 H 1 1.015 0.020 . 2 . . . . 71 VAL HG1 . 15991 1 835 . 1 1 71 71 VAL HG12 H 1 1.015 0.020 . 2 . . . . 71 VAL HG1 . 15991 1 836 . 1 1 71 71 VAL HG13 H 1 1.015 0.020 . 2 . . . . 71 VAL HG1 . 15991 1 837 . 1 1 71 71 VAL HG21 H 1 0.762 0.020 . 2 . . . . 71 VAL HG2 . 15991 1 838 . 1 1 71 71 VAL HG22 H 1 0.762 0.020 . 2 . . . . 71 VAL HG2 . 15991 1 839 . 1 1 71 71 VAL HG23 H 1 0.762 0.020 . 2 . . . . 71 VAL HG2 . 15991 1 840 . 1 1 71 71 VAL CA C 13 65.623 0.400 . 1 . . . . 71 VAL CA . 15991 1 841 . 1 1 71 71 VAL CB C 13 30.251 0.400 . 1 . . . . 71 VAL CB . 15991 1 842 . 1 1 71 71 VAL CG1 C 13 24.400 0.400 . 1 . . . . 71 VAL CG1 . 15991 1 843 . 1 1 71 71 VAL CG2 C 13 23.338 0.400 . 1 . . . . 71 VAL CG2 . 15991 1 844 . 1 1 71 71 VAL N N 15 110.808 0.400 . 1 . . . . 71 VAL N . 15991 1 845 . 1 1 72 72 CYS H H 1 8.022 0.020 . 1 . . . . 72 CYS H . 15991 1 846 . 1 1 72 72 CYS HA H 1 3.469 0.020 . 1 . . . . 72 CYS HA . 15991 1 847 . 1 1 72 72 CYS HB2 H 1 3.929 0.020 . 2 . . . . 72 CYS HB2 . 15991 1 848 . 1 1 72 72 CYS HB3 H 1 3.075 0.020 . 2 . . . . 72 CYS HB3 . 15991 1 849 . 1 1 72 72 CYS CA C 13 62.733 0.400 . 1 . . . . 72 CYS CA . 15991 1 850 . 1 1 72 72 CYS CB C 13 27.163 0.400 . 1 . . . . 72 CYS CB . 15991 1 851 . 1 1 72 72 CYS N N 15 109.483 0.400 . 1 . . . . 72 CYS N . 15991 1 852 . 1 1 73 73 SER H H 1 7.996 0.020 . 1 . . . . 73 SER H . 15991 1 853 . 1 1 73 73 SER HA H 1 4.439 0.020 . 1 . . . . 73 SER HA . 15991 1 854 . 1 1 73 73 SER HB2 H 1 4.215 0.020 . 2 . . . . 73 SER HB2 . 15991 1 855 . 1 1 73 73 SER HB3 H 1 4.075 0.020 . 2 . . . . 73 SER HB3 . 15991 1 856 . 1 1 73 73 SER CA C 13 62.145 0.400 . 1 . . . . 73 SER CA . 15991 1 857 . 1 1 73 73 SER CB C 13 66.013 0.400 . 1 . . . . 73 SER CB . 15991 1 858 . 1 1 73 73 SER N N 15 118.630 0.400 . 1 . . . . 73 SER N . 15991 1 859 . 1 1 74 74 LYS H H 1 10.186 0.020 . 1 . . . . 74 LYS H . 15991 1 860 . 1 1 74 74 LYS HA H 1 4.172 0.020 . 1 . . . . 74 LYS HA . 15991 1 861 . 1 1 74 74 LYS HB2 H 1 1.920 0.020 . 2 . . . . 74 LYS HB2 . 15991 1 862 . 1 1 74 74 LYS HB3 H 1 1.798 0.020 . 2 . . . . 74 LYS HB3 . 15991 1 863 . 1 1 74 74 LYS HE2 H 1 3.143 0.020 . 2 . . . . 74 LYS HE2 . 15991 1 864 . 1 1 74 74 LYS HE3 H 1 3.143 0.020 . 2 . . . . 74 LYS HE3 . 15991 1 865 . 1 1 74 74 LYS HG2 H 1 1.770 0.020 . 2 . . . . 74 LYS HG2 . 15991 1 866 . 1 1 74 74 LYS HG3 H 1 1.614 0.020 . 2 . . . . 74 LYS HG3 . 15991 1 867 . 1 1 74 74 LYS CA C 13 59.848 0.400 . 1 . . . . 74 LYS CA . 15991 1 868 . 1 1 74 74 LYS CB C 13 34.278 0.400 . 1 . . . . 74 LYS CB . 15991 1 869 . 1 1 74 74 LYS CG C 13 26.695 0.400 . 1 . . . . 74 LYS CG . 15991 1 870 . 1 1 74 74 LYS N N 15 123.341 0.400 . 1 . . . . 74 LYS N . 15991 1 871 . 1 1 75 75 ASP H H 1 7.542 0.020 . 1 . . . . 75 ASP H . 15991 1 872 . 1 1 75 75 ASP HA H 1 3.538 0.020 . 1 . . . . 75 ASP HA . 15991 1 873 . 1 1 75 75 ASP HB2 H 1 3.170 0.020 . 2 . . . . 75 ASP HB2 . 15991 1 874 . 1 1 75 75 ASP HB3 H 1 2.893 0.020 . 2 . . . . 75 ASP HB3 . 15991 1 875 . 1 1 75 75 ASP CA C 13 52.472 0.400 . 1 . . . . 75 ASP CA . 15991 1 876 . 1 1 75 75 ASP CB C 13 42.360 0.400 . 1 . . . . 75 ASP CB . 15991 1 877 . 1 1 75 75 ASP N N 15 112.035 0.400 . 1 . . . . 75 ASP N . 15991 1 878 . 1 1 76 76 VAL H H 1 8.128 0.020 . 1 . . . . 76 VAL H . 15991 1 879 . 1 1 76 76 VAL HA H 1 4.106 0.020 . 1 . . . . 76 VAL HA . 15991 1 880 . 1 1 76 76 VAL HB H 1 1.947 0.020 . 1 . . . . 76 VAL HB . 15991 1 881 . 1 1 76 76 VAL HG11 H 1 1.000 0.020 . 2 . . . . 76 VAL HG1 . 15991 1 882 . 1 1 76 76 VAL HG12 H 1 1.000 0.020 . 2 . . . . 76 VAL HG1 . 15991 1 883 . 1 1 76 76 VAL HG13 H 1 1.000 0.020 . 2 . . . . 76 VAL HG1 . 15991 1 884 . 1 1 76 76 VAL HG21 H 1 0.209 0.020 . 2 . . . . 76 VAL HG2 . 15991 1 885 . 1 1 76 76 VAL HG22 H 1 0.209 0.020 . 2 . . . . 76 VAL HG2 . 15991 1 886 . 1 1 76 76 VAL HG23 H 1 0.209 0.020 . 2 . . . . 76 VAL HG2 . 15991 1 887 . 1 1 76 76 VAL CA C 13 65.179 0.400 . 1 . . . . 76 VAL CA . 15991 1 888 . 1 1 76 76 VAL CB C 13 32.174 0.400 . 1 . . . . 76 VAL CB . 15991 1 889 . 1 1 76 76 VAL CG1 C 13 22.210 0.400 . 1 . . . . 76 VAL CG1 . 15991 1 890 . 1 1 76 76 VAL CG2 C 13 18.972 0.400 . 1 . . . . 76 VAL CG2 . 15991 1 891 . 1 1 76 76 VAL N N 15 117.992 0.400 . 1 . . . . 76 VAL N . 15991 1 892 . 1 1 77 77 TRP H H 1 6.869 0.020 . 1 . . . . 77 TRP H . 15991 1 893 . 1 1 77 77 TRP HA H 1 4.509 0.020 . 1 . . . . 77 TRP HA . 15991 1 894 . 1 1 77 77 TRP HB2 H 1 3.597 0.020 . 2 . . . . 77 TRP HB2 . 15991 1 895 . 1 1 77 77 TRP HB3 H 1 3.403 0.020 . 2 . . . . 77 TRP HB3 . 15991 1 896 . 1 1 77 77 TRP HD1 H 1 7.434 0.020 . 1 . . . . 77 TRP HD1 . 15991 1 897 . 1 1 77 77 TRP HE1 H 1 10.390 0.020 . 1 . . . . 77 TRP HE1 . 15991 1 898 . 1 1 77 77 TRP HE3 H 1 7.639 0.020 . 1 . . . . 77 TRP HE3 . 15991 1 899 . 1 1 77 77 TRP CA C 13 59.207 0.400 . 1 . . . . 77 TRP CA . 15991 1 900 . 1 1 77 77 TRP CB C 13 28.941 0.400 . 1 . . . . 77 TRP CB . 15991 1 901 . 1 1 77 77 TRP N N 15 123.077 0.400 . 1 . . . . 77 TRP N . 15991 1 902 . 1 1 77 77 TRP NE1 N 15 130.090 0.400 . 1 . . . . 77 TRP NE1 . 15991 1 903 . 1 1 78 78 GLU H H 1 8.593 0.020 . 1 . . . . 78 GLU H . 15991 1 904 . 1 1 78 78 GLU HA H 1 4.318 0.020 . 1 . . . . 78 GLU HA . 15991 1 905 . 1 1 78 78 GLU HB2 H 1 2.455 0.020 . 2 . . . . 78 GLU HB2 . 15991 1 906 . 1 1 78 78 GLU HB3 H 1 2.437 0.020 . 2 . . . . 78 GLU HB3 . 15991 1 907 . 1 1 78 78 GLU HG2 H 1 2.565 0.020 . 2 . . . . 78 GLU HG2 . 15991 1 908 . 1 1 78 78 GLU HG3 H 1 2.565 0.020 . 2 . . . . 78 GLU HG3 . 15991 1 909 . 1 1 78 78 GLU CA C 13 60.038 0.400 . 1 . . . . 78 GLU CA . 15991 1 910 . 1 1 78 78 GLU CB C 13 31.178 0.400 . 1 . . . . 78 GLU CB . 15991 1 911 . 1 1 78 78 GLU CG C 13 38.261 0.400 . 1 . . . . 78 GLU CG . 15991 1 912 . 1 1 78 78 GLU N N 15 121.505 0.400 . 1 . . . . 78 GLU N . 15991 1 913 . 1 1 79 79 PHE H H 1 8.071 0.020 . 1 . . . . 79 PHE H . 15991 1 914 . 1 1 79 79 PHE HA H 1 4.986 0.020 . 1 . . . . 79 PHE HA . 15991 1 915 . 1 1 79 79 PHE HB2 H 1 3.910 0.020 . 2 . . . . 79 PHE HB2 . 15991 1 916 . 1 1 79 79 PHE HB3 H 1 3.457 0.020 . 2 . . . . 79 PHE HB3 . 15991 1 917 . 1 1 79 79 PHE HD1 H 1 7.244 0.020 . 1 . . . . 79 PHE HD1 . 15991 1 918 . 1 1 79 79 PHE HD2 H 1 7.244 0.020 . 1 . . . . 79 PHE HD2 . 15991 1 919 . 1 1 79 79 PHE CA C 13 58.749 0.400 . 1 . . . . 79 PHE CA . 15991 1 920 . 1 1 79 79 PHE CB C 13 39.732 0.400 . 1 . . . . 79 PHE CB . 15991 1 921 . 1 1 79 79 PHE N N 15 118.384 0.400 . 1 . . . . 79 PHE N . 15991 1 922 . 1 1 80 80 LEU H H 1 9.309 0.020 . 1 . . . . 80 LEU H . 15991 1 923 . 1 1 80 80 LEU HA H 1 3.970 0.020 . 1 . . . . 80 LEU HA . 15991 1 924 . 1 1 80 80 LEU HB2 H 1 2.229 0.020 . 2 . . . . 80 LEU HB2 . 15991 1 925 . 1 1 80 80 LEU HB3 H 1 1.326 0.020 . 2 . . . . 80 LEU HB3 . 15991 1 926 . 1 1 80 80 LEU HD11 H 1 0.713 0.020 . 2 . . . . 80 LEU HD1 . 15991 1 927 . 1 1 80 80 LEU HD12 H 1 0.713 0.020 . 2 . . . . 80 LEU HD1 . 15991 1 928 . 1 1 80 80 LEU HD13 H 1 0.713 0.020 . 2 . . . . 80 LEU HD1 . 15991 1 929 . 1 1 80 80 LEU HD21 H 1 0.744 0.020 . 2 . . . . 80 LEU HD2 . 15991 1 930 . 1 1 80 80 LEU HD22 H 1 0.744 0.020 . 2 . . . . 80 LEU HD2 . 15991 1 931 . 1 1 80 80 LEU HD23 H 1 0.744 0.020 . 2 . . . . 80 LEU HD2 . 15991 1 932 . 1 1 80 80 LEU HG H 1 2.003 0.020 . 1 . . . . 80 LEU HG . 15991 1 933 . 1 1 80 80 LEU CA C 13 59.307 0.400 . 1 . . . . 80 LEU CA . 15991 1 934 . 1 1 80 80 LEU CB C 13 43.257 0.400 . 1 . . . . 80 LEU CB . 15991 1 935 . 1 1 80 80 LEU CD1 C 13 27.048 0.400 . 1 . . . . 80 LEU CD1 . 15991 1 936 . 1 1 80 80 LEU CD2 C 13 24.384 0.400 . 1 . . . . 80 LEU CD2 . 15991 1 937 . 1 1 80 80 LEU N N 15 122.915 0.400 . 1 . . . . 80 LEU N . 15991 1 938 . 1 1 81 81 GLU H H 1 8.282 0.020 . 1 . . . . 81 GLU H . 15991 1 939 . 1 1 81 81 GLU HA H 1 3.832 0.020 . 1 . . . . 81 GLU HA . 15991 1 940 . 1 1 81 81 GLU HB2 H 1 2.461 0.020 . 2 . . . . 81 GLU HB2 . 15991 1 941 . 1 1 81 81 GLU HB3 H 1 2.204 0.020 . 2 . . . . 81 GLU HB3 . 15991 1 942 . 1 1 81 81 GLU HG2 H 1 2.797 0.020 . 2 . . . . 81 GLU HG2 . 15991 1 943 . 1 1 81 81 GLU HG3 H 1 2.187 0.020 . 2 . . . . 81 GLU HG3 . 15991 1 944 . 1 1 81 81 GLU CA C 13 62.069 0.400 . 1 . . . . 81 GLU CA . 15991 1 945 . 1 1 81 81 GLU CB C 13 30.249 0.400 . 1 . . . . 81 GLU CB . 15991 1 946 . 1 1 81 81 GLU CG C 13 38.869 0.400 . 1 . . . . 81 GLU CG . 15991 1 947 . 1 1 81 81 GLU N N 15 119.345 0.400 . 1 . . . . 81 GLU N . 15991 1 948 . 1 1 82 82 LEU H H 1 8.236 0.020 . 1 . . . . 82 LEU H . 15991 1 949 . 1 1 82 82 LEU HA H 1 4.187 0.020 . 1 . . . . 82 LEU HA . 15991 1 950 . 1 1 82 82 LEU HB2 H 1 2.165 0.020 . 2 . . . . 82 LEU HB2 . 15991 1 951 . 1 1 82 82 LEU HB3 H 1 2.013 0.020 . 2 . . . . 82 LEU HB3 . 15991 1 952 . 1 1 82 82 LEU HD11 H 1 1.174 0.020 . 2 . . . . 82 LEU HD1 . 15991 1 953 . 1 1 82 82 LEU HD12 H 1 1.174 0.020 . 2 . . . . 82 LEU HD1 . 15991 1 954 . 1 1 82 82 LEU HD13 H 1 1.174 0.020 . 2 . . . . 82 LEU HD1 . 15991 1 955 . 1 1 82 82 LEU HD21 H 1 1.109 0.020 . 2 . . . . 82 LEU HD2 . 15991 1 956 . 1 1 82 82 LEU HD22 H 1 1.109 0.020 . 2 . . . . 82 LEU HD2 . 15991 1 957 . 1 1 82 82 LEU HD23 H 1 1.109 0.020 . 2 . . . . 82 LEU HD2 . 15991 1 958 . 1 1 82 82 LEU HG H 1 1.855 0.020 . 1 . . . . 82 LEU HG . 15991 1 959 . 1 1 82 82 LEU CA C 13 58.348 0.400 . 1 . . . . 82 LEU CA . 15991 1 960 . 1 1 82 82 LEU CB C 13 42.827 0.400 . 1 . . . . 82 LEU CB . 15991 1 961 . 1 1 82 82 LEU CD1 C 13 27.248 0.400 . 1 . . . . 82 LEU CD1 . 15991 1 962 . 1 1 82 82 LEU CD2 C 13 25.571 0.400 . 1 . . . . 82 LEU CD2 . 15991 1 963 . 1 1 82 82 LEU N N 15 120.013 0.400 . 1 . . . . 82 LEU N . 15991 1 964 . 1 1 83 83 GLN H H 1 7.949 0.020 . 1 . . . . 83 GLN H . 15991 1 965 . 1 1 83 83 GLN HA H 1 3.812 0.020 . 1 . . . . 83 GLN HA . 15991 1 966 . 1 1 83 83 GLN HB2 H 1 2.148 0.020 . 2 . . . . 83 GLN HB2 . 15991 1 967 . 1 1 83 83 GLN HB3 H 1 2.148 0.020 . 2 . . . . 83 GLN HB3 . 15991 1 968 . 1 1 83 83 GLN CA C 13 60.248 0.400 . 1 . . . . 83 GLN CA . 15991 1 969 . 1 1 83 83 GLN CB C 13 33.537 0.400 . 1 . . . . 83 GLN CB . 15991 1 970 . 1 1 83 83 GLN N N 15 116.443 0.400 . 1 . . . . 83 GLN N . 15991 1 971 . 1 1 84 84 ILE H H 1 8.407 0.020 . 1 . . . . 84 ILE H . 15991 1 972 . 1 1 84 84 ILE HA H 1 3.644 0.020 . 1 . . . . 84 ILE HA . 15991 1 973 . 1 1 84 84 ILE HB H 1 2.208 0.020 . 1 . . . . 84 ILE HB . 15991 1 974 . 1 1 84 84 ILE HD11 H 1 0.827 0.020 . 1 . . . . 84 ILE HD1 . 15991 1 975 . 1 1 84 84 ILE HD12 H 1 0.827 0.020 . 1 . . . . 84 ILE HD1 . 15991 1 976 . 1 1 84 84 ILE HD13 H 1 0.827 0.020 . 1 . . . . 84 ILE HD1 . 15991 1 977 . 1 1 84 84 ILE HG12 H 1 2.013 0.020 . 2 . . . . 84 ILE HG12 . 15991 1 978 . 1 1 84 84 ILE HG13 H 1 0.943 0.020 . 2 . . . . 84 ILE HG13 . 15991 1 979 . 1 1 84 84 ILE HG21 H 1 1.118 0.020 . 1 . . . . 84 ILE HG2 . 15991 1 980 . 1 1 84 84 ILE HG22 H 1 1.118 0.020 . 1 . . . . 84 ILE HG2 . 15991 1 981 . 1 1 84 84 ILE HG23 H 1 1.118 0.020 . 1 . . . . 84 ILE HG2 . 15991 1 982 . 1 1 84 84 ILE CA C 13 67.288 0.400 . 1 . . . . 84 ILE CA . 15991 1 983 . 1 1 84 84 ILE CB C 13 38.305 0.400 . 1 . . . . 84 ILE CB . 15991 1 984 . 1 1 84 84 ILE CD1 C 13 15.520 0.400 . 1 . . . . 84 ILE CD1 . 15991 1 985 . 1 1 84 84 ILE CG1 C 13 30.573 0.400 . 1 . . . . 84 ILE CG1 . 15991 1 986 . 1 1 84 84 ILE CG2 C 13 20.185 0.400 . 1 . . . . 84 ILE CG2 . 15991 1 987 . 1 1 84 84 ILE N N 15 120.422 0.400 . 1 . . . . 84 ILE N . 15991 1 988 . 1 1 85 85 GLU H H 1 7.741 0.020 . 1 . . . . 85 GLU H . 15991 1 989 . 1 1 85 85 GLU HA H 1 3.811 0.020 . 1 . . . . 85 GLU HA . 15991 1 990 . 1 1 85 85 GLU HB2 H 1 2.417 0.020 . 2 . . . . 85 GLU HB2 . 15991 1 991 . 1 1 85 85 GLU HB3 H 1 2.135 0.020 . 2 . . . . 85 GLU HB3 . 15991 1 992 . 1 1 85 85 GLU HG2 H 1 2.690 0.020 . 2 . . . . 85 GLU HG2 . 15991 1 993 . 1 1 85 85 GLU HG3 H 1 2.690 0.020 . 2 . . . . 85 GLU HG3 . 15991 1 994 . 1 1 85 85 GLU CA C 13 59.862 0.400 . 1 . . . . 85 GLU CA . 15991 1 995 . 1 1 85 85 GLU CB C 13 30.360 0.400 . 1 . . . . 85 GLU CB . 15991 1 996 . 1 1 85 85 GLU CG C 13 36.758 0.400 . 1 . . . . 85 GLU CG . 15991 1 997 . 1 1 85 85 GLU N N 15 115.705 0.400 . 1 . . . . 85 GLU N . 15991 1 998 . 1 1 86 86 GLU H H 1 7.818 0.020 . 1 . . . . 86 GLU H . 15991 1 999 . 1 1 86 86 GLU HA H 1 4.274 0.020 . 1 . . . . 86 GLU HA . 15991 1 1000 . 1 1 86 86 GLU HB2 H 1 2.255 0.020 . 2 . . . . 86 GLU HB2 . 15991 1 1001 . 1 1 86 86 GLU HB3 H 1 1.956 0.020 . 2 . . . . 86 GLU HB3 . 15991 1 1002 . 1 1 86 86 GLU HG2 H 1 2.525 0.020 . 2 . . . . 86 GLU HG2 . 15991 1 1003 . 1 1 86 86 GLU HG3 H 1 2.294 0.020 . 2 . . . . 86 GLU HG3 . 15991 1 1004 . 1 1 86 86 GLU CA C 13 58.068 0.400 . 1 . . . . 86 GLU CA . 15991 1 1005 . 1 1 86 86 GLU CB C 13 31.424 0.400 . 1 . . . . 86 GLU CB . 15991 1 1006 . 1 1 86 86 GLU CG C 13 36.864 0.400 . 1 . . . . 86 GLU CG . 15991 1 1007 . 1 1 86 86 GLU N N 15 114.297 0.400 . 1 . . . . 86 GLU N . 15991 1 1008 . 1 1 87 87 ILE H H 1 8.753 0.020 . 1 . . . . 87 ILE H . 15991 1 1009 . 1 1 87 87 ILE HA H 1 3.976 0.020 . 1 . . . . 87 ILE HA . 15991 1 1010 . 1 1 87 87 ILE HB H 1 1.547 0.020 . 1 . . . . 87 ILE HB . 15991 1 1011 . 1 1 87 87 ILE HD11 H 1 0.783 0.020 . 1 . . . . 87 ILE HD1 . 15991 1 1012 . 1 1 87 87 ILE HD12 H 1 0.783 0.020 . 1 . . . . 87 ILE HD1 . 15991 1 1013 . 1 1 87 87 ILE HD13 H 1 0.783 0.020 . 1 . . . . 87 ILE HD1 . 15991 1 1014 . 1 1 87 87 ILE HG12 H 1 1.421 0.020 . 2 . . . . 87 ILE HG12 . 15991 1 1015 . 1 1 87 87 ILE HG13 H 1 1.127 0.020 . 2 . . . . 87 ILE HG13 . 15991 1 1016 . 1 1 87 87 ILE HG21 H 1 0.183 0.020 . 1 . . . . 87 ILE HG2 . 15991 1 1017 . 1 1 87 87 ILE HG22 H 1 0.183 0.020 . 1 . . . . 87 ILE HG2 . 15991 1 1018 . 1 1 87 87 ILE HG23 H 1 0.183 0.020 . 1 . . . . 87 ILE HG2 . 15991 1 1019 . 1 1 87 87 ILE CA C 13 62.660 0.400 . 1 . . . . 87 ILE CA . 15991 1 1020 . 1 1 87 87 ILE CB C 13 39.275 0.400 . 1 . . . . 87 ILE CB . 15991 1 1021 . 1 1 87 87 ILE CD1 C 13 12.918 0.400 . 1 . . . . 87 ILE CD1 . 15991 1 1022 . 1 1 87 87 ILE CG1 C 13 28.730 0.400 . 1 . . . . 87 ILE CG1 . 15991 1 1023 . 1 1 87 87 ILE CG2 C 13 17.134 0.400 . 1 . . . . 87 ILE CG2 . 15991 1 1024 . 1 1 87 87 ILE N N 15 118.890 0.400 . 1 . . . . 87 ILE N . 15991 1 1025 . 1 1 88 88 TYR H H 1 8.059 0.020 . 1 . . . . 88 TYR H . 15991 1 1026 . 1 1 88 88 TYR HA H 1 5.447 0.020 . 1 . . . . 88 TYR HA . 15991 1 1027 . 1 1 88 88 TYR HB2 H 1 3.383 0.020 . 2 . . . . 88 TYR HB2 . 15991 1 1028 . 1 1 88 88 TYR HB3 H 1 2.770 0.020 . 2 . . . . 88 TYR HB3 . 15991 1 1029 . 1 1 88 88 TYR HD1 H 1 7.094 0.020 . 1 . . . . 88 TYR HD1 . 15991 1 1030 . 1 1 88 88 TYR HD2 H 1 7.094 0.020 . 1 . . . . 88 TYR HD2 . 15991 1 1031 . 1 1 88 88 TYR HE1 H 1 6.724 0.020 . 1 . . . . 88 TYR HE1 . 15991 1 1032 . 1 1 88 88 TYR HE2 H 1 6.724 0.020 . 1 . . . . 88 TYR HE2 . 15991 1 1033 . 1 1 88 88 TYR CA C 13 55.285 0.400 . 1 . . . . 88 TYR CA . 15991 1 1034 . 1 1 88 88 TYR CB C 13 40.687 0.400 . 1 . . . . 88 TYR CB . 15991 1 1035 . 1 1 88 88 TYR N N 15 119.252 0.400 . 1 . . . . 88 TYR N . 15991 1 1036 . 1 1 89 89 PRO HA H 1 4.410 0.020 . 1 . . . . 89 PRO HA . 15991 1 1037 . 1 1 89 89 PRO HB2 H 1 2.585 0.020 . 2 . . . . 89 PRO HB2 . 15991 1 1038 . 1 1 89 89 PRO HB3 H 1 2.135 0.020 . 2 . . . . 89 PRO HB3 . 15991 1 1039 . 1 1 89 89 PRO HD2 H 1 3.726 0.020 . 2 . . . . 89 PRO HD2 . 15991 1 1040 . 1 1 89 89 PRO HD3 H 1 3.168 0.020 . 2 . . . . 89 PRO HD3 . 15991 1 1041 . 1 1 89 89 PRO HG2 H 1 2.139 0.020 . 2 . . . . 89 PRO HG2 . 15991 1 1042 . 1 1 89 89 PRO HG3 H 1 2.094 0.020 . 2 . . . . 89 PRO HG3 . 15991 1 1043 . 1 1 89 89 PRO CA C 13 66.374 0.400 . 1 . . . . 89 PRO CA . 15991 1 1044 . 1 1 89 89 PRO CB C 13 31.377 0.400 . 1 . . . . 89 PRO CB . 15991 1 1045 . 1 1 89 89 PRO CD C 13 50.660 0.400 . 1 . . . . 89 PRO CD . 15991 1 1046 . 1 1 89 89 PRO CG C 13 28.401 0.400 . 1 . . . . 89 PRO CG . 15991 1 1047 . 1 1 90 90 GLU H H 1 9.234 0.020 . 1 . . . . 90 GLU H . 15991 1 1048 . 1 1 90 90 GLU HA H 1 4.379 0.020 . 1 . . . . 90 GLU HA . 15991 1 1049 . 1 1 90 90 GLU HB2 H 1 2.299 0.020 . 2 . . . . 90 GLU HB2 . 15991 1 1050 . 1 1 90 90 GLU HB3 H 1 2.200 0.020 . 2 . . . . 90 GLU HB3 . 15991 1 1051 . 1 1 90 90 GLU HG2 H 1 2.514 0.020 . 2 . . . . 90 GLU HG2 . 15991 1 1052 . 1 1 90 90 GLU HG3 H 1 2.434 0.020 . 2 . . . . 90 GLU HG3 . 15991 1 1053 . 1 1 90 90 GLU CA C 13 59.098 0.400 . 1 . . . . 90 GLU CA . 15991 1 1054 . 1 1 90 90 GLU CB C 13 29.461 0.400 . 1 . . . . 90 GLU CB . 15991 1 1055 . 1 1 90 90 GLU CG C 13 37.206 0.400 . 1 . . . . 90 GLU CG . 15991 1 1056 . 1 1 90 90 GLU N N 15 117.574 0.400 . 1 . . . . 90 GLU N . 15991 1 1057 . 1 1 91 91 GLU H H 1 7.966 0.020 . 1 . . . . 91 GLU H . 15991 1 1058 . 1 1 91 91 GLU HA H 1 4.890 0.020 . 1 . . . . 91 GLU HA . 15991 1 1059 . 1 1 91 91 GLU HB2 H 1 2.428 0.020 . 2 . . . . 91 GLU HB2 . 15991 1 1060 . 1 1 91 91 GLU HB3 H 1 1.849 0.020 . 2 . . . . 91 GLU HB3 . 15991 1 1061 . 1 1 91 91 GLU HG2 H 1 2.187 0.020 . 2 . . . . 91 GLU HG2 . 15991 1 1062 . 1 1 91 91 GLU HG3 H 1 2.187 0.020 . 2 . . . . 91 GLU HG3 . 15991 1 1063 . 1 1 91 91 GLU CA C 13 55.324 0.400 . 1 . . . . 91 GLU CA . 15991 1 1064 . 1 1 91 91 GLU CB C 13 31.590 0.400 . 1 . . . . 91 GLU CB . 15991 1 1065 . 1 1 91 91 GLU CG C 13 37.782 0.400 . 1 . . . . 91 GLU CG . 15991 1 1066 . 1 1 91 91 GLU N N 15 119.310 0.400 . 1 . . . . 91 GLU N . 15991 1 1067 . 1 1 92 92 GLU H H 1 7.263 0.020 . 1 . . . . 92 GLU H . 15991 1 1068 . 1 1 92 92 GLU HA H 1 3.789 0.020 . 1 . . . . 92 GLU HA . 15991 1 1069 . 1 1 92 92 GLU HB2 H 1 2.345 0.020 . 2 . . . . 92 GLU HB2 . 15991 1 1070 . 1 1 92 92 GLU HB3 H 1 2.124 0.020 . 2 . . . . 92 GLU HB3 . 15991 1 1071 . 1 1 92 92 GLU HG2 H 1 2.340 0.020 . 2 . . . . 92 GLU HG2 . 15991 1 1072 . 1 1 92 92 GLU HG3 H 1 2.244 0.020 . 2 . . . . 92 GLU HG3 . 15991 1 1073 . 1 1 92 92 GLU CA C 13 60.628 0.400 . 1 . . . . 92 GLU CA . 15991 1 1074 . 1 1 92 92 GLU CB C 13 30.531 0.400 . 1 . . . . 92 GLU CB . 15991 1 1075 . 1 1 92 92 GLU CG C 13 36.065 0.400 . 1 . . . . 92 GLU CG . 15991 1 1076 . 1 1 92 92 GLU N N 15 121.332 0.400 . 1 . . . . 92 GLU N . 15991 1 1077 . 1 1 93 93 GLU H H 1 8.646 0.020 . 1 . . . . 93 GLU H . 15991 1 1078 . 1 1 93 93 GLU HA H 1 4.127 0.020 . 1 . . . . 93 GLU HA . 15991 1 1079 . 1 1 93 93 GLU HB2 H 1 2.269 0.020 . 2 . . . . 93 GLU HB2 . 15991 1 1080 . 1 1 93 93 GLU HB3 H 1 2.159 0.020 . 2 . . . . 93 GLU HB3 . 15991 1 1081 . 1 1 93 93 GLU HG2 H 1 2.433 0.020 . 2 . . . . 93 GLU HG2 . 15991 1 1082 . 1 1 93 93 GLU HG3 H 1 2.321 0.020 . 2 . . . . 93 GLU HG3 . 15991 1 1083 . 1 1 93 93 GLU CA C 13 60.528 0.400 . 1 . . . . 93 GLU CA . 15991 1 1084 . 1 1 93 93 GLU CB C 13 29.744 0.400 . 1 . . . . 93 GLU CB . 15991 1 1085 . 1 1 93 93 GLU CG C 13 37.700 0.400 . 1 . . . . 93 GLU CG . 15991 1 1086 . 1 1 93 93 GLU N N 15 118.207 0.400 . 1 . . . . 93 GLU N . 15991 1 1087 . 1 1 94 94 ILE H H 1 7.766 0.020 . 1 . . . . 94 ILE H . 15991 1 1088 . 1 1 94 94 ILE HA H 1 3.976 0.020 . 1 . . . . 94 ILE HA . 15991 1 1089 . 1 1 94 94 ILE HB H 1 1.971 0.020 . 1 . . . . 94 ILE HB . 15991 1 1090 . 1 1 94 94 ILE HD11 H 1 1.000 0.020 . 1 . . . . 94 ILE HD1 . 15991 1 1091 . 1 1 94 94 ILE HD12 H 1 1.000 0.020 . 1 . . . . 94 ILE HD1 . 15991 1 1092 . 1 1 94 94 ILE HD13 H 1 1.000 0.020 . 1 . . . . 94 ILE HD1 . 15991 1 1093 . 1 1 94 94 ILE HG12 H 1 1.701 0.020 . 2 . . . . 94 ILE HG12 . 15991 1 1094 . 1 1 94 94 ILE HG13 H 1 1.364 0.020 . 2 . . . . 94 ILE HG13 . 15991 1 1095 . 1 1 94 94 ILE HG21 H 1 1.041 0.020 . 1 . . . . 94 ILE HG2 . 15991 1 1096 . 1 1 94 94 ILE HG22 H 1 1.041 0.020 . 1 . . . . 94 ILE HG2 . 15991 1 1097 . 1 1 94 94 ILE HG23 H 1 1.041 0.020 . 1 . . . . 94 ILE HG2 . 15991 1 1098 . 1 1 94 94 ILE CA C 13 64.361 0.400 . 1 . . . . 94 ILE CA . 15991 1 1099 . 1 1 94 94 ILE CB C 13 38.921 0.400 . 1 . . . . 94 ILE CB . 15991 1 1100 . 1 1 94 94 ILE CD1 C 13 13.850 0.400 . 1 . . . . 94 ILE CD1 . 15991 1 1101 . 1 1 94 94 ILE CG1 C 13 29.081 0.400 . 1 . . . . 94 ILE CG1 . 15991 1 1102 . 1 1 94 94 ILE CG2 C 13 17.981 0.400 . 1 . . . . 94 ILE CG2 . 15991 1 1103 . 1 1 94 94 ILE N N 15 119.072 0.400 . 1 . . . . 94 ILE N . 15991 1 1104 . 1 1 95 95 LEU H H 1 8.340 0.020 . 1 . . . . 95 LEU H . 15991 1 1105 . 1 1 95 95 LEU HA H 1 4.300 0.020 . 1 . . . . 95 LEU HA . 15991 1 1106 . 1 1 95 95 LEU HB2 H 1 1.983 0.020 . 2 . . . . 95 LEU HB2 . 15991 1 1107 . 1 1 95 95 LEU HB3 H 1 1.352 0.020 . 2 . . . . 95 LEU HB3 . 15991 1 1108 . 1 1 95 95 LEU HD11 H 1 0.655 0.020 . 2 . . . . 95 LEU HD1 . 15991 1 1109 . 1 1 95 95 LEU HD12 H 1 0.655 0.020 . 2 . . . . 95 LEU HD1 . 15991 1 1110 . 1 1 95 95 LEU HD13 H 1 0.655 0.020 . 2 . . . . 95 LEU HD1 . 15991 1 1111 . 1 1 95 95 LEU HD21 H 1 0.736 0.020 . 2 . . . . 95 LEU HD2 . 15991 1 1112 . 1 1 95 95 LEU HD22 H 1 0.736 0.020 . 2 . . . . 95 LEU HD2 . 15991 1 1113 . 1 1 95 95 LEU HD23 H 1 0.736 0.020 . 2 . . . . 95 LEU HD2 . 15991 1 1114 . 1 1 95 95 LEU HG H 1 1.849 0.020 . 1 . . . . 95 LEU HG . 15991 1 1115 . 1 1 95 95 LEU CA C 13 57.905 0.400 . 1 . . . . 95 LEU CA . 15991 1 1116 . 1 1 95 95 LEU CB C 13 42.144 0.400 . 1 . . . . 95 LEU CB . 15991 1 1117 . 1 1 95 95 LEU CD1 C 13 27.795 0.400 . 1 . . . . 95 LEU CD1 . 15991 1 1118 . 1 1 95 95 LEU CD2 C 13 23.288 0.400 . 1 . . . . 95 LEU CD2 . 15991 1 1119 . 1 1 95 95 LEU N N 15 121.325 0.400 . 1 . . . . 95 LEU N . 15991 1 1120 . 1 1 96 96 LYS H H 1 8.899 0.020 . 1 . . . . 96 LYS H . 15991 1 1121 . 1 1 96 96 LYS HA H 1 4.075 0.020 . 1 . . . . 96 LYS HA . 15991 1 1122 . 1 1 96 96 LYS HB2 H 1 2.150 0.020 . 2 . . . . 96 LYS HB2 . 15991 1 1123 . 1 1 96 96 LYS HB3 H 1 2.011 0.020 . 2 . . . . 96 LYS HB3 . 15991 1 1124 . 1 1 96 96 LYS HE2 H 1 3.016 0.020 . 2 . . . . 96 LYS HE2 . 15991 1 1125 . 1 1 96 96 LYS HE3 H 1 2.846 0.020 . 2 . . . . 96 LYS HE3 . 15991 1 1126 . 1 1 96 96 LYS CA C 13 61.707 0.400 . 1 . . . . 96 LYS CA . 15991 1 1127 . 1 1 96 96 LYS CB C 13 32.910 0.400 . 1 . . . . 96 LYS CB . 15991 1 1128 . 1 1 96 96 LYS N N 15 120.018 0.400 . 1 . . . . 96 LYS N . 15991 1 1129 . 1 1 97 97 LYS H H 1 7.808 0.020 . 1 . . . . 97 LYS H . 15991 1 1130 . 1 1 97 97 LYS HA H 1 4.045 0.020 . 1 . . . . 97 LYS HA . 15991 1 1131 . 1 1 97 97 LYS HB2 H 1 2.061 0.020 . 2 . . . . 97 LYS HB2 . 15991 1 1132 . 1 1 97 97 LYS HB3 H 1 2.061 0.020 . 2 . . . . 97 LYS HB3 . 15991 1 1133 . 1 1 97 97 LYS HD2 H 1 1.809 0.020 . 2 . . . . 97 LYS HD2 . 15991 1 1134 . 1 1 97 97 LYS HD3 H 1 1.809 0.020 . 2 . . . . 97 LYS HD3 . 15991 1 1135 . 1 1 97 97 LYS HE2 H 1 3.085 0.020 . 2 . . . . 97 LYS HE2 . 15991 1 1136 . 1 1 97 97 LYS HE3 H 1 3.085 0.020 . 2 . . . . 97 LYS HE3 . 15991 1 1137 . 1 1 97 97 LYS HG2 H 1 1.651 0.020 . 2 . . . . 97 LYS HG2 . 15991 1 1138 . 1 1 97 97 LYS HG3 H 1 1.518 0.020 . 2 . . . . 97 LYS HG3 . 15991 1 1139 . 1 1 97 97 LYS CA C 13 60.198 0.400 . 1 . . . . 97 LYS CA . 15991 1 1140 . 1 1 97 97 LYS CB C 13 32.600 0.400 . 1 . . . . 97 LYS CB . 15991 1 1141 . 1 1 97 97 LYS CD C 13 29.920 0.400 . 1 . . . . 97 LYS CD . 15991 1 1142 . 1 1 97 97 LYS CG C 13 26.077 0.400 . 1 . . . . 97 LYS CG . 15991 1 1143 . 1 1 97 97 LYS N N 15 121.016 0.400 . 1 . . . . 97 LYS N . 15991 1 1144 . 1 1 98 98 ALA H H 1 7.814 0.020 . 1 . . . . 98 ALA H . 15991 1 1145 . 1 1 98 98 ALA HA H 1 4.320 0.020 . 1 . . . . 98 ALA HA . 15991 1 1146 . 1 1 98 98 ALA HB1 H 1 1.685 0.020 . 1 . . . . 98 ALA HB . 15991 1 1147 . 1 1 98 98 ALA HB2 H 1 1.685 0.020 . 1 . . . . 98 ALA HB . 15991 1 1148 . 1 1 98 98 ALA HB3 H 1 1.685 0.020 . 1 . . . . 98 ALA HB . 15991 1 1149 . 1 1 98 98 ALA CA C 13 55.260 0.400 . 1 . . . . 98 ALA CA . 15991 1 1150 . 1 1 98 98 ALA CB C 13 19.468 0.400 . 1 . . . . 98 ALA CB . 15991 1 1151 . 1 1 98 98 ALA N N 15 122.102 0.400 . 1 . . . . 98 ALA N . 15991 1 1152 . 1 1 99 99 LEU H H 1 8.212 0.020 . 1 . . . . 99 LEU H . 15991 1 1153 . 1 1 99 99 LEU HA H 1 4.187 0.020 . 1 . . . . 99 LEU HA . 15991 1 1154 . 1 1 99 99 LEU HB2 H 1 2.147 0.020 . 2 . . . . 99 LEU HB2 . 15991 1 1155 . 1 1 99 99 LEU HB3 H 1 2.009 0.020 . 2 . . . . 99 LEU HB3 . 15991 1 1156 . 1 1 99 99 LEU HD11 H 1 1.200 0.020 . 2 . . . . 99 LEU HD1 . 15991 1 1157 . 1 1 99 99 LEU HD12 H 1 1.200 0.020 . 2 . . . . 99 LEU HD1 . 15991 1 1158 . 1 1 99 99 LEU HD13 H 1 1.200 0.020 . 2 . . . . 99 LEU HD1 . 15991 1 1159 . 1 1 99 99 LEU HG H 1 1.246 0.020 . 1 . . . . 99 LEU HG . 15991 1 1160 . 1 1 99 99 LEU CA C 13 58.398 0.400 . 1 . . . . 99 LEU CA . 15991 1 1161 . 1 1 99 99 LEU CB C 13 42.720 0.400 . 1 . . . . 99 LEU CB . 15991 1 1162 . 1 1 99 99 LEU CD1 C 13 25.965 0.400 . 1 . . . . 99 LEU CD1 . 15991 1 1163 . 1 1 99 99 LEU CG C 13 27.025 0.400 . 1 . . . . 99 LEU CG . 15991 1 1164 . 1 1 99 99 LEU N N 15 118.467 0.400 . 1 . . . . 99 LEU N . 15991 1 1165 . 1 1 100 100 ARG H H 1 7.738 0.020 . 1 . . . . 100 ARG H . 15991 1 1166 . 1 1 100 100 ARG HA H 1 3.894 0.020 . 1 . . . . 100 ARG HA . 15991 1 1167 . 1 1 100 100 ARG HB2 H 1 2.086 0.020 . 2 . . . . 100 ARG HB2 . 15991 1 1168 . 1 1 100 100 ARG HB3 H 1 1.987 0.020 . 2 . . . . 100 ARG HB3 . 15991 1 1169 . 1 1 100 100 ARG HD2 H 1 3.308 0.020 . 2 . . . . 100 ARG HD2 . 15991 1 1170 . 1 1 100 100 ARG HD3 H 1 3.203 0.020 . 2 . . . . 100 ARG HD3 . 15991 1 1171 . 1 1 100 100 ARG HG2 H 1 1.974 0.020 . 2 . . . . 100 ARG HG2 . 15991 1 1172 . 1 1 100 100 ARG HG3 H 1 1.630 0.020 . 2 . . . . 100 ARG HG3 . 15991 1 1173 . 1 1 100 100 ARG CA C 13 60.135 0.400 . 1 . . . . 100 ARG CA . 15991 1 1174 . 1 1 100 100 ARG CB C 13 30.187 0.400 . 1 . . . . 100 ARG CB . 15991 1 1175 . 1 1 100 100 ARG CD C 13 44.097 0.400 . 1 . . . . 100 ARG CD . 15991 1 1176 . 1 1 100 100 ARG CG C 13 28.452 0.400 . 1 . . . . 100 ARG CG . 15991 1 1177 . 1 1 100 100 ARG N N 15 119.100 0.400 . 1 . . . . 100 ARG N . 15991 1 1178 . 1 1 101 101 ASP H H 1 8.186 0.020 . 1 . . . . 101 ASP H . 15991 1 1179 . 1 1 101 101 ASP HA H 1 4.424 0.020 . 1 . . . . 101 ASP HA . 15991 1 1180 . 1 1 101 101 ASP HB2 H 1 3.058 0.020 . 2 . . . . 101 ASP HB2 . 15991 1 1181 . 1 1 101 101 ASP HB3 H 1 2.467 0.020 . 2 . . . . 101 ASP HB3 . 15991 1 1182 . 1 1 101 101 ASP CA C 13 57.902 0.400 . 1 . . . . 101 ASP CA . 15991 1 1183 . 1 1 101 101 ASP CB C 13 40.033 0.400 . 1 . . . . 101 ASP CB . 15991 1 1184 . 1 1 101 101 ASP N N 15 121.899 0.400 . 1 . . . . 101 ASP N . 15991 1 1185 . 1 1 102 102 LEU H H 1 8.730 0.020 . 1 . . . . 102 LEU H . 15991 1 1186 . 1 1 102 102 LEU HA H 1 4.373 0.020 . 1 . . . . 102 LEU HA . 15991 1 1187 . 1 1 102 102 LEU HB2 H 1 2.257 0.020 . 2 . . . . 102 LEU HB2 . 15991 1 1188 . 1 1 102 102 LEU HB3 H 1 1.935 0.020 . 2 . . . . 102 LEU HB3 . 15991 1 1189 . 1 1 102 102 LEU HD11 H 1 1.130 0.020 . 2 . . . . 102 LEU HD1 . 15991 1 1190 . 1 1 102 102 LEU HD12 H 1 1.130 0.020 . 2 . . . . 102 LEU HD1 . 15991 1 1191 . 1 1 102 102 LEU HD13 H 1 1.130 0.020 . 2 . . . . 102 LEU HD1 . 15991 1 1192 . 1 1 102 102 LEU HD21 H 1 1.126 0.020 . 2 . . . . 102 LEU HD2 . 15991 1 1193 . 1 1 102 102 LEU HD22 H 1 1.126 0.020 . 2 . . . . 102 LEU HD2 . 15991 1 1194 . 1 1 102 102 LEU HD23 H 1 1.126 0.020 . 2 . . . . 102 LEU HD2 . 15991 1 1195 . 1 1 102 102 LEU CA C 13 58.218 0.400 . 1 . . . . 102 LEU CA . 15991 1 1196 . 1 1 102 102 LEU CB C 13 42.839 0.400 . 1 . . . . 102 LEU CB . 15991 1 1197 . 1 1 102 102 LEU CD1 C 13 25.849 0.400 . 1 . . . . 102 LEU CD1 . 15991 1 1198 . 1 1 102 102 LEU CD2 C 13 24.863 0.400 . 1 . . . . 102 LEU CD2 . 15991 1 1199 . 1 1 102 102 LEU N N 15 124.505 0.400 . 1 . . . . 102 LEU N . 15991 1 1200 . 1 1 103 103 LYS HA H 1 3.726 0.020 . 1 . . . . 103 LYS HA . 15991 1 1201 . 1 1 103 103 LYS HB2 H 1 1.593 0.020 . 2 . . . . 103 LYS HB2 . 15991 1 1202 . 1 1 103 103 LYS HB3 H 1 1.217 0.020 . 2 . . . . 103 LYS HB3 . 15991 1 1203 . 1 1 103 103 LYS HD2 H 1 1.034 0.020 . 2 . . . . 103 LYS HD2 . 15991 1 1204 . 1 1 103 103 LYS HD3 H 1 0.778 0.020 . 2 . . . . 103 LYS HD3 . 15991 1 1205 . 1 1 103 103 LYS HE2 H 1 2.207 0.020 . 2 . . . . 103 LYS HE2 . 15991 1 1206 . 1 1 103 103 LYS HE3 H 1 2.207 0.020 . 2 . . . . 103 LYS HE3 . 15991 1 1207 . 1 1 103 103 LYS HG2 H 1 0.694 0.020 . 2 . . . . 103 LYS HG2 . 15991 1 1208 . 1 1 103 103 LYS HG3 H 1 0.694 0.020 . 2 . . . . 103 LYS HG3 . 15991 1 1209 . 1 1 103 103 LYS CA C 13 59.760 0.400 . 1 . . . . 103 LYS CA . 15991 1 1210 . 1 1 103 103 LYS CB C 13 32.822 0.400 . 1 . . . . 103 LYS CB . 15991 1 1211 . 1 1 103 103 LYS CD C 13 29.710 0.400 . 1 . . . . 103 LYS CD . 15991 1 1212 . 1 1 103 103 LYS CE C 13 41.764 0.400 . 1 . . . . 103 LYS CE . 15991 1 1213 . 1 1 103 103 LYS CG C 13 25.324 0.400 . 1 . . . . 103 LYS CG . 15991 1 1214 . 1 1 104 104 ARG H H 1 7.409 0.020 . 1 . . . . 104 ARG H . 15991 1 1215 . 1 1 104 104 ARG HA H 1 4.432 0.020 . 1 . . . . 104 ARG HA . 15991 1 1216 . 1 1 104 104 ARG HB2 H 1 2.133 0.020 . 2 . . . . 104 ARG HB2 . 15991 1 1217 . 1 1 104 104 ARG HB3 H 1 1.981 0.020 . 2 . . . . 104 ARG HB3 . 15991 1 1218 . 1 1 104 104 ARG HD2 H 1 3.256 0.020 . 2 . . . . 104 ARG HD2 . 15991 1 1219 . 1 1 104 104 ARG HD3 H 1 3.256 0.020 . 2 . . . . 104 ARG HD3 . 15991 1 1220 . 1 1 104 104 ARG HG2 H 1 1.851 0.020 . 2 . . . . 104 ARG HG2 . 15991 1 1221 . 1 1 104 104 ARG HG3 H 1 1.851 0.020 . 2 . . . . 104 ARG HG3 . 15991 1 1222 . 1 1 104 104 ARG CA C 13 56.298 0.400 . 1 . . . . 104 ARG CA . 15991 1 1223 . 1 1 104 104 ARG CB C 13 31.215 0.400 . 1 . . . . 104 ARG CB . 15991 1 1224 . 1 1 104 104 ARG CD C 13 43.984 0.400 . 1 . . . . 104 ARG CD . 15991 1 1225 . 1 1 104 104 ARG CG C 13 27.954 0.400 . 1 . . . . 104 ARG CG . 15991 1 1226 . 1 1 104 104 ARG N N 15 115.912 0.400 . 1 . . . . 104 ARG N . 15991 1 1227 . 1 1 105 105 GLY H H 1 8.046 0.020 . 1 . . . . 105 GLY H . 15991 1 1228 . 1 1 105 105 GLY HA2 H 1 4.257 0.020 . 2 . . . . 105 GLY HA2 . 15991 1 1229 . 1 1 105 105 GLY HA3 H 1 3.930 0.020 . 2 . . . . 105 GLY HA3 . 15991 1 1230 . 1 1 105 105 GLY CA C 13 46.309 0.400 . 1 . . . . 105 GLY CA . 15991 1 1231 . 1 1 105 105 GLY N N 15 108.860 0.400 . 1 . . . . 105 GLY N . 15991 1 1232 . 1 1 106 106 LYS H H 1 8.033 0.020 . 1 . . . . 106 LYS H . 15991 1 1233 . 1 1 106 106 LYS HA H 1 4.394 0.020 . 1 . . . . 106 LYS HA . 15991 1 1234 . 1 1 106 106 LYS HB2 H 1 1.864 0.020 . 2 . . . . 106 LYS HB2 . 15991 1 1235 . 1 1 106 106 LYS HB3 H 1 1.538 0.020 . 2 . . . . 106 LYS HB3 . 15991 1 1236 . 1 1 106 106 LYS HD2 H 1 1.673 0.020 . 2 . . . . 106 LYS HD2 . 15991 1 1237 . 1 1 106 106 LYS HD3 H 1 1.673 0.020 . 2 . . . . 106 LYS HD3 . 15991 1 1238 . 1 1 106 106 LYS HE2 H 1 3.026 0.020 . 2 . . . . 106 LYS HE2 . 15991 1 1239 . 1 1 106 106 LYS HE3 H 1 3.026 0.020 . 2 . . . . 106 LYS HE3 . 15991 1 1240 . 1 1 106 106 LYS HG2 H 1 1.470 0.020 . 2 . . . . 106 LYS HG2 . 15991 1 1241 . 1 1 106 106 LYS HG3 H 1 1.470 0.020 . 2 . . . . 106 LYS HG3 . 15991 1 1242 . 1 1 106 106 LYS CA C 13 55.822 0.400 . 1 . . . . 106 LYS CA . 15991 1 1243 . 1 1 106 106 LYS CB C 13 33.449 0.400 . 1 . . . . 106 LYS CB . 15991 1 1244 . 1 1 106 106 LYS CD C 13 29.162 0.400 . 1 . . . . 106 LYS CD . 15991 1 1245 . 1 1 106 106 LYS CG C 13 25.491 0.400 . 1 . . . . 106 LYS CG . 15991 1 1246 . 1 1 106 106 LYS N N 15 121.082 0.400 . 1 . . . . 106 LYS N . 15991 1 1247 . 1 1 107 107 LYS H H 1 8.271 0.020 . 1 . . . . 107 LYS H . 15991 1 1248 . 1 1 107 107 LYS HA H 1 4.329 0.020 . 1 . . . . 107 LYS HA . 15991 1 1249 . 1 1 107 107 LYS HB2 H 1 1.831 0.020 . 2 . . . . 107 LYS HB2 . 15991 1 1250 . 1 1 107 107 LYS HB3 H 1 1.831 0.020 . 2 . . . . 107 LYS HB3 . 15991 1 1251 . 1 1 107 107 LYS HE2 H 1 3.091 0.020 . 2 . . . . 107 LYS HE2 . 15991 1 1252 . 1 1 107 107 LYS HE3 H 1 3.091 0.020 . 2 . . . . 107 LYS HE3 . 15991 1 1253 . 1 1 107 107 LYS HG2 H 1 1.592 0.020 . 2 . . . . 107 LYS HG2 . 15991 1 1254 . 1 1 107 107 LYS HG3 H 1 1.504 0.020 . 2 . . . . 107 LYS HG3 . 15991 1 1255 . 1 1 107 107 LYS CA C 13 56.673 0.400 . 1 . . . . 107 LYS CA . 15991 1 1256 . 1 1 107 107 LYS CB C 13 33.341 0.400 . 1 . . . . 107 LYS CB . 15991 1 1257 . 1 1 107 107 LYS CG C 13 25.434 0.400 . 1 . . . . 107 LYS CG . 15991 1 1258 . 1 1 107 107 LYS N N 15 121.869 0.400 . 1 . . . . 107 LYS N . 15991 1 1259 . 1 1 108 108 LEU H H 1 8.481 0.020 . 1 . . . . 108 LEU H . 15991 1 1260 . 1 1 108 108 LEU HA H 1 4.637 0.020 . 1 . . . . 108 LEU HA . 15991 1 1261 . 1 1 108 108 LEU HB2 H 1 1.686 0.020 . 2 . . . . 108 LEU HB2 . 15991 1 1262 . 1 1 108 108 LEU HB3 H 1 1.479 0.020 . 2 . . . . 108 LEU HB3 . 15991 1 1263 . 1 1 108 108 LEU HD11 H 1 0.944 0.020 . 2 . . . . 108 LEU HD1 . 15991 1 1264 . 1 1 108 108 LEU HD12 H 1 0.944 0.020 . 2 . . . . 108 LEU HD1 . 15991 1 1265 . 1 1 108 108 LEU HD13 H 1 0.944 0.020 . 2 . . . . 108 LEU HD1 . 15991 1 1266 . 1 1 108 108 LEU HD21 H 1 1.000 0.020 . 2 . . . . 108 LEU HD2 . 15991 1 1267 . 1 1 108 108 LEU HD22 H 1 1.000 0.020 . 2 . . . . 108 LEU HD2 . 15991 1 1268 . 1 1 108 108 LEU HD23 H 1 1.000 0.020 . 2 . . . . 108 LEU HD2 . 15991 1 1269 . 1 1 108 108 LEU CA C 13 53.819 0.400 . 1 . . . . 108 LEU CA . 15991 1 1270 . 1 1 108 108 LEU CB C 13 45.135 0.400 . 1 . . . . 108 LEU CB . 15991 1 1271 . 1 1 108 108 LEU CD1 C 13 26.981 0.400 . 1 . . . . 108 LEU CD1 . 15991 1 1272 . 1 1 108 108 LEU N N 15 124.360 0.400 . 1 . . . . 108 LEU N . 15991 1 1273 . 1 1 109 109 LYS H H 1 8.657 0.020 . 1 . . . . 109 LYS H . 15991 1 1274 . 1 1 109 109 LYS HA H 1 4.565 0.020 . 1 . . . . 109 LYS HA . 15991 1 1275 . 1 1 109 109 LYS HB2 H 1 2.216 0.020 . 2 . . . . 109 LYS HB2 . 15991 1 1276 . 1 1 109 109 LYS HB3 H 1 1.752 0.020 . 2 . . . . 109 LYS HB3 . 15991 1 1277 . 1 1 109 109 LYS HD2 H 1 1.865 0.020 . 2 . . . . 109 LYS HD2 . 15991 1 1278 . 1 1 109 109 LYS HD3 H 1 1.865 0.020 . 2 . . . . 109 LYS HD3 . 15991 1 1279 . 1 1 109 109 LYS HE2 H 1 3.139 0.020 . 2 . . . . 109 LYS HE2 . 15991 1 1280 . 1 1 109 109 LYS HE3 H 1 3.139 0.020 . 2 . . . . 109 LYS HE3 . 15991 1 1281 . 1 1 109 109 LYS HG2 H 1 1.795 0.020 . 2 . . . . 109 LYS HG2 . 15991 1 1282 . 1 1 109 109 LYS HG3 H 1 1.696 0.020 . 2 . . . . 109 LYS HG3 . 15991 1 1283 . 1 1 109 109 LYS CA C 13 55.511 0.400 . 1 . . . . 109 LYS CA . 15991 1 1284 . 1 1 109 109 LYS CB C 13 32.029 0.400 . 1 . . . . 109 LYS CB . 15991 1 1285 . 1 1 109 109 LYS CD C 13 29.372 0.400 . 1 . . . . 109 LYS CD . 15991 1 1286 . 1 1 109 109 LYS CG C 13 25.932 0.400 . 1 . . . . 109 LYS CG . 15991 1 1287 . 1 1 109 109 LYS N N 15 123.165 0.400 . 1 . . . . 109 LYS N . 15991 1 1288 . 1 1 110 110 PRO HA H 1 4.232 0.020 . 1 . . . . 110 PRO HA . 15991 1 1289 . 1 1 110 110 PRO HB2 H 1 2.498 0.020 . 2 . . . . 110 PRO HB2 . 15991 1 1290 . 1 1 110 110 PRO HB3 H 1 2.105 0.020 . 2 . . . . 110 PRO HB3 . 15991 1 1291 . 1 1 110 110 PRO HD2 H 1 4.030 0.020 . 2 . . . . 110 PRO HD2 . 15991 1 1292 . 1 1 110 110 PRO HD3 H 1 3.933 0.020 . 2 . . . . 110 PRO HD3 . 15991 1 1293 . 1 1 110 110 PRO HG2 H 1 2.335 0.020 . 2 . . . . 110 PRO HG2 . 15991 1 1294 . 1 1 110 110 PRO HG3 H 1 2.204 0.020 . 2 . . . . 110 PRO HG3 . 15991 1 1295 . 1 1 110 110 PRO CA C 13 66.732 0.400 . 1 . . . . 110 PRO CA . 15991 1 1296 . 1 1 110 110 PRO CB C 13 32.481 0.400 . 1 . . . . 110 PRO CB . 15991 1 1297 . 1 1 110 110 PRO CD C 13 51.075 0.400 . 1 . . . . 110 PRO CD . 15991 1 1298 . 1 1 110 110 PRO CG C 13 28.315 0.400 . 1 . . . . 110 PRO CG . 15991 1 1299 . 1 1 111 111 GLU HA H 1 4.221 0.020 . 1 . . . . 111 GLU HA . 15991 1 1300 . 1 1 111 111 GLU HB2 H 1 2.101 0.020 . 2 . . . . 111 GLU HB2 . 15991 1 1301 . 1 1 111 111 GLU HB3 H 1 2.101 0.020 . 2 . . . . 111 GLU HB3 . 15991 1 1302 . 1 1 111 111 GLU HG2 H 1 2.435 0.020 . 2 . . . . 111 GLU HG2 . 15991 1 1303 . 1 1 111 111 GLU HG3 H 1 2.343 0.020 . 2 . . . . 111 GLU HG3 . 15991 1 1304 . 1 1 111 111 GLU CA C 13 59.819 0.400 . 1 . . . . 111 GLU CA . 15991 1 1305 . 1 1 111 111 GLU CB C 13 29.250 0.400 . 1 . . . . 111 GLU CB . 15991 1 1306 . 1 1 111 111 GLU CG C 13 37.000 0.400 . 1 . . . . 111 GLU CG . 15991 1 1307 . 1 1 112 112 ILE H H 1 7.233 0.020 . 1 . . . . 112 ILE H . 15991 1 1308 . 1 1 112 112 ILE HA H 1 3.848 0.020 . 1 . . . . 112 ILE HA . 15991 1 1309 . 1 1 112 112 ILE HB H 1 2.191 0.020 . 1 . . . . 112 ILE HB . 15991 1 1310 . 1 1 112 112 ILE HD11 H 1 0.841 0.020 . 1 . . . . 112 ILE HD1 . 15991 1 1311 . 1 1 112 112 ILE HD12 H 1 0.841 0.020 . 1 . . . . 112 ILE HD1 . 15991 1 1312 . 1 1 112 112 ILE HD13 H 1 0.841 0.020 . 1 . . . . 112 ILE HD1 . 15991 1 1313 . 1 1 112 112 ILE HG12 H 1 1.661 0.020 . 2 . . . . 112 ILE HG12 . 15991 1 1314 . 1 1 112 112 ILE HG13 H 1 1.385 0.020 . 2 . . . . 112 ILE HG13 . 15991 1 1315 . 1 1 112 112 ILE HG21 H 1 0.978 0.020 . 1 . . . . 112 ILE HG2 . 15991 1 1316 . 1 1 112 112 ILE HG22 H 1 0.978 0.020 . 1 . . . . 112 ILE HG2 . 15991 1 1317 . 1 1 112 112 ILE HG23 H 1 0.978 0.020 . 1 . . . . 112 ILE HG2 . 15991 1 1318 . 1 1 112 112 ILE CA C 13 62.635 0.400 . 1 . . . . 112 ILE CA . 15991 1 1319 . 1 1 112 112 ILE CB C 13 37.159 0.400 . 1 . . . . 112 ILE CB . 15991 1 1320 . 1 1 112 112 ILE CD1 C 13 11.155 0.400 . 1 . . . . 112 ILE CD1 . 15991 1 1321 . 1 1 112 112 ILE CG1 C 13 28.534 0.400 . 1 . . . . 112 ILE CG1 . 15991 1 1322 . 1 1 112 112 ILE CG2 C 13 18.947 0.400 . 1 . . . . 112 ILE CG2 . 15991 1 1323 . 1 1 112 112 ILE N N 15 120.783 0.400 . 1 . . . . 112 ILE N . 15991 1 1324 . 1 1 113 113 LYS H H 1 8.268 0.020 . 1 . . . . 113 LYS H . 15991 1 1325 . 1 1 113 113 LYS HA H 1 3.849 0.020 . 1 . . . . 113 LYS HA . 15991 1 1326 . 1 1 113 113 LYS HB2 H 1 1.833 0.020 . 2 . . . . 113 LYS HB2 . 15991 1 1327 . 1 1 113 113 LYS HB3 H 1 1.833 0.020 . 2 . . . . 113 LYS HB3 . 15991 1 1328 . 1 1 113 113 LYS CA C 13 60.248 0.400 . 1 . . . . 113 LYS CA . 15991 1 1329 . 1 1 113 113 LYS CB C 13 32.668 0.400 . 1 . . . . 113 LYS CB . 15991 1 1330 . 1 1 113 113 LYS N N 15 121.680 0.400 . 1 . . . . 113 LYS N . 15991 1 1331 . 1 1 114 114 GLY H H 1 8.460 0.020 . 1 . . . . 114 GLY H . 15991 1 1332 . 1 1 114 114 GLY HA2 H 1 3.989 0.020 . 2 . . . . 114 GLY HA2 . 15991 1 1333 . 1 1 114 114 GLY HA3 H 1 3.900 0.020 . 2 . . . . 114 GLY HA3 . 15991 1 1334 . 1 1 114 114 GLY CA C 13 47.600 0.400 . 1 . . . . 114 GLY CA . 15991 1 1335 . 1 1 114 114 GLY N N 15 105.413 0.400 . 1 . . . . 114 GLY N . 15991 1 1336 . 1 1 115 115 LYS H H 1 7.352 0.020 . 1 . . . . 115 LYS H . 15991 1 1337 . 1 1 115 115 LYS HA H 1 4.189 0.020 . 1 . . . . 115 LYS HA . 15991 1 1338 . 1 1 115 115 LYS HB2 H 1 1.852 0.020 . 2 . . . . 115 LYS HB2 . 15991 1 1339 . 1 1 115 115 LYS HB3 H 1 1.408 0.020 . 2 . . . . 115 LYS HB3 . 15991 1 1340 . 1 1 115 115 LYS HD2 H 1 1.384 0.020 . 2 . . . . 115 LYS HD2 . 15991 1 1341 . 1 1 115 115 LYS HD3 H 1 1.358 0.020 . 2 . . . . 115 LYS HD3 . 15991 1 1342 . 1 1 115 115 LYS HE2 H 1 2.895 0.020 . 2 . . . . 115 LYS HE2 . 15991 1 1343 . 1 1 115 115 LYS HE3 H 1 2.895 0.020 . 2 . . . . 115 LYS HE3 . 15991 1 1344 . 1 1 115 115 LYS HG2 H 1 1.621 0.020 . 2 . . . . 115 LYS HG2 . 15991 1 1345 . 1 1 115 115 LYS HG3 H 1 1.416 0.020 . 2 . . . . 115 LYS HG3 . 15991 1 1346 . 1 1 115 115 LYS CA C 13 59.689 0.400 . 1 . . . . 115 LYS CA . 15991 1 1347 . 1 1 115 115 LYS CB C 13 33.428 0.400 . 1 . . . . 115 LYS CB . 15991 1 1348 . 1 1 115 115 LYS CD C 13 29.933 0.400 . 1 . . . . 115 LYS CD . 15991 1 1349 . 1 1 115 115 LYS CE C 13 42.213 0.400 . 1 . . . . 115 LYS CE . 15991 1 1350 . 1 1 115 115 LYS CG C 13 26.851 0.400 . 1 . . . . 115 LYS CG . 15991 1 1351 . 1 1 115 115 LYS N N 15 121.599 0.400 . 1 . . . . 115 LYS N . 15991 1 1352 . 1 1 116 116 LEU H H 1 8.046 0.020 . 1 . . . . 116 LEU H . 15991 1 1353 . 1 1 116 116 LEU HA H 1 4.153 0.020 . 1 . . . . 116 LEU HA . 15991 1 1354 . 1 1 116 116 LEU HB2 H 1 1.891 0.020 . 2 . . . . 116 LEU HB2 . 15991 1 1355 . 1 1 116 116 LEU HB3 H 1 1.891 0.020 . 2 . . . . 116 LEU HB3 . 15991 1 1356 . 1 1 116 116 LEU HD11 H 1 1.004 0.020 . 2 . . . . 116 LEU HD1 . 15991 1 1357 . 1 1 116 116 LEU HD12 H 1 1.004 0.020 . 2 . . . . 116 LEU HD1 . 15991 1 1358 . 1 1 116 116 LEU HD13 H 1 1.004 0.020 . 2 . . . . 116 LEU HD1 . 15991 1 1359 . 1 1 116 116 LEU HD21 H 1 0.892 0.020 . 2 . . . . 116 LEU HD2 . 15991 1 1360 . 1 1 116 116 LEU HD22 H 1 0.892 0.020 . 2 . . . . 116 LEU HD2 . 15991 1 1361 . 1 1 116 116 LEU HD23 H 1 0.892 0.020 . 2 . . . . 116 LEU HD2 . 15991 1 1362 . 1 1 116 116 LEU HG H 1 1.499 0.020 . 1 . . . . 116 LEU HG . 15991 1 1363 . 1 1 116 116 LEU CA C 13 57.698 0.400 . 1 . . . . 116 LEU CA . 15991 1 1364 . 1 1 116 116 LEU CB C 13 42.070 0.400 . 1 . . . . 116 LEU CB . 15991 1 1365 . 1 1 116 116 LEU CD2 C 13 23.913 0.400 . 1 . . . . 116 LEU CD2 . 15991 1 1366 . 1 1 116 116 LEU N N 15 118.827 0.400 . 1 . . . . 116 LEU N . 15991 1 1367 . 1 1 117 117 SER H H 1 8.321 0.020 . 1 . . . . 117 SER H . 15991 1 1368 . 1 1 117 117 SER HA H 1 4.334 0.020 . 1 . . . . 117 SER HA . 15991 1 1369 . 1 1 117 117 SER HB2 H 1 4.121 0.020 . 2 . . . . 117 SER HB2 . 15991 1 1370 . 1 1 117 117 SER HB3 H 1 4.121 0.020 . 2 . . . . 117 SER HB3 . 15991 1 1371 . 1 1 117 117 SER CA C 13 61.467 0.400 . 1 . . . . 117 SER CA . 15991 1 1372 . 1 1 117 117 SER CB C 13 63.613 0.400 . 1 . . . . 117 SER CB . 15991 1 1373 . 1 1 117 117 SER N N 15 114.829 0.400 . 1 . . . . 117 SER N . 15991 1 1374 . 1 1 118 118 ARG H H 1 7.001 0.020 . 1 . . . . 118 ARG H . 15991 1 1375 . 1 1 118 118 ARG HA H 1 4.403 0.020 . 1 . . . . 118 ARG HA . 15991 1 1376 . 1 1 118 118 ARG HB2 H 1 2.177 0.020 . 2 . . . . 118 ARG HB2 . 15991 1 1377 . 1 1 118 118 ARG HB3 H 1 1.841 0.020 . 2 . . . . 118 ARG HB3 . 15991 1 1378 . 1 1 118 118 ARG HD2 H 1 3.326 0.020 . 2 . . . . 118 ARG HD2 . 15991 1 1379 . 1 1 118 118 ARG HD3 H 1 3.326 0.020 . 2 . . . . 118 ARG HD3 . 15991 1 1380 . 1 1 118 118 ARG HG2 H 1 1.903 0.020 . 2 . . . . 118 ARG HG2 . 15991 1 1381 . 1 1 118 118 ARG HG3 H 1 1.807 0.020 . 2 . . . . 118 ARG HG3 . 15991 1 1382 . 1 1 118 118 ARG CA C 13 56.734 0.400 . 1 . . . . 118 ARG CA . 15991 1 1383 . 1 1 118 118 ARG CB C 13 31.115 0.400 . 1 . . . . 118 ARG CB . 15991 1 1384 . 1 1 118 118 ARG CG C 13 27.719 0.400 . 1 . . . . 118 ARG CG . 15991 1 1385 . 1 1 118 118 ARG N N 15 118.114 0.400 . 1 . . . . 118 ARG N . 15991 1 1386 . 1 1 119 119 LEU H H 1 7.365 0.020 . 1 . . . . 119 LEU H . 15991 1 1387 . 1 1 119 119 LEU HA H 1 4.253 0.020 . 1 . . . . 119 LEU HA . 15991 1 1388 . 1 1 119 119 LEU HB2 H 1 2.002 0.020 . 2 . . . . 119 LEU HB2 . 15991 1 1389 . 1 1 119 119 LEU HB3 H 1 1.871 0.020 . 2 . . . . 119 LEU HB3 . 15991 1 1390 . 1 1 119 119 LEU HD11 H 1 1.008 0.020 . 2 . . . . 119 LEU HD1 . 15991 1 1391 . 1 1 119 119 LEU HD12 H 1 1.008 0.020 . 2 . . . . 119 LEU HD1 . 15991 1 1392 . 1 1 119 119 LEU HD13 H 1 1.008 0.020 . 2 . . . . 119 LEU HD1 . 15991 1 1393 . 1 1 119 119 LEU HD21 H 1 0.832 0.020 . 2 . . . . 119 LEU HD2 . 15991 1 1394 . 1 1 119 119 LEU HD22 H 1 0.832 0.020 . 2 . . . . 119 LEU HD2 . 15991 1 1395 . 1 1 119 119 LEU HD23 H 1 0.832 0.020 . 2 . . . . 119 LEU HD2 . 15991 1 1396 . 1 1 119 119 LEU HG H 1 1.274 0.020 . 1 . . . . 119 LEU HG . 15991 1 1397 . 1 1 119 119 LEU CA C 13 54.639 0.400 . 1 . . . . 119 LEU CA . 15991 1 1398 . 1 1 119 119 LEU CB C 13 41.700 0.400 . 1 . . . . 119 LEU CB . 15991 1 1399 . 1 1 119 119 LEU CD1 C 13 26.997 0.400 . 1 . . . . 119 LEU CD1 . 15991 1 1400 . 1 1 119 119 LEU CD2 C 13 23.123 0.400 . 1 . . . . 119 LEU CD2 . 15991 1 1401 . 1 1 119 119 LEU N N 15 119.181 0.400 . 1 . . . . 119 LEU N . 15991 1 1402 . 1 1 120 120 ARG H H 1 8.766 0.020 . 1 . . . . 120 ARG H . 15991 1 1403 . 1 1 120 120 ARG HA H 1 4.374 0.020 . 1 . . . . 120 ARG HA . 15991 1 1404 . 1 1 120 120 ARG HB2 H 1 1.914 0.020 . 2 . . . . 120 ARG HB2 . 15991 1 1405 . 1 1 120 120 ARG HB3 H 1 1.793 0.020 . 2 . . . . 120 ARG HB3 . 15991 1 1406 . 1 1 120 120 ARG HD2 H 1 3.439 0.020 . 2 . . . . 120 ARG HD2 . 15991 1 1407 . 1 1 120 120 ARG HD3 H 1 3.439 0.020 . 2 . . . . 120 ARG HD3 . 15991 1 1408 . 1 1 120 120 ARG HG2 H 1 1.859 0.020 . 2 . . . . 120 ARG HG2 . 15991 1 1409 . 1 1 120 120 ARG HG3 H 1 1.832 0.020 . 2 . . . . 120 ARG HG3 . 15991 1 1410 . 1 1 120 120 ARG CA C 13 56.426 0.400 . 1 . . . . 120 ARG CA . 15991 1 1411 . 1 1 120 120 ARG CB C 13 32.414 0.400 . 1 . . . . 120 ARG CB . 15991 1 1412 . 1 1 120 120 ARG CD C 13 44.407 0.400 . 1 . . . . 120 ARG CD . 15991 1 1413 . 1 1 120 120 ARG CG C 13 28.534 0.400 . 1 . . . . 120 ARG CG . 15991 1 1414 . 1 1 120 120 ARG N N 15 122.099 0.400 . 1 . . . . 120 ARG N . 15991 1 1415 . 1 1 121 121 LEU H H 1 8.312 0.020 . 1 . . . . 121 LEU H . 15991 1 1416 . 1 1 121 121 LEU HA H 1 4.407 0.020 . 1 . . . . 121 LEU HA . 15991 1 1417 . 1 1 121 121 LEU HB2 H 1 1.832 0.020 . 2 . . . . 121 LEU HB2 . 15991 1 1418 . 1 1 121 121 LEU HB3 H 1 1.234 0.020 . 2 . . . . 121 LEU HB3 . 15991 1 1419 . 1 1 121 121 LEU HD11 H 1 0.874 0.020 . 2 . . . . 121 LEU HD1 . 15991 1 1420 . 1 1 121 121 LEU HD12 H 1 0.874 0.020 . 2 . . . . 121 LEU HD1 . 15991 1 1421 . 1 1 121 121 LEU HD13 H 1 0.874 0.020 . 2 . . . . 121 LEU HD1 . 15991 1 1422 . 1 1 121 121 LEU HD21 H 1 0.704 0.020 . 2 . . . . 121 LEU HD2 . 15991 1 1423 . 1 1 121 121 LEU HD22 H 1 0.704 0.020 . 2 . . . . 121 LEU HD2 . 15991 1 1424 . 1 1 121 121 LEU HD23 H 1 0.704 0.020 . 2 . . . . 121 LEU HD2 . 15991 1 1425 . 1 1 121 121 LEU HG H 1 1.531 0.020 . 1 . . . . 121 LEU HG . 15991 1 1426 . 1 1 121 121 LEU CA C 13 56.028 0.400 . 1 . . . . 121 LEU CA . 15991 1 1427 . 1 1 121 121 LEU CB C 13 43.122 0.400 . 1 . . . . 121 LEU CB . 15991 1 1428 . 1 1 121 121 LEU CD1 C 13 25.689 0.400 . 1 . . . . 121 LEU CD1 . 15991 1 1429 . 1 1 121 121 LEU CD2 C 13 23.557 0.400 . 1 . . . . 121 LEU CD2 . 15991 1 1430 . 1 1 121 121 LEU N N 15 118.761 0.400 . 1 . . . . 121 LEU N . 15991 1 1431 . 1 1 122 122 PHE H H 1 7.143 0.020 . 1 . . . . 122 PHE H . 15991 1 1432 . 1 1 122 122 PHE HA H 1 5.201 0.020 . 1 . . . . 122 PHE HA . 15991 1 1433 . 1 1 122 122 PHE HB2 H 1 3.380 0.020 . 2 . . . . 122 PHE HB2 . 15991 1 1434 . 1 1 122 122 PHE HB3 H 1 2.955 0.020 . 2 . . . . 122 PHE HB3 . 15991 1 1435 . 1 1 122 122 PHE HD1 H 1 7.356 0.020 . 1 . . . . 122 PHE HD1 . 15991 1 1436 . 1 1 122 122 PHE HD2 H 1 7.356 0.020 . 1 . . . . 122 PHE HD2 . 15991 1 1437 . 1 1 122 122 PHE HE1 H 1 7.218 0.020 . 1 . . . . 122 PHE HE1 . 15991 1 1438 . 1 1 122 122 PHE HE2 H 1 7.218 0.020 . 1 . . . . 122 PHE HE2 . 15991 1 1439 . 1 1 122 122 PHE CA C 13 53.047 0.400 . 1 . . . . 122 PHE CA . 15991 1 1440 . 1 1 122 122 PHE CB C 13 40.844 0.400 . 1 . . . . 122 PHE CB . 15991 1 1441 . 1 1 122 122 PHE N N 15 112.750 0.400 . 1 . . . . 122 PHE N . 15991 1 1442 . 1 1 123 123 PRO HA H 1 3.908 0.020 . 1 . . . . 123 PRO HA . 15991 1 1443 . 1 1 123 123 PRO HB2 H 1 1.700 0.020 . 2 . . . . 123 PRO HB2 . 15991 1 1444 . 1 1 123 123 PRO HB3 H 1 1.494 0.020 . 2 . . . . 123 PRO HB3 . 15991 1 1445 . 1 1 123 123 PRO HD2 H 1 2.857 0.020 . 2 . . . . 123 PRO HD2 . 15991 1 1446 . 1 1 123 123 PRO HD3 H 1 2.561 0.020 . 2 . . . . 123 PRO HD3 . 15991 1 1447 . 1 1 123 123 PRO HG2 H 1 1.221 0.020 . 2 . . . . 123 PRO HG2 . 15991 1 1448 . 1 1 123 123 PRO HG3 H 1 1.221 0.020 . 2 . . . . 123 PRO HG3 . 15991 1 1449 . 1 1 123 123 PRO CA C 13 65.478 0.400 . 1 . . . . 123 PRO CA . 15991 1 1450 . 1 1 123 123 PRO CB C 13 33.248 0.400 . 1 . . . . 123 PRO CB . 15991 1 1451 . 1 1 123 123 PRO CD C 13 51.697 0.400 . 1 . . . . 123 PRO CD . 15991 1 1452 . 1 1 124 124 LEU H H 1 7.208 0.020 . 1 . . . . 124 LEU H . 15991 1 1453 . 1 1 124 124 LEU HA H 1 4.673 0.020 . 1 . . . . 124 LEU HA . 15991 1 1454 . 1 1 124 124 LEU HB2 H 1 1.499 0.020 . 2 . . . . 124 LEU HB2 . 15991 1 1455 . 1 1 124 124 LEU HB3 H 1 1.447 0.020 . 2 . . . . 124 LEU HB3 . 15991 1 1456 . 1 1 124 124 LEU HD11 H 1 0.820 0.020 . 2 . . . . 124 LEU HD1 . 15991 1 1457 . 1 1 124 124 LEU HD12 H 1 0.820 0.020 . 2 . . . . 124 LEU HD1 . 15991 1 1458 . 1 1 124 124 LEU HD13 H 1 0.820 0.020 . 2 . . . . 124 LEU HD1 . 15991 1 1459 . 1 1 124 124 LEU HD21 H 1 0.804 0.020 . 2 . . . . 124 LEU HD2 . 15991 1 1460 . 1 1 124 124 LEU HD22 H 1 0.804 0.020 . 2 . . . . 124 LEU HD2 . 15991 1 1461 . 1 1 124 124 LEU HD23 H 1 0.804 0.020 . 2 . . . . 124 LEU HD2 . 15991 1 1462 . 1 1 124 124 LEU HG H 1 1.362 0.020 . 1 . . . . 124 LEU HG . 15991 1 1463 . 1 1 124 124 LEU CA C 13 53.307 0.400 . 1 . . . . 124 LEU CA . 15991 1 1464 . 1 1 124 124 LEU CB C 13 42.853 0.400 . 1 . . . . 124 LEU CB . 15991 1 1465 . 1 1 124 124 LEU CD1 C 13 25.939 0.400 . 1 . . . . 124 LEU CD1 . 15991 1 1466 . 1 1 124 124 LEU CD2 C 13 23.913 0.400 . 1 . . . . 124 LEU CD2 . 15991 1 1467 . 1 1 124 124 LEU CG C 13 27.400 0.400 . 1 . . . . 124 LEU CG . 15991 1 1468 . 1 1 124 124 LEU N N 15 113.875 0.400 . 1 . . . . 124 LEU N . 15991 1 1469 . 1 1 125 125 SER H H 1 8.990 0.020 . 1 . . . . 125 SER H . 15991 1 1470 . 1 1 125 125 SER HA H 1 4.533 0.020 . 1 . . . . 125 SER HA . 15991 1 1471 . 1 1 125 125 SER HB2 H 1 3.938 0.020 . 2 . . . . 125 SER HB2 . 15991 1 1472 . 1 1 125 125 SER HB3 H 1 3.938 0.020 . 2 . . . . 125 SER HB3 . 15991 1 1473 . 1 1 125 125 SER CA C 13 59.198 0.400 . 1 . . . . 125 SER CA . 15991 1 1474 . 1 1 125 125 SER CB C 13 64.578 0.400 . 1 . . . . 125 SER CB . 15991 1 1475 . 1 1 125 125 SER N N 15 117.894 0.400 . 1 . . . . 125 SER N . 15991 1 1476 . 1 1 126 126 SER H H 1 8.618 0.020 . 1 . . . . 126 SER H . 15991 1 1477 . 1 1 126 126 SER HA H 1 4.614 0.020 . 1 . . . . 126 SER HA . 15991 1 1478 . 1 1 126 126 SER HB2 H 1 3.990 0.020 . 2 . . . . 126 SER HB2 . 15991 1 1479 . 1 1 126 126 SER HB3 H 1 3.935 0.020 . 2 . . . . 126 SER HB3 . 15991 1 1480 . 1 1 126 126 SER CA C 13 58.730 0.400 . 1 . . . . 126 SER CA . 15991 1 1481 . 1 1 126 126 SER CB C 13 64.367 0.400 . 1 . . . . 126 SER CB . 15991 1 1482 . 1 1 126 126 SER N N 15 118.602 0.400 . 1 . . . . 126 SER N . 15991 1 1483 . 1 1 127 127 SER HA H 1 4.530 0.020 . 1 . . . . 127 SER HA . 15991 1 1484 . 1 1 127 127 SER HB2 H 1 3.918 0.020 . 2 . . . . 127 SER HB2 . 15991 1 1485 . 1 1 127 127 SER HB3 H 1 3.918 0.020 . 2 . . . . 127 SER HB3 . 15991 1 1486 . 1 1 127 127 SER CA C 13 58.954 0.400 . 1 . . . . 127 SER CA . 15991 1 1487 . 1 1 127 127 SER CB C 13 64.379 0.400 . 1 . . . . 127 SER CB . 15991 1 1488 . 1 1 128 128 ALA H H 1 8.345 0.020 . 1 . . . . 128 ALA H . 15991 1 1489 . 1 1 128 128 ALA HA H 1 4.432 0.020 . 1 . . . . 128 ALA HA . 15991 1 1490 . 1 1 128 128 ALA HB1 H 1 1.487 0.020 . 1 . . . . 128 ALA HB . 15991 1 1491 . 1 1 128 128 ALA HB2 H 1 1.487 0.020 . 1 . . . . 128 ALA HB . 15991 1 1492 . 1 1 128 128 ALA HB3 H 1 1.487 0.020 . 1 . . . . 128 ALA HB . 15991 1 1493 . 1 1 128 128 ALA CA C 13 52.963 0.400 . 1 . . . . 128 ALA CA . 15991 1 1494 . 1 1 128 128 ALA CB C 13 19.924 0.400 . 1 . . . . 128 ALA CB . 15991 1 1495 . 1 1 128 128 ALA N N 15 126.185 0.400 . 1 . . . . 128 ALA N . 15991 1 1496 . 1 1 129 129 GLU H H 1 8.329 0.020 . 1 . . . . 129 GLU H . 15991 1 1497 . 1 1 129 129 GLU HA H 1 4.353 0.020 . 1 . . . . 129 GLU HA . 15991 1 1498 . 1 1 129 129 GLU HB2 H 1 2.163 0.020 . 2 . . . . 129 GLU HB2 . 15991 1 1499 . 1 1 129 129 GLU HB3 H 1 2.037 0.020 . 2 . . . . 129 GLU HB3 . 15991 1 1500 . 1 1 129 129 GLU HG2 H 1 2.374 0.020 . 2 . . . . 129 GLU HG2 . 15991 1 1501 . 1 1 129 129 GLU HG3 H 1 2.299 0.020 . 2 . . . . 129 GLU HG3 . 15991 1 1502 . 1 1 129 129 GLU CA C 13 57.111 0.400 . 1 . . . . 129 GLU CA . 15991 1 1503 . 1 1 129 129 GLU CB C 13 30.949 0.400 . 1 . . . . 129 GLU CB . 15991 1 1504 . 1 1 129 129 GLU N N 15 120.842 0.400 . 1 . . . . 129 GLU N . 15991 1 1505 . 1 1 130 130 LYS H H 1 7.947 0.020 . 1 . . . . 130 LYS H . 15991 1 1506 . 1 1 130 130 LYS HA H 1 3.835 0.020 . 1 . . . . 130 LYS HA . 15991 1 1507 . 1 1 130 130 LYS HB2 H 1 1.986 0.020 . 2 . . . . 130 LYS HB2 . 15991 1 1508 . 1 1 130 130 LYS HB3 H 1 1.986 0.020 . 2 . . . . 130 LYS HB3 . 15991 1 1509 . 1 1 130 130 LYS HD2 H 1 1.819 0.020 . 2 . . . . 130 LYS HD2 . 15991 1 1510 . 1 1 130 130 LYS HD3 H 1 1.751 0.020 . 2 . . . . 130 LYS HD3 . 15991 1 1511 . 1 1 130 130 LYS HE2 H 1 3.103 0.020 . 2 . . . . 130 LYS HE2 . 15991 1 1512 . 1 1 130 130 LYS HE3 H 1 3.103 0.020 . 2 . . . . 130 LYS HE3 . 15991 1 1513 . 1 1 130 130 LYS HG2 H 1 1.598 0.020 . 2 . . . . 130 LYS HG2 . 15991 1 1514 . 1 1 130 130 LYS HG3 H 1 1.538 0.020 . 2 . . . . 130 LYS HG3 . 15991 1 1515 . 1 1 130 130 LYS CA C 13 57.756 0.400 . 1 . . . . 130 LYS CA . 15991 1 1516 . 1 1 130 130 LYS CB C 13 33.156 0.400 . 1 . . . . 130 LYS CB . 15991 1 1517 . 1 1 130 130 LYS CD C 13 29.553 0.400 . 1 . . . . 130 LYS CD . 15991 1 1518 . 1 1 130 130 LYS CE C 13 42.398 0.400 . 1 . . . . 130 LYS CE . 15991 1 1519 . 1 1 130 130 LYS CG C 13 24.716 0.400 . 1 . . . . 130 LYS CG . 15991 1 1520 . 1 1 130 130 LYS N N 15 127.703 0.400 . 1 . . . . 130 LYS N . 15991 1 stop_ save_