data_11190 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11190 _Entry.Title ; Solution structure of the third PDZ domain of human InaD-like protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-21 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-20 _Entry.Original_release_date 2011-07-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _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 K. Inoue . . . 11190 2 T. Nagashima . . . 11190 3 F. Hayashi . . . 11190 4 S. Yokoyama . . . 11190 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11190 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11190 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 509 11190 '15N chemical shifts' 123 11190 '1H chemical shifts' 812 11190 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-07-20 2010-07-21 original author . 11190 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DMZ 'BMRB Entry Tracking System' 11190 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11190 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution structure of the third PDZ domain of human InaD-like protein' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 K. Inoue . . . 11190 1 2 T. Nagashima . . . 11190 1 3 F. Hayashi . . . 11190 1 4 S. Yokoyama . . . 11190 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11190 _Assembly.ID 1 _Assembly.Name 'InaD-like protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PDZ domain' 1 $entity_1 A . yes native no no . . . 11190 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2dmz . . . . . . 11190 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11190 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PDZ domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGGSDSSLFETYNVE LVRKDGQSLGIRIVGYVGTS HTGEASGIYVKSVIPGSAAY HNGHIQVNDKIVAVDGVNIQ GFANHDVVEVLRNAGQVVHL TLVRRKTSSSTSPLEPPSDR GTVSGPSSG ; _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 129 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _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 2014-05-12 loop_ _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 no PDB 2DMZ . "Solution Structure Of The Third Pdz Domain Of Human Inad- Like Protein" . . . . . 100.00 129 100.00 100.00 7.30e-84 . . . . 11190 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 11190 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 . GLY . 11190 1 2 . SER . 11190 1 3 . SER . 11190 1 4 . GLY . 11190 1 5 . SER . 11190 1 6 . SER . 11190 1 7 . GLY . 11190 1 8 . GLY . 11190 1 9 . SER . 11190 1 10 . ASP . 11190 1 11 . SER . 11190 1 12 . SER . 11190 1 13 . LEU . 11190 1 14 . PHE . 11190 1 15 . GLU . 11190 1 16 . THR . 11190 1 17 . TYR . 11190 1 18 . ASN . 11190 1 19 . VAL . 11190 1 20 . GLU . 11190 1 21 . LEU . 11190 1 22 . VAL . 11190 1 23 . ARG . 11190 1 24 . LYS . 11190 1 25 . ASP . 11190 1 26 . GLY . 11190 1 27 . GLN . 11190 1 28 . SER . 11190 1 29 . LEU . 11190 1 30 . GLY . 11190 1 31 . ILE . 11190 1 32 . ARG . 11190 1 33 . ILE . 11190 1 34 . VAL . 11190 1 35 . GLY . 11190 1 36 . TYR . 11190 1 37 . VAL . 11190 1 38 . GLY . 11190 1 39 . THR . 11190 1 40 . SER . 11190 1 41 . HIS . 11190 1 42 . THR . 11190 1 43 . GLY . 11190 1 44 . GLU . 11190 1 45 . ALA . 11190 1 46 . SER . 11190 1 47 . GLY . 11190 1 48 . ILE . 11190 1 49 . TYR . 11190 1 50 . VAL . 11190 1 51 . LYS . 11190 1 52 . SER . 11190 1 53 . VAL . 11190 1 54 . ILE . 11190 1 55 . PRO . 11190 1 56 . GLY . 11190 1 57 . SER . 11190 1 58 . ALA . 11190 1 59 . ALA . 11190 1 60 . TYR . 11190 1 61 . HIS . 11190 1 62 . ASN . 11190 1 63 . GLY . 11190 1 64 . HIS . 11190 1 65 . ILE . 11190 1 66 . GLN . 11190 1 67 . VAL . 11190 1 68 . ASN . 11190 1 69 . ASP . 11190 1 70 . LYS . 11190 1 71 . ILE . 11190 1 72 . VAL . 11190 1 73 . ALA . 11190 1 74 . VAL . 11190 1 75 . ASP . 11190 1 76 . GLY . 11190 1 77 . VAL . 11190 1 78 . ASN . 11190 1 79 . ILE . 11190 1 80 . GLN . 11190 1 81 . GLY . 11190 1 82 . PHE . 11190 1 83 . ALA . 11190 1 84 . ASN . 11190 1 85 . HIS . 11190 1 86 . ASP . 11190 1 87 . VAL . 11190 1 88 . VAL . 11190 1 89 . GLU . 11190 1 90 . VAL . 11190 1 91 . LEU . 11190 1 92 . ARG . 11190 1 93 . ASN . 11190 1 94 . ALA . 11190 1 95 . GLY . 11190 1 96 . GLN . 11190 1 97 . VAL . 11190 1 98 . VAL . 11190 1 99 . HIS . 11190 1 100 . LEU . 11190 1 101 . THR . 11190 1 102 . LEU . 11190 1 103 . VAL . 11190 1 104 . ARG . 11190 1 105 . ARG . 11190 1 106 . LYS . 11190 1 107 . THR . 11190 1 108 . SER . 11190 1 109 . SER . 11190 1 110 . SER . 11190 1 111 . THR . 11190 1 112 . SER . 11190 1 113 . PRO . 11190 1 114 . LEU . 11190 1 115 . GLU . 11190 1 116 . PRO . 11190 1 117 . PRO . 11190 1 118 . SER . 11190 1 119 . ASP . 11190 1 120 . ARG . 11190 1 121 . GLY . 11190 1 122 . THR . 11190 1 123 . VAL . 11190 1 124 . SER . 11190 1 125 . GLY . 11190 1 126 . PRO . 11190 1 127 . SER . 11190 1 128 . SER . 11190 1 129 . GLY . 11190 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11190 1 . SER 2 2 11190 1 . SER 3 3 11190 1 . GLY 4 4 11190 1 . SER 5 5 11190 1 . SER 6 6 11190 1 . GLY 7 7 11190 1 . GLY 8 8 11190 1 . SER 9 9 11190 1 . ASP 10 10 11190 1 . SER 11 11 11190 1 . SER 12 12 11190 1 . LEU 13 13 11190 1 . PHE 14 14 11190 1 . GLU 15 15 11190 1 . THR 16 16 11190 1 . TYR 17 17 11190 1 . ASN 18 18 11190 1 . VAL 19 19 11190 1 . GLU 20 20 11190 1 . LEU 21 21 11190 1 . VAL 22 22 11190 1 . ARG 23 23 11190 1 . LYS 24 24 11190 1 . ASP 25 25 11190 1 . GLY 26 26 11190 1 . GLN 27 27 11190 1 . SER 28 28 11190 1 . LEU 29 29 11190 1 . GLY 30 30 11190 1 . ILE 31 31 11190 1 . ARG 32 32 11190 1 . ILE 33 33 11190 1 . VAL 34 34 11190 1 . GLY 35 35 11190 1 . TYR 36 36 11190 1 . VAL 37 37 11190 1 . GLY 38 38 11190 1 . THR 39 39 11190 1 . SER 40 40 11190 1 . HIS 41 41 11190 1 . THR 42 42 11190 1 . GLY 43 43 11190 1 . GLU 44 44 11190 1 . ALA 45 45 11190 1 . SER 46 46 11190 1 . GLY 47 47 11190 1 . ILE 48 48 11190 1 . TYR 49 49 11190 1 . VAL 50 50 11190 1 . LYS 51 51 11190 1 . SER 52 52 11190 1 . VAL 53 53 11190 1 . ILE 54 54 11190 1 . PRO 55 55 11190 1 . GLY 56 56 11190 1 . SER 57 57 11190 1 . ALA 58 58 11190 1 . ALA 59 59 11190 1 . TYR 60 60 11190 1 . HIS 61 61 11190 1 . ASN 62 62 11190 1 . GLY 63 63 11190 1 . HIS 64 64 11190 1 . ILE 65 65 11190 1 . GLN 66 66 11190 1 . VAL 67 67 11190 1 . ASN 68 68 11190 1 . ASP 69 69 11190 1 . LYS 70 70 11190 1 . ILE 71 71 11190 1 . VAL 72 72 11190 1 . ALA 73 73 11190 1 . VAL 74 74 11190 1 . ASP 75 75 11190 1 . GLY 76 76 11190 1 . VAL 77 77 11190 1 . ASN 78 78 11190 1 . ILE 79 79 11190 1 . GLN 80 80 11190 1 . GLY 81 81 11190 1 . PHE 82 82 11190 1 . ALA 83 83 11190 1 . ASN 84 84 11190 1 . HIS 85 85 11190 1 . ASP 86 86 11190 1 . VAL 87 87 11190 1 . VAL 88 88 11190 1 . GLU 89 89 11190 1 . VAL 90 90 11190 1 . LEU 91 91 11190 1 . ARG 92 92 11190 1 . ASN 93 93 11190 1 . ALA 94 94 11190 1 . GLY 95 95 11190 1 . GLN 96 96 11190 1 . VAL 97 97 11190 1 . VAL 98 98 11190 1 . HIS 99 99 11190 1 . LEU 100 100 11190 1 . THR 101 101 11190 1 . LEU 102 102 11190 1 . VAL 103 103 11190 1 . ARG 104 104 11190 1 . ARG 105 105 11190 1 . LYS 106 106 11190 1 . THR 107 107 11190 1 . SER 108 108 11190 1 . SER 109 109 11190 1 . SER 110 110 11190 1 . THR 111 111 11190 1 . SER 112 112 11190 1 . PRO 113 113 11190 1 . LEU 114 114 11190 1 . GLU 115 115 11190 1 . PRO 116 116 11190 1 . PRO 117 117 11190 1 . SER 118 118 11190 1 . ASP 119 119 11190 1 . ARG 120 120 11190 1 . GLY 121 121 11190 1 . THR 122 122 11190 1 . VAL 123 123 11190 1 . SER 124 124 11190 1 . GLY 125 125 11190 1 . PRO 126 126 11190 1 . SER 127 127 11190 1 . SER 128 128 11190 1 . GLY 129 129 11190 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 11190 _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 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11190 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 11190 _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 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P050627-17 . . . . . . 11190 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11190 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.26mM U-15N,13C-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 90% H2O, 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.26 . . mM . . . . 11190 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11190 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11190 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11190 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11190 1 6 H2O . . . . . . solvent 90 . . % . . . . 11190 1 7 D2O . . . . . . solvent 10 . . % . . . . 11190 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11190 _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' 120 0.1 mM 11190 1 pH 7.0 0.05 pH 11190 1 pressure 1 0.001 atm 11190 1 temperature 293 0.1 K 11190 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 11190 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 11190 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11190 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11190 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11190 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11190 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11190 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11190 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11190 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11190 _Software.ID 4 _Software.Name Kujira _Software.Version 0.93191 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11190 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11190 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11190 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11190 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11190 5 'structure solution' 11190 5 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 11190 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 11190 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 11190 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 800 . . . 11190 1 2 spectrometer_2 Varian INOVA . 900 . . . 11190 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 11190 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11190 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11190 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11190 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect 0.251449530 . . . . . . . . . 11190 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11190 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11190 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11190 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11190 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11190 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $VNMR . . 11190 1 2 $NMRPipe . . 11190 1 3 $NMRView . . 11190 1 4 $Kujira . . 11190 1 5 $CYANA . . 11190 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 6 6 SER H H 1 9.009 0.030 . 1 . . . . 6 SER H . 11190 1 2 . 1 1 6 6 SER HA H 1 4.510 0.030 . 1 . . . . 6 SER HA . 11190 1 3 . 1 1 6 6 SER HB2 H 1 3.846 0.030 . 2 . . . . 6 SER HB2 . 11190 1 4 . 1 1 6 6 SER HB3 H 1 3.906 0.030 . 2 . . . . 6 SER HB3 . 11190 1 5 . 1 1 6 6 SER C C 13 175.067 0.300 . 1 . . . . 6 SER C . 11190 1 6 . 1 1 6 6 SER CA C 13 58.354 0.300 . 1 . . . . 6 SER CA . 11190 1 7 . 1 1 6 6 SER CB C 13 63.844 0.300 . 1 . . . . 6 SER CB . 11190 1 8 . 1 1 7 7 GLY H H 1 8.471 0.030 . 1 . . . . 7 GLY H . 11190 1 9 . 1 1 7 7 GLY HA2 H 1 4.000 0.030 . 1 . . . . 7 GLY HA2 . 11190 1 10 . 1 1 7 7 GLY HA3 H 1 4.000 0.030 . 1 . . . . 7 GLY HA3 . 11190 1 11 . 1 1 7 7 GLY C C 13 174.699 0.300 . 1 . . . . 7 GLY C . 11190 1 12 . 1 1 7 7 GLY CA C 13 45.343 0.300 . 1 . . . . 7 GLY CA . 11190 1 13 . 1 1 7 7 GLY N N 15 110.851 0.300 . 1 . . . . 7 GLY N . 11190 1 14 . 1 1 8 8 GLY H H 1 8.308 0.030 . 1 . . . . 8 GLY H . 11190 1 15 . 1 1 8 8 GLY HA2 H 1 4.023 0.030 . 1 . . . . 8 GLY HA2 . 11190 1 16 . 1 1 8 8 GLY HA3 H 1 4.023 0.030 . 1 . . . . 8 GLY HA3 . 11190 1 17 . 1 1 8 8 GLY C C 13 174.427 0.300 . 1 . . . . 8 GLY C . 11190 1 18 . 1 1 8 8 GLY CA C 13 45.228 0.300 . 1 . . . . 8 GLY CA . 11190 1 19 . 1 1 8 8 GLY N N 15 108.802 0.300 . 1 . . . . 8 GLY N . 11190 1 20 . 1 1 9 9 SER H H 1 8.365 0.030 . 1 . . . . 9 SER H . 11190 1 21 . 1 1 9 9 SER HA H 1 4.500 0.030 . 1 . . . . 9 SER HA . 11190 1 22 . 1 1 9 9 SER HB2 H 1 3.883 0.030 . 1 . . . . 9 SER HB2 . 11190 1 23 . 1 1 9 9 SER HB3 H 1 3.883 0.030 . 1 . . . . 9 SER HB3 . 11190 1 24 . 1 1 9 9 SER C C 13 174.488 0.300 . 1 . . . . 9 SER C . 11190 1 25 . 1 1 9 9 SER CA C 13 58.359 0.300 . 1 . . . . 9 SER CA . 11190 1 26 . 1 1 9 9 SER CB C 13 63.953 0.300 . 1 . . . . 9 SER CB . 11190 1 27 . 1 1 10 10 ASP H H 1 8.480 0.030 . 1 . . . . 10 ASP H . 11190 1 28 . 1 1 10 10 ASP HA H 1 4.672 0.030 . 1 . . . . 10 ASP HA . 11190 1 29 . 1 1 10 10 ASP HB2 H 1 2.731 0.030 . 2 . . . . 10 ASP HB2 . 11190 1 30 . 1 1 10 10 ASP HB3 H 1 2.787 0.030 . 2 . . . . 10 ASP HB3 . 11190 1 31 . 1 1 10 10 ASP C C 13 176.682 0.300 . 1 . . . . 10 ASP C . 11190 1 32 . 1 1 10 10 ASP CA C 13 54.522 0.300 . 1 . . . . 10 ASP CA . 11190 1 33 . 1 1 10 10 ASP CB C 13 41.181 0.300 . 1 . . . . 10 ASP CB . 11190 1 34 . 1 1 10 10 ASP N N 15 122.713 0.300 . 1 . . . . 10 ASP N . 11190 1 35 . 1 1 11 11 SER H H 1 8.382 0.030 . 1 . . . . 11 SER H . 11190 1 36 . 1 1 11 11 SER HA H 1 4.471 0.030 . 1 . . . . 11 SER HA . 11190 1 37 . 1 1 11 11 SER HB2 H 1 3.915 0.030 . 2 . . . . 11 SER HB2 . 11190 1 38 . 1 1 11 11 SER HB3 H 1 3.991 0.030 . 2 . . . . 11 SER HB3 . 11190 1 39 . 1 1 11 11 SER C C 13 175.059 0.300 . 1 . . . . 11 SER C . 11190 1 40 . 1 1 11 11 SER CA C 13 59.155 0.300 . 1 . . . . 11 SER CA . 11190 1 41 . 1 1 11 11 SER CB C 13 63.624 0.300 . 1 . . . . 11 SER CB . 11190 1 42 . 1 1 11 11 SER N N 15 117.087 0.300 . 1 . . . . 11 SER N . 11190 1 43 . 1 1 12 12 SER H H 1 8.423 0.030 . 1 . . . . 12 SER H . 11190 1 44 . 1 1 12 12 SER HA H 1 4.466 0.030 . 1 . . . . 12 SER HA . 11190 1 45 . 1 1 12 12 SER HB2 H 1 3.879 0.030 . 2 . . . . 12 SER HB2 . 11190 1 46 . 1 1 12 12 SER HB3 H 1 3.944 0.030 . 2 . . . . 12 SER HB3 . 11190 1 47 . 1 1 12 12 SER C C 13 174.541 0.300 . 1 . . . . 12 SER C . 11190 1 48 . 1 1 12 12 SER CA C 13 59.230 0.300 . 1 . . . . 12 SER CA . 11190 1 49 . 1 1 12 12 SER CB C 13 63.624 0.300 . 1 . . . . 12 SER CB . 11190 1 50 . 1 1 12 12 SER N N 15 117.535 0.300 . 1 . . . . 12 SER N . 11190 1 51 . 1 1 13 13 LEU H H 1 8.109 0.030 . 1 . . . . 13 LEU H . 11190 1 52 . 1 1 13 13 LEU HA H 1 4.308 0.030 . 1 . . . . 13 LEU HA . 11190 1 53 . 1 1 13 13 LEU HB2 H 1 1.257 0.030 . 2 . . . . 13 LEU HB2 . 11190 1 54 . 1 1 13 13 LEU HB3 H 1 1.507 0.030 . 2 . . . . 13 LEU HB3 . 11190 1 55 . 1 1 13 13 LEU HD11 H 1 0.879 0.030 . 1 . . . . 13 LEU HD1 . 11190 1 56 . 1 1 13 13 LEU HD12 H 1 0.879 0.030 . 1 . . . . 13 LEU HD1 . 11190 1 57 . 1 1 13 13 LEU HD13 H 1 0.879 0.030 . 1 . . . . 13 LEU HD1 . 11190 1 58 . 1 1 13 13 LEU HD21 H 1 0.774 0.030 . 1 . . . . 13 LEU HD2 . 11190 1 59 . 1 1 13 13 LEU HD22 H 1 0.774 0.030 . 1 . . . . 13 LEU HD2 . 11190 1 60 . 1 1 13 13 LEU HD23 H 1 0.774 0.030 . 1 . . . . 13 LEU HD2 . 11190 1 61 . 1 1 13 13 LEU HG H 1 1.535 0.030 . 1 . . . . 13 LEU HG . 11190 1 62 . 1 1 13 13 LEU C C 13 175.927 0.300 . 1 . . . . 13 LEU C . 11190 1 63 . 1 1 13 13 LEU CA C 13 55.214 0.300 . 1 . . . . 13 LEU CA . 11190 1 64 . 1 1 13 13 LEU CB C 13 42.886 0.300 . 1 . . . . 13 LEU CB . 11190 1 65 . 1 1 13 13 LEU CD1 C 13 25.126 0.300 . 2 . . . . 13 LEU CD1 . 11190 1 66 . 1 1 13 13 LEU CD2 C 13 22.880 0.300 . 2 . . . . 13 LEU CD2 . 11190 1 67 . 1 1 13 13 LEU CG C 13 26.839 0.300 . 1 . . . . 13 LEU CG . 11190 1 68 . 1 1 13 13 LEU N N 15 122.086 0.300 . 1 . . . . 13 LEU N . 11190 1 69 . 1 1 14 14 PHE H H 1 8.000 0.030 . 1 . . . . 14 PHE H . 11190 1 70 . 1 1 14 14 PHE HA H 1 5.238 0.030 . 1 . . . . 14 PHE HA . 11190 1 71 . 1 1 14 14 PHE HB2 H 1 2.777 0.030 . 2 . . . . 14 PHE HB2 . 11190 1 72 . 1 1 14 14 PHE HB3 H 1 2.958 0.030 . 2 . . . . 14 PHE HB3 . 11190 1 73 . 1 1 14 14 PHE HD1 H 1 7.126 0.030 . 1 . . . . 14 PHE HD1 . 11190 1 74 . 1 1 14 14 PHE HD2 H 1 7.126 0.030 . 1 . . . . 14 PHE HD2 . 11190 1 75 . 1 1 14 14 PHE HE1 H 1 7.365 0.030 . 1 . . . . 14 PHE HE1 . 11190 1 76 . 1 1 14 14 PHE HE2 H 1 7.365 0.030 . 1 . . . . 14 PHE HE2 . 11190 1 77 . 1 1 14 14 PHE HZ H 1 7.318 0.030 . 1 . . . . 14 PHE HZ . 11190 1 78 . 1 1 14 14 PHE C C 13 174.699 0.300 . 1 . . . . 14 PHE C . 11190 1 79 . 1 1 14 14 PHE CA C 13 56.807 0.300 . 1 . . . . 14 PHE CA . 11190 1 80 . 1 1 14 14 PHE CB C 13 42.395 0.300 . 1 . . . . 14 PHE CB . 11190 1 81 . 1 1 14 14 PHE CD1 C 13 132.037 0.300 . 1 . . . . 14 PHE CD1 . 11190 1 82 . 1 1 14 14 PHE CD2 C 13 132.037 0.300 . 1 . . . . 14 PHE CD2 . 11190 1 83 . 1 1 14 14 PHE CE1 C 13 131.364 0.300 . 1 . . . . 14 PHE CE1 . 11190 1 84 . 1 1 14 14 PHE CE2 C 13 131.364 0.300 . 1 . . . . 14 PHE CE2 . 11190 1 85 . 1 1 14 14 PHE CZ C 13 129.548 0.300 . 1 . . . . 14 PHE CZ . 11190 1 86 . 1 1 14 14 PHE N N 15 117.448 0.300 . 1 . . . . 14 PHE N . 11190 1 87 . 1 1 15 15 GLU H H 1 9.280 0.030 . 1 . . . . 15 GLU H . 11190 1 88 . 1 1 15 15 GLU HA H 1 4.741 0.030 . 1 . . . . 15 GLU HA . 11190 1 89 . 1 1 15 15 GLU HB2 H 1 1.940 0.030 . 1 . . . . 15 GLU HB2 . 11190 1 90 . 1 1 15 15 GLU HB3 H 1 1.940 0.030 . 1 . . . . 15 GLU HB3 . 11190 1 91 . 1 1 15 15 GLU HG2 H 1 2.149 0.030 . 1 . . . . 15 GLU HG2 . 11190 1 92 . 1 1 15 15 GLU HG3 H 1 2.149 0.030 . 1 . . . . 15 GLU HG3 . 11190 1 93 . 1 1 15 15 GLU C C 13 174.558 0.300 . 1 . . . . 15 GLU C . 11190 1 94 . 1 1 15 15 GLU CA C 13 54.707 0.300 . 1 . . . . 15 GLU CA . 11190 1 95 . 1 1 15 15 GLU CB C 13 33.603 0.300 . 1 . . . . 15 GLU CB . 11190 1 96 . 1 1 15 15 GLU CG C 13 36.093 0.300 . 1 . . . . 15 GLU CG . 11190 1 97 . 1 1 15 15 GLU N N 15 121.348 0.300 . 1 . . . . 15 GLU N . 11190 1 98 . 1 1 16 16 THR H H 1 8.528 0.030 . 1 . . . . 16 THR H . 11190 1 99 . 1 1 16 16 THR HA H 1 5.294 0.030 . 1 . . . . 16 THR HA . 11190 1 100 . 1 1 16 16 THR HB H 1 3.856 0.030 . 1 . . . . 16 THR HB . 11190 1 101 . 1 1 16 16 THR HG21 H 1 1.026 0.030 . 1 . . . . 16 THR HG2 . 11190 1 102 . 1 1 16 16 THR HG22 H 1 1.026 0.030 . 1 . . . . 16 THR HG2 . 11190 1 103 . 1 1 16 16 THR HG23 H 1 1.026 0.030 . 1 . . . . 16 THR HG2 . 11190 1 104 . 1 1 16 16 THR C C 13 174.032 0.300 . 1 . . . . 16 THR C . 11190 1 105 . 1 1 16 16 THR CA C 13 61.749 0.300 . 1 . . . . 16 THR CA . 11190 1 106 . 1 1 16 16 THR CB C 13 69.984 0.300 . 1 . . . . 16 THR CB . 11190 1 107 . 1 1 16 16 THR CG2 C 13 21.483 0.300 . 1 . . . . 16 THR CG2 . 11190 1 108 . 1 1 16 16 THR N N 15 120.089 0.300 . 1 . . . . 16 THR N . 11190 1 109 . 1 1 17 17 TYR H H 1 9.586 0.030 . 1 . . . . 17 TYR H . 11190 1 110 . 1 1 17 17 TYR HA H 1 4.822 0.030 . 1 . . . . 17 TYR HA . 11190 1 111 . 1 1 17 17 TYR HB2 H 1 2.752 0.030 . 2 . . . . 17 TYR HB2 . 11190 1 112 . 1 1 17 17 TYR HB3 H 1 2.887 0.030 . 2 . . . . 17 TYR HB3 . 11190 1 113 . 1 1 17 17 TYR HD1 H 1 6.866 0.030 . 1 . . . . 17 TYR HD1 . 11190 1 114 . 1 1 17 17 TYR HD2 H 1 6.866 0.030 . 1 . . . . 17 TYR HD2 . 11190 1 115 . 1 1 17 17 TYR HE1 H 1 6.529 0.030 . 1 . . . . 17 TYR HE1 . 11190 1 116 . 1 1 17 17 TYR HE2 H 1 6.529 0.030 . 1 . . . . 17 TYR HE2 . 11190 1 117 . 1 1 17 17 TYR C C 13 172.610 0.300 . 1 . . . . 17 TYR C . 11190 1 118 . 1 1 17 17 TYR CA C 13 56.850 0.300 . 1 . . . . 17 TYR CA . 11190 1 119 . 1 1 17 17 TYR CB C 13 41.655 0.300 . 1 . . . . 17 TYR CB . 11190 1 120 . 1 1 17 17 TYR CD1 C 13 132.752 0.300 . 1 . . . . 17 TYR CD1 . 11190 1 121 . 1 1 17 17 TYR CD2 C 13 132.752 0.300 . 1 . . . . 17 TYR CD2 . 11190 1 122 . 1 1 17 17 TYR CE1 C 13 118.435 0.300 . 1 . . . . 17 TYR CE1 . 11190 1 123 . 1 1 17 17 TYR CE2 C 13 118.435 0.300 . 1 . . . . 17 TYR CE2 . 11190 1 124 . 1 1 17 17 TYR N N 15 125.533 0.300 . 1 . . . . 17 TYR N . 11190 1 125 . 1 1 18 18 ASN H H 1 8.743 0.030 . 1 . . . . 18 ASN H . 11190 1 126 . 1 1 18 18 ASN HA H 1 5.650 0.030 . 1 . . . . 18 ASN HA . 11190 1 127 . 1 1 18 18 ASN HB2 H 1 2.638 0.030 . 1 . . . . 18 ASN HB2 . 11190 1 128 . 1 1 18 18 ASN HB3 H 1 2.638 0.030 . 1 . . . . 18 ASN HB3 . 11190 1 129 . 1 1 18 18 ASN HD21 H 1 6.955 0.030 . 2 . . . . 18 ASN HD21 . 11190 1 130 . 1 1 18 18 ASN HD22 H 1 7.586 0.030 . 2 . . . . 18 ASN HD22 . 11190 1 131 . 1 1 18 18 ASN C C 13 174.769 0.300 . 1 . . . . 18 ASN C . 11190 1 132 . 1 1 18 18 ASN CA C 13 52.170 0.300 . 1 . . . . 18 ASN CA . 11190 1 133 . 1 1 18 18 ASN CB C 13 41.419 0.300 . 1 . . . . 18 ASN CB . 11190 1 134 . 1 1 18 18 ASN N N 15 120.145 0.300 . 1 . . . . 18 ASN N . 11190 1 135 . 1 1 18 18 ASN ND2 N 15 114.603 0.300 . 1 . . . . 18 ASN ND2 . 11190 1 136 . 1 1 19 19 VAL H H 1 9.006 0.030 . 1 . . . . 19 VAL H . 11190 1 137 . 1 1 19 19 VAL HA H 1 4.434 0.030 . 1 . . . . 19 VAL HA . 11190 1 138 . 1 1 19 19 VAL HB H 1 1.876 0.030 . 1 . . . . 19 VAL HB . 11190 1 139 . 1 1 19 19 VAL HG11 H 1 0.921 0.030 . 1 . . . . 19 VAL HG1 . 11190 1 140 . 1 1 19 19 VAL HG12 H 1 0.921 0.030 . 1 . . . . 19 VAL HG1 . 11190 1 141 . 1 1 19 19 VAL HG13 H 1 0.921 0.030 . 1 . . . . 19 VAL HG1 . 11190 1 142 . 1 1 19 19 VAL HG21 H 1 0.868 0.030 . 1 . . . . 19 VAL HG2 . 11190 1 143 . 1 1 19 19 VAL HG22 H 1 0.868 0.030 . 1 . . . . 19 VAL HG2 . 11190 1 144 . 1 1 19 19 VAL HG23 H 1 0.868 0.030 . 1 . . . . 19 VAL HG2 . 11190 1 145 . 1 1 19 19 VAL C C 13 173.505 0.300 . 1 . . . . 19 VAL C . 11190 1 146 . 1 1 19 19 VAL CA C 13 60.485 0.300 . 1 . . . . 19 VAL CA . 11190 1 147 . 1 1 19 19 VAL CB C 13 36.004 0.300 . 1 . . . . 19 VAL CB . 11190 1 148 . 1 1 19 19 VAL CG1 C 13 21.669 0.300 . 2 . . . . 19 VAL CG1 . 11190 1 149 . 1 1 19 19 VAL CG2 C 13 21.310 0.300 . 2 . . . . 19 VAL CG2 . 11190 1 150 . 1 1 19 19 VAL N N 15 119.822 0.300 . 1 . . . . 19 VAL N . 11190 1 151 . 1 1 20 20 GLU H H 1 8.574 0.030 . 1 . . . . 20 GLU H . 11190 1 152 . 1 1 20 20 GLU HA H 1 4.660 0.030 . 1 . . . . 20 GLU HA . 11190 1 153 . 1 1 20 20 GLU HB2 H 1 1.779 0.030 . 2 . . . . 20 GLU HB2 . 11190 1 154 . 1 1 20 20 GLU HB3 H 1 1.903 0.030 . 2 . . . . 20 GLU HB3 . 11190 1 155 . 1 1 20 20 GLU HG2 H 1 1.700 0.030 . 2 . . . . 20 GLU HG2 . 11190 1 156 . 1 1 20 20 GLU HG3 H 1 1.630 0.030 . 2 . . . . 20 GLU HG3 . 11190 1 157 . 1 1 20 20 GLU C C 13 174.242 0.300 . 1 . . . . 20 GLU C . 11190 1 158 . 1 1 20 20 GLU CA C 13 54.904 0.300 . 1 . . . . 20 GLU CA . 11190 1 159 . 1 1 20 20 GLU CB C 13 31.490 0.300 . 1 . . . . 20 GLU CB . 11190 1 160 . 1 1 20 20 GLU CG C 13 37.039 0.300 . 1 . . . . 20 GLU CG . 11190 1 161 . 1 1 20 20 GLU N N 15 127.432 0.300 . 1 . . . . 20 GLU N . 11190 1 162 . 1 1 21 21 LEU H H 1 9.184 0.030 . 1 . . . . 21 LEU H . 11190 1 163 . 1 1 21 21 LEU HA H 1 4.723 0.030 . 1 . . . . 21 LEU HA . 11190 1 164 . 1 1 21 21 LEU HB2 H 1 1.564 0.030 . 2 . . . . 21 LEU HB2 . 11190 1 165 . 1 1 21 21 LEU HB3 H 1 1.300 0.030 . 2 . . . . 21 LEU HB3 . 11190 1 166 . 1 1 21 21 LEU HD11 H 1 0.744 0.030 . 1 . . . . 21 LEU HD1 . 11190 1 167 . 1 1 21 21 LEU HD12 H 1 0.744 0.030 . 1 . . . . 21 LEU HD1 . 11190 1 168 . 1 1 21 21 LEU HD13 H 1 0.744 0.030 . 1 . . . . 21 LEU HD1 . 11190 1 169 . 1 1 21 21 LEU HD21 H 1 0.766 0.030 . 1 . . . . 21 LEU HD2 . 11190 1 170 . 1 1 21 21 LEU HD22 H 1 0.766 0.030 . 1 . . . . 21 LEU HD2 . 11190 1 171 . 1 1 21 21 LEU HD23 H 1 0.766 0.030 . 1 . . . . 21 LEU HD2 . 11190 1 172 . 1 1 21 21 LEU HG H 1 1.485 0.030 . 1 . . . . 21 LEU HG . 11190 1 173 . 1 1 21 21 LEU C C 13 174.453 0.300 . 1 . . . . 21 LEU C . 11190 1 174 . 1 1 21 21 LEU CA C 13 53.249 0.300 . 1 . . . . 21 LEU CA . 11190 1 175 . 1 1 21 21 LEU CB C 13 43.763 0.300 . 1 . . . . 21 LEU CB . 11190 1 176 . 1 1 21 21 LEU CD1 C 13 26.161 0.300 . 2 . . . . 21 LEU CD1 . 11190 1 177 . 1 1 21 21 LEU CD2 C 13 25.072 0.300 . 2 . . . . 21 LEU CD2 . 11190 1 178 . 1 1 21 21 LEU CG C 13 26.972 0.300 . 1 . . . . 21 LEU CG . 11190 1 179 . 1 1 21 21 LEU N N 15 127.262 0.300 . 1 . . . . 21 LEU N . 11190 1 180 . 1 1 22 22 VAL H H 1 8.572 0.030 . 1 . . . . 22 VAL H . 11190 1 181 . 1 1 22 22 VAL HA H 1 4.659 0.030 . 1 . . . . 22 VAL HA . 11190 1 182 . 1 1 22 22 VAL HB H 1 1.976 0.030 . 1 . . . . 22 VAL HB . 11190 1 183 . 1 1 22 22 VAL HG11 H 1 0.857 0.030 . 1 . . . . 22 VAL HG1 . 11190 1 184 . 1 1 22 22 VAL HG12 H 1 0.857 0.030 . 1 . . . . 22 VAL HG1 . 11190 1 185 . 1 1 22 22 VAL HG13 H 1 0.857 0.030 . 1 . . . . 22 VAL HG1 . 11190 1 186 . 1 1 22 22 VAL HG21 H 1 0.921 0.030 . 1 . . . . 22 VAL HG2 . 11190 1 187 . 1 1 22 22 VAL HG22 H 1 0.921 0.030 . 1 . . . . 22 VAL HG2 . 11190 1 188 . 1 1 22 22 VAL HG23 H 1 0.921 0.030 . 1 . . . . 22 VAL HG2 . 11190 1 189 . 1 1 22 22 VAL C C 13 175.664 0.300 . 1 . . . . 22 VAL C . 11190 1 190 . 1 1 22 22 VAL CA C 13 61.168 0.300 . 1 . . . . 22 VAL CA . 11190 1 191 . 1 1 22 22 VAL CB C 13 33.135 0.300 . 1 . . . . 22 VAL CB . 11190 1 192 . 1 1 22 22 VAL CG1 C 13 20.978 0.300 . 2 . . . . 22 VAL CG1 . 11190 1 193 . 1 1 22 22 VAL CG2 C 13 21.060 0.300 . 2 . . . . 22 VAL CG2 . 11190 1 194 . 1 1 22 22 VAL N N 15 124.085 0.300 . 1 . . . . 22 VAL N . 11190 1 195 . 1 1 23 23 ARG H H 1 9.101 0.030 . 1 . . . . 23 ARG H . 11190 1 196 . 1 1 23 23 ARG HA H 1 4.458 0.030 . 1 . . . . 23 ARG HA . 11190 1 197 . 1 1 23 23 ARG HB2 H 1 1.750 0.030 . 2 . . . . 23 ARG HB2 . 11190 1 198 . 1 1 23 23 ARG HB3 H 1 1.942 0.030 . 2 . . . . 23 ARG HB3 . 11190 1 199 . 1 1 23 23 ARG HD2 H 1 3.159 0.030 . 2 . . . . 23 ARG HD2 . 11190 1 200 . 1 1 23 23 ARG HD3 H 1 3.210 0.030 . 2 . . . . 23 ARG HD3 . 11190 1 201 . 1 1 23 23 ARG HE H 1 6.942 0.030 . 1 . . . . 23 ARG HE . 11190 1 202 . 1 1 23 23 ARG HG2 H 1 1.431 0.030 . 2 . . . . 23 ARG HG2 . 11190 1 203 . 1 1 23 23 ARG HG3 H 1 1.576 0.030 . 2 . . . . 23 ARG HG3 . 11190 1 204 . 1 1 23 23 ARG C C 13 176.243 0.300 . 1 . . . . 23 ARG C . 11190 1 205 . 1 1 23 23 ARG CA C 13 55.345 0.300 . 1 . . . . 23 ARG CA . 11190 1 206 . 1 1 23 23 ARG CB C 13 32.033 0.300 . 1 . . . . 23 ARG CB . 11190 1 207 . 1 1 23 23 ARG CD C 13 44.310 0.300 . 1 . . . . 23 ARG CD . 11190 1 208 . 1 1 23 23 ARG CG C 13 27.120 0.300 . 1 . . . . 23 ARG CG . 11190 1 209 . 1 1 23 23 ARG N N 15 126.372 0.300 . 1 . . . . 23 ARG N . 11190 1 210 . 1 1 23 23 ARG NE N 15 83.162 0.300 . 1 . . . . 23 ARG NE . 11190 1 211 . 1 1 24 24 LYS H H 1 8.352 0.030 . 1 . . . . 24 LYS H . 11190 1 212 . 1 1 24 24 LYS HA H 1 4.391 0.030 . 1 . . . . 24 LYS HA . 11190 1 213 . 1 1 24 24 LYS HB2 H 1 1.535 0.030 . 2 . . . . 24 LYS HB2 . 11190 1 214 . 1 1 24 24 LYS HB3 H 1 1.832 0.030 . 2 . . . . 24 LYS HB3 . 11190 1 215 . 1 1 24 24 LYS HD2 H 1 1.634 0.030 . 1 . . . . 24 LYS HD2 . 11190 1 216 . 1 1 24 24 LYS HD3 H 1 1.634 0.030 . 1 . . . . 24 LYS HD3 . 11190 1 217 . 1 1 24 24 LYS HE2 H 1 2.957 0.030 . 1 . . . . 24 LYS HE2 . 11190 1 218 . 1 1 24 24 LYS HE3 H 1 2.957 0.030 . 1 . . . . 24 LYS HE3 . 11190 1 219 . 1 1 24 24 LYS HG2 H 1 1.404 0.030 . 2 . . . . 24 LYS HG2 . 11190 1 220 . 1 1 24 24 LYS HG3 H 1 1.471 0.030 . 2 . . . . 24 LYS HG3 . 11190 1 221 . 1 1 24 24 LYS C C 13 176.524 0.300 . 1 . . . . 24 LYS C . 11190 1 222 . 1 1 24 24 LYS CA C 13 55.340 0.300 . 1 . . . . 24 LYS CA . 11190 1 223 . 1 1 24 24 LYS CB C 13 33.454 0.300 . 1 . . . . 24 LYS CB . 11190 1 224 . 1 1 24 24 LYS CD C 13 28.929 0.300 . 1 . . . . 24 LYS CD . 11190 1 225 . 1 1 24 24 LYS CE C 13 42.236 0.300 . 1 . . . . 24 LYS CE . 11190 1 226 . 1 1 24 24 LYS CG C 13 25.098 0.300 . 1 . . . . 24 LYS CG . 11190 1 227 . 1 1 24 24 LYS N N 15 123.288 0.300 . 1 . . . . 24 LYS N . 11190 1 228 . 1 1 25 25 ASP H H 1 8.659 0.030 . 1 . . . . 25 ASP H . 11190 1 229 . 1 1 25 25 ASP HA H 1 4.335 0.030 . 1 . . . . 25 ASP HA . 11190 1 230 . 1 1 25 25 ASP HB2 H 1 2.598 0.030 . 2 . . . . 25 ASP HB2 . 11190 1 231 . 1 1 25 25 ASP HB3 H 1 2.669 0.030 . 2 . . . . 25 ASP HB3 . 11190 1 232 . 1 1 25 25 ASP C C 13 177.384 0.300 . 1 . . . . 25 ASP C . 11190 1 233 . 1 1 25 25 ASP CA C 13 56.165 0.300 . 1 . . . . 25 ASP CA . 11190 1 234 . 1 1 25 25 ASP CB C 13 40.360 0.300 . 1 . . . . 25 ASP CB . 11190 1 235 . 1 1 25 25 ASP N N 15 121.714 0.300 . 1 . . . . 25 ASP N . 11190 1 236 . 1 1 26 26 GLY H H 1 8.772 0.030 . 1 . . . . 26 GLY H . 11190 1 237 . 1 1 26 26 GLY HA2 H 1 3.739 0.030 . 2 . . . . 26 GLY HA2 . 11190 1 238 . 1 1 26 26 GLY HA3 H 1 4.097 0.030 . 2 . . . . 26 GLY HA3 . 11190 1 239 . 1 1 26 26 GLY C C 13 173.997 0.300 . 1 . . . . 26 GLY C . 11190 1 240 . 1 1 26 26 GLY CA C 13 45.652 0.300 . 1 . . . . 26 GLY CA . 11190 1 241 . 1 1 26 26 GLY N N 15 111.698 0.300 . 1 . . . . 26 GLY N . 11190 1 242 . 1 1 27 27 GLN H H 1 8.040 0.030 . 1 . . . . 27 GLN H . 11190 1 243 . 1 1 27 27 GLN HA H 1 4.494 0.030 . 1 . . . . 27 GLN HA . 11190 1 244 . 1 1 27 27 GLN HB2 H 1 2.328 0.030 . 2 . . . . 27 GLN HB2 . 11190 1 245 . 1 1 27 27 GLN HB3 H 1 1.941 0.030 . 2 . . . . 27 GLN HB3 . 11190 1 246 . 1 1 27 27 GLN HE21 H 1 6.894 0.030 . 2 . . . . 27 GLN HE21 . 11190 1 247 . 1 1 27 27 GLN HE22 H 1 7.481 0.030 . 2 . . . . 27 GLN HE22 . 11190 1 248 . 1 1 27 27 GLN HG2 H 1 2.588 0.030 . 2 . . . . 27 GLN HG2 . 11190 1 249 . 1 1 27 27 GLN HG3 H 1 2.669 0.030 . 2 . . . . 27 GLN HG3 . 11190 1 250 . 1 1 27 27 GLN C C 13 175.962 0.300 . 1 . . . . 27 GLN C . 11190 1 251 . 1 1 27 27 GLN CA C 13 55.036 0.300 . 1 . . . . 27 GLN CA . 11190 1 252 . 1 1 27 27 GLN CB C 13 31.077 0.300 . 1 . . . . 27 GLN CB . 11190 1 253 . 1 1 27 27 GLN CG C 13 34.112 0.300 . 1 . . . . 27 GLN CG . 11190 1 254 . 1 1 27 27 GLN N N 15 120.994 0.300 . 1 . . . . 27 GLN N . 11190 1 255 . 1 1 27 27 GLN NE2 N 15 111.589 0.300 . 1 . . . . 27 GLN NE2 . 11190 1 256 . 1 1 28 28 SER H H 1 8.847 0.030 . 1 . . . . 28 SER H . 11190 1 257 . 1 1 28 28 SER HA H 1 4.481 0.030 . 1 . . . . 28 SER HA . 11190 1 258 . 1 1 28 28 SER HB2 H 1 3.909 0.030 . 2 . . . . 28 SER HB2 . 11190 1 259 . 1 1 28 28 SER HB3 H 1 4.013 0.030 . 2 . . . . 28 SER HB3 . 11190 1 260 . 1 1 28 28 SER C C 13 174.962 0.300 . 1 . . . . 28 SER C . 11190 1 261 . 1 1 28 28 SER CA C 13 58.046 0.300 . 1 . . . . 28 SER CA . 11190 1 262 . 1 1 28 28 SER CB C 13 64.147 0.300 . 1 . . . . 28 SER CB . 11190 1 263 . 1 1 28 28 SER N N 15 120.968 0.300 . 1 . . . . 28 SER N . 11190 1 264 . 1 1 29 29 LEU H H 1 9.193 0.030 . 1 . . . . 29 LEU H . 11190 1 265 . 1 1 29 29 LEU HA H 1 4.059 0.030 . 1 . . . . 29 LEU HA . 11190 1 266 . 1 1 29 29 LEU HB2 H 1 1.700 0.030 . 2 . . . . 29 LEU HB2 . 11190 1 267 . 1 1 29 29 LEU HB3 H 1 1.878 0.030 . 2 . . . . 29 LEU HB3 . 11190 1 268 . 1 1 29 29 LEU HD11 H 1 0.939 0.030 . 1 . . . . 29 LEU HD1 . 11190 1 269 . 1 1 29 29 LEU HD12 H 1 0.939 0.030 . 1 . . . . 29 LEU HD1 . 11190 1 270 . 1 1 29 29 LEU HD13 H 1 0.939 0.030 . 1 . . . . 29 LEU HD1 . 11190 1 271 . 1 1 29 29 LEU HD21 H 1 0.946 0.030 . 1 . . . . 29 LEU HD2 . 11190 1 272 . 1 1 29 29 LEU HD22 H 1 0.946 0.030 . 1 . . . . 29 LEU HD2 . 11190 1 273 . 1 1 29 29 LEU HD23 H 1 0.946 0.030 . 1 . . . . 29 LEU HD2 . 11190 1 274 . 1 1 29 29 LEU HG H 1 1.660 0.030 . 1 . . . . 29 LEU HG . 11190 1 275 . 1 1 29 29 LEU C C 13 178.262 0.300 . 1 . . . . 29 LEU C . 11190 1 276 . 1 1 29 29 LEU CA C 13 58.987 0.300 . 1 . . . . 29 LEU CA . 11190 1 277 . 1 1 29 29 LEU CB C 13 41.819 0.300 . 1 . . . . 29 LEU CB . 11190 1 278 . 1 1 29 29 LEU CD1 C 13 25.472 0.300 . 2 . . . . 29 LEU CD1 . 11190 1 279 . 1 1 29 29 LEU CD2 C 13 25.242 0.300 . 2 . . . . 29 LEU CD2 . 11190 1 280 . 1 1 29 29 LEU CG C 13 27.615 0.300 . 1 . . . . 29 LEU CG . 11190 1 281 . 1 1 29 29 LEU N N 15 125.557 0.300 . 1 . . . . 29 LEU N . 11190 1 282 . 1 1 30 30 GLY H H 1 8.316 0.030 . 1 . . . . 30 GLY H . 11190 1 283 . 1 1 30 30 GLY HA2 H 1 3.541 0.030 . 2 . . . . 30 GLY HA2 . 11190 1 284 . 1 1 30 30 GLY HA3 H 1 4.841 0.030 . 2 . . . . 30 GLY HA3 . 11190 1 285 . 1 1 30 30 GLY C C 13 173.470 0.300 . 1 . . . . 30 GLY C . 11190 1 286 . 1 1 30 30 GLY CA C 13 45.954 0.300 . 1 . . . . 30 GLY CA . 11190 1 287 . 1 1 30 30 GLY N N 15 101.893 0.300 . 1 . . . . 30 GLY N . 11190 1 288 . 1 1 31 31 ILE H H 1 7.471 0.030 . 1 . . . . 31 ILE H . 11190 1 289 . 1 1 31 31 ILE HA H 1 4.555 0.030 . 1 . . . . 31 ILE HA . 11190 1 290 . 1 1 31 31 ILE HB H 1 1.613 0.030 . 1 . . . . 31 ILE HB . 11190 1 291 . 1 1 31 31 ILE HD11 H 1 0.676 0.030 . 1 . . . . 31 ILE HD1 . 11190 1 292 . 1 1 31 31 ILE HD12 H 1 0.676 0.030 . 1 . . . . 31 ILE HD1 . 11190 1 293 . 1 1 31 31 ILE HD13 H 1 0.676 0.030 . 1 . . . . 31 ILE HD1 . 11190 1 294 . 1 1 31 31 ILE HG12 H 1 0.672 0.030 . 2 . . . . 31 ILE HG12 . 11190 1 295 . 1 1 31 31 ILE HG13 H 1 1.480 0.030 . 2 . . . . 31 ILE HG13 . 11190 1 296 . 1 1 31 31 ILE HG21 H 1 0.739 0.030 . 1 . . . . 31 ILE HG2 . 11190 1 297 . 1 1 31 31 ILE HG22 H 1 0.739 0.030 . 1 . . . . 31 ILE HG2 . 11190 1 298 . 1 1 31 31 ILE HG23 H 1 0.739 0.030 . 1 . . . . 31 ILE HG2 . 11190 1 299 . 1 1 31 31 ILE C C 13 175.611 0.300 . 1 . . . . 31 ILE C . 11190 1 300 . 1 1 31 31 ILE CA C 13 60.240 0.300 . 1 . . . . 31 ILE CA . 11190 1 301 . 1 1 31 31 ILE CB C 13 40.267 0.300 . 1 . . . . 31 ILE CB . 11190 1 302 . 1 1 31 31 ILE CD1 C 13 13.863 0.300 . 1 . . . . 31 ILE CD1 . 11190 1 303 . 1 1 31 31 ILE CG1 C 13 27.415 0.300 . 1 . . . . 31 ILE CG1 . 11190 1 304 . 1 1 31 31 ILE CG2 C 13 18.680 0.300 . 1 . . . . 31 ILE CG2 . 11190 1 305 . 1 1 31 31 ILE N N 15 115.934 0.300 . 1 . . . . 31 ILE N . 11190 1 306 . 1 1 32 32 ARG H H 1 8.411 0.030 . 1 . . . . 32 ARG H . 11190 1 307 . 1 1 32 32 ARG HA H 1 4.859 0.030 . 1 . . . . 32 ARG HA . 11190 1 308 . 1 1 32 32 ARG HB2 H 1 1.825 0.030 . 1 . . . . 32 ARG HB2 . 11190 1 309 . 1 1 32 32 ARG HB3 H 1 1.825 0.030 . 1 . . . . 32 ARG HB3 . 11190 1 310 . 1 1 32 32 ARG HD2 H 1 3.121 0.030 . 2 . . . . 32 ARG HD2 . 11190 1 311 . 1 1 32 32 ARG HD3 H 1 3.189 0.030 . 2 . . . . 32 ARG HD3 . 11190 1 312 . 1 1 32 32 ARG HG2 H 1 1.456 0.030 . 2 . . . . 32 ARG HG2 . 11190 1 313 . 1 1 32 32 ARG HG3 H 1 1.582 0.030 . 2 . . . . 32 ARG HG3 . 11190 1 314 . 1 1 32 32 ARG C C 13 176.524 0.300 . 1 . . . . 32 ARG C . 11190 1 315 . 1 1 32 32 ARG CA C 13 54.265 0.300 . 1 . . . . 32 ARG CA . 11190 1 316 . 1 1 32 32 ARG CB C 13 30.529 0.300 . 1 . . . . 32 ARG CB . 11190 1 317 . 1 1 32 32 ARG CD C 13 42.848 0.300 . 1 . . . . 32 ARG CD . 11190 1 318 . 1 1 32 32 ARG CG C 13 27.122 0.300 . 1 . . . . 32 ARG CG . 11190 1 319 . 1 1 32 32 ARG N N 15 126.924 0.300 . 1 . . . . 32 ARG N . 11190 1 320 . 1 1 33 33 ILE H H 1 8.782 0.030 . 1 . . . . 33 ILE H . 11190 1 321 . 1 1 33 33 ILE HA H 1 5.416 0.030 . 1 . . . . 33 ILE HA . 11190 1 322 . 1 1 33 33 ILE HB H 1 1.902 0.030 . 1 . . . . 33 ILE HB . 11190 1 323 . 1 1 33 33 ILE HD11 H 1 0.742 0.030 . 1 . . . . 33 ILE HD1 . 11190 1 324 . 1 1 33 33 ILE HD12 H 1 0.742 0.030 . 1 . . . . 33 ILE HD1 . 11190 1 325 . 1 1 33 33 ILE HD13 H 1 0.742 0.030 . 1 . . . . 33 ILE HD1 . 11190 1 326 . 1 1 33 33 ILE HG12 H 1 1.043 0.030 . 2 . . . . 33 ILE HG12 . 11190 1 327 . 1 1 33 33 ILE HG13 H 1 1.404 0.030 . 2 . . . . 33 ILE HG13 . 11190 1 328 . 1 1 33 33 ILE HG21 H 1 0.630 0.030 . 1 . . . . 33 ILE HG2 . 11190 1 329 . 1 1 33 33 ILE HG22 H 1 0.630 0.030 . 1 . . . . 33 ILE HG2 . 11190 1 330 . 1 1 33 33 ILE HG23 H 1 0.630 0.030 . 1 . . . . 33 ILE HG2 . 11190 1 331 . 1 1 33 33 ILE C C 13 175.137 0.300 . 1 . . . . 33 ILE C . 11190 1 332 . 1 1 33 33 ILE CA C 13 59.506 0.300 . 1 . . . . 33 ILE CA . 11190 1 333 . 1 1 33 33 ILE CB C 13 41.798 0.300 . 1 . . . . 33 ILE CB . 11190 1 334 . 1 1 33 33 ILE CD1 C 13 14.479 0.300 . 1 . . . . 33 ILE CD1 . 11190 1 335 . 1 1 33 33 ILE CG1 C 13 25.421 0.300 . 1 . . . . 33 ILE CG1 . 11190 1 336 . 1 1 33 33 ILE CG2 C 13 19.249 0.300 . 1 . . . . 33 ILE CG2 . 11190 1 337 . 1 1 33 33 ILE N N 15 118.450 0.300 . 1 . . . . 33 ILE N . 11190 1 338 . 1 1 34 34 VAL H H 1 8.951 0.030 . 1 . . . . 34 VAL H . 11190 1 339 . 1 1 34 34 VAL HA H 1 4.387 0.030 . 1 . . . . 34 VAL HA . 11190 1 340 . 1 1 34 34 VAL HB H 1 1.992 0.030 . 1 . . . . 34 VAL HB . 11190 1 341 . 1 1 34 34 VAL HG11 H 1 0.910 0.030 . 1 . . . . 34 VAL HG1 . 11190 1 342 . 1 1 34 34 VAL HG12 H 1 0.910 0.030 . 1 . . . . 34 VAL HG1 . 11190 1 343 . 1 1 34 34 VAL HG13 H 1 0.910 0.030 . 1 . . . . 34 VAL HG1 . 11190 1 344 . 1 1 34 34 VAL HG21 H 1 0.872 0.030 . 1 . . . . 34 VAL HG2 . 11190 1 345 . 1 1 34 34 VAL HG22 H 1 0.872 0.030 . 1 . . . . 34 VAL HG2 . 11190 1 346 . 1 1 34 34 VAL HG23 H 1 0.872 0.030 . 1 . . . . 34 VAL HG2 . 11190 1 347 . 1 1 34 34 VAL C C 13 173.207 0.300 . 1 . . . . 34 VAL C . 11190 1 348 . 1 1 34 34 VAL CA C 13 60.788 0.300 . 1 . . . . 34 VAL CA . 11190 1 349 . 1 1 34 34 VAL CB C 13 35.230 0.300 . 1 . . . . 34 VAL CB . 11190 1 350 . 1 1 34 34 VAL CG1 C 13 20.886 0.300 . 2 . . . . 34 VAL CG1 . 11190 1 351 . 1 1 34 34 VAL CG2 C 13 20.068 0.300 . 2 . . . . 34 VAL CG2 . 11190 1 352 . 1 1 34 34 VAL N N 15 119.974 0.300 . 1 . . . . 34 VAL N . 11190 1 353 . 1 1 35 35 GLY H H 1 8.426 0.030 . 1 . . . . 35 GLY H . 11190 1 354 . 1 1 35 35 GLY HA2 H 1 3.720 0.030 . 2 . . . . 35 GLY HA2 . 11190 1 355 . 1 1 35 35 GLY HA3 H 1 5.043 0.030 . 2 . . . . 35 GLY HA3 . 11190 1 356 . 1 1 35 35 GLY C C 13 173.136 0.300 . 1 . . . . 35 GLY C . 11190 1 357 . 1 1 35 35 GLY CA C 13 44.732 0.300 . 1 . . . . 35 GLY CA . 11190 1 358 . 1 1 35 35 GLY N N 15 112.106 0.300 . 1 . . . . 35 GLY N . 11190 1 359 . 1 1 36 36 TYR H H 1 8.544 0.030 . 1 . . . . 36 TYR H . 11190 1 360 . 1 1 36 36 TYR HA H 1 4.864 0.030 . 1 . . . . 36 TYR HA . 11190 1 361 . 1 1 36 36 TYR HB2 H 1 2.856 0.030 . 2 . . . . 36 TYR HB2 . 11190 1 362 . 1 1 36 36 TYR HB3 H 1 3.032 0.030 . 2 . . . . 36 TYR HB3 . 11190 1 363 . 1 1 36 36 TYR HD1 H 1 6.970 0.030 . 1 . . . . 36 TYR HD1 . 11190 1 364 . 1 1 36 36 TYR HD2 H 1 6.970 0.030 . 1 . . . . 36 TYR HD2 . 11190 1 365 . 1 1 36 36 TYR HE1 H 1 6.602 0.030 . 1 . . . . 36 TYR HE1 . 11190 1 366 . 1 1 36 36 TYR HE2 H 1 6.602 0.030 . 1 . . . . 36 TYR HE2 . 11190 1 367 . 1 1 36 36 TYR C C 13 175.366 0.300 . 1 . . . . 36 TYR C . 11190 1 368 . 1 1 36 36 TYR CA C 13 56.963 0.300 . 1 . . . . 36 TYR CA . 11190 1 369 . 1 1 36 36 TYR CB C 13 40.330 0.300 . 1 . . . . 36 TYR CB . 11190 1 370 . 1 1 36 36 TYR CD1 C 13 133.014 0.300 . 1 . . . . 36 TYR CD1 . 11190 1 371 . 1 1 36 36 TYR CD2 C 13 133.014 0.300 . 1 . . . . 36 TYR CD2 . 11190 1 372 . 1 1 36 36 TYR CE1 C 13 117.910 0.300 . 1 . . . . 36 TYR CE1 . 11190 1 373 . 1 1 36 36 TYR CE2 C 13 117.910 0.300 . 1 . . . . 36 TYR CE2 . 11190 1 374 . 1 1 36 36 TYR N N 15 121.317 0.300 . 1 . . . . 36 TYR N . 11190 1 375 . 1 1 37 37 VAL H H 1 8.378 0.030 . 1 . . . . 37 VAL H . 11190 1 376 . 1 1 37 37 VAL HA H 1 4.256 0.030 . 1 . . . . 37 VAL HA . 11190 1 377 . 1 1 37 37 VAL HB H 1 1.979 0.030 . 1 . . . . 37 VAL HB . 11190 1 378 . 1 1 37 37 VAL HG11 H 1 0.870 0.030 . 1 . . . . 37 VAL HG1 . 11190 1 379 . 1 1 37 37 VAL HG12 H 1 0.870 0.030 . 1 . . . . 37 VAL HG1 . 11190 1 380 . 1 1 37 37 VAL HG13 H 1 0.870 0.030 . 1 . . . . 37 VAL HG1 . 11190 1 381 . 1 1 37 37 VAL HG21 H 1 0.861 0.030 . 1 . . . . 37 VAL HG2 . 11190 1 382 . 1 1 37 37 VAL HG22 H 1 0.861 0.030 . 1 . . . . 37 VAL HG2 . 11190 1 383 . 1 1 37 37 VAL HG23 H 1 0.861 0.030 . 1 . . . . 37 VAL HG2 . 11190 1 384 . 1 1 37 37 VAL C C 13 175.892 0.300 . 1 . . . . 37 VAL C . 11190 1 385 . 1 1 37 37 VAL CA C 13 61.728 0.300 . 1 . . . . 37 VAL CA . 11190 1 386 . 1 1 37 37 VAL CB C 13 33.179 0.300 . 1 . . . . 37 VAL CB . 11190 1 387 . 1 1 37 37 VAL CG1 C 13 21.107 0.300 . 2 . . . . 37 VAL CG1 . 11190 1 388 . 1 1 37 37 VAL CG2 C 13 20.326 0.300 . 2 . . . . 37 VAL CG2 . 11190 1 389 . 1 1 37 37 VAL N N 15 122.811 0.300 . 1 . . . . 37 VAL N . 11190 1 390 . 1 1 38 38 GLY H H 1 8.251 0.030 . 1 . . . . 38 GLY H . 11190 1 391 . 1 1 38 38 GLY HA2 H 1 4.033 0.030 . 1 . . . . 38 GLY HA2 . 11190 1 392 . 1 1 38 38 GLY HA3 H 1 4.033 0.030 . 1 . . . . 38 GLY HA3 . 11190 1 393 . 1 1 38 38 GLY C C 13 173.944 0.300 . 1 . . . . 38 GLY C . 11190 1 394 . 1 1 38 38 GLY CA C 13 45.107 0.300 . 1 . . . . 38 GLY CA . 11190 1 395 . 1 1 38 38 GLY N N 15 112.560 0.300 . 1 . . . . 38 GLY N . 11190 1 396 . 1 1 39 39 THR H H 1 8.221 0.030 . 1 . . . . 39 THR H . 11190 1 397 . 1 1 39 39 THR HA H 1 4.444 0.030 . 1 . . . . 39 THR HA . 11190 1 398 . 1 1 39 39 THR HB H 1 4.278 0.030 . 1 . . . . 39 THR HB . 11190 1 399 . 1 1 39 39 THR HG21 H 1 1.198 0.030 . 1 . . . . 39 THR HG2 . 11190 1 400 . 1 1 39 39 THR HG22 H 1 1.198 0.030 . 1 . . . . 39 THR HG2 . 11190 1 401 . 1 1 39 39 THR HG23 H 1 1.198 0.030 . 1 . . . . 39 THR HG2 . 11190 1 402 . 1 1 39 39 THR C C 13 175.059 0.300 . 1 . . . . 39 THR C . 11190 1 403 . 1 1 39 39 THR CA C 13 61.696 0.300 . 1 . . . . 39 THR CA . 11190 1 404 . 1 1 39 39 THR CB C 13 69.941 0.300 . 1 . . . . 39 THR CB . 11190 1 405 . 1 1 39 39 THR CG2 C 13 21.615 0.300 . 1 . . . . 39 THR CG2 . 11190 1 406 . 1 1 39 39 THR N N 15 112.629 0.300 . 1 . . . . 39 THR N . 11190 1 407 . 1 1 40 40 SER H H 1 8.464 0.030 . 1 . . . . 40 SER H . 11190 1 408 . 1 1 40 40 SER HA H 1 4.524 0.030 . 1 . . . . 40 SER HA . 11190 1 409 . 1 1 40 40 SER HB2 H 1 3.907 0.030 . 2 . . . . 40 SER HB2 . 11190 1 410 . 1 1 40 40 SER HB3 H 1 3.859 0.030 . 2 . . . . 40 SER HB3 . 11190 1 411 . 1 1 40 40 SER CA C 13 58.306 0.300 . 1 . . . . 40 SER CA . 11190 1 412 . 1 1 40 40 SER CB C 13 63.870 0.300 . 1 . . . . 40 SER CB . 11190 1 413 . 1 1 41 41 HIS HA H 1 4.600 0.030 . 1 . . . . 41 HIS HA . 11190 1 414 . 1 1 41 41 HIS HB2 H 1 3.101 0.030 . 2 . . . . 41 HIS HB2 . 11190 1 415 . 1 1 41 41 HIS HB3 H 1 3.128 0.030 . 2 . . . . 41 HIS HB3 . 11190 1 416 . 1 1 41 41 HIS HD2 H 1 6.995 0.030 . 1 . . . . 41 HIS HD2 . 11190 1 417 . 1 1 41 41 HIS HE1 H 1 7.802 0.030 . 1 . . . . 41 HIS HE1 . 11190 1 418 . 1 1 41 41 HIS C C 13 175.839 0.300 . 1 . . . . 41 HIS C . 11190 1 419 . 1 1 41 41 HIS CA C 13 57.120 0.300 . 1 . . . . 41 HIS CA . 11190 1 420 . 1 1 41 41 HIS CB C 13 30.427 0.300 . 1 . . . . 41 HIS CB . 11190 1 421 . 1 1 41 41 HIS CD2 C 13 119.469 0.300 . 1 . . . . 41 HIS CD2 . 11190 1 422 . 1 1 41 41 HIS CE1 C 13 138.333 0.300 . 1 . . . . 41 HIS CE1 . 11190 1 423 . 1 1 42 42 THR H H 1 7.874 0.030 . 1 . . . . 42 THR H . 11190 1 424 . 1 1 42 42 THR HA H 1 4.346 0.030 . 1 . . . . 42 THR HA . 11190 1 425 . 1 1 42 42 THR HB H 1 4.321 0.030 . 1 . . . . 42 THR HB . 11190 1 426 . 1 1 42 42 THR HG21 H 1 1.072 0.030 . 1 . . . . 42 THR HG2 . 11190 1 427 . 1 1 42 42 THR HG22 H 1 1.072 0.030 . 1 . . . . 42 THR HG2 . 11190 1 428 . 1 1 42 42 THR HG23 H 1 1.072 0.030 . 1 . . . . 42 THR HG2 . 11190 1 429 . 1 1 42 42 THR C C 13 175.295 0.300 . 1 . . . . 42 THR C . 11190 1 430 . 1 1 42 42 THR CA C 13 61.659 0.300 . 1 . . . . 42 THR CA . 11190 1 431 . 1 1 42 42 THR CB C 13 69.502 0.300 . 1 . . . . 42 THR CB . 11190 1 432 . 1 1 42 42 THR CG2 C 13 21.493 0.300 . 1 . . . . 42 THR CG2 . 11190 1 433 . 1 1 42 42 THR N N 15 111.674 0.300 . 1 . . . . 42 THR N . 11190 1 434 . 1 1 43 43 GLY H H 1 8.236 0.030 . 1 . . . . 43 GLY H . 11190 1 435 . 1 1 43 43 GLY HA2 H 1 3.836 0.030 . 2 . . . . 43 GLY HA2 . 11190 1 436 . 1 1 43 43 GLY HA3 H 1 4.052 0.030 . 2 . . . . 43 GLY HA3 . 11190 1 437 . 1 1 43 43 GLY C C 13 174.365 0.300 . 1 . . . . 43 GLY C . 11190 1 438 . 1 1 43 43 GLY CA C 13 45.445 0.300 . 1 . . . . 43 GLY CA . 11190 1 439 . 1 1 43 43 GLY N N 15 110.732 0.300 . 1 . . . . 43 GLY N . 11190 1 440 . 1 1 44 44 GLU H H 1 8.149 0.030 . 1 . . . . 44 GLU H . 11190 1 441 . 1 1 44 44 GLU HA H 1 4.236 0.030 . 1 . . . . 44 GLU HA . 11190 1 442 . 1 1 44 44 GLU HB2 H 1 1.809 0.030 . 2 . . . . 44 GLU HB2 . 11190 1 443 . 1 1 44 44 GLU HB3 H 1 1.988 0.030 . 2 . . . . 44 GLU HB3 . 11190 1 444 . 1 1 44 44 GLU HG2 H 1 2.186 0.030 . 1 . . . . 44 GLU HG2 . 11190 1 445 . 1 1 44 44 GLU HG3 H 1 2.186 0.030 . 1 . . . . 44 GLU HG3 . 11190 1 446 . 1 1 44 44 GLU C C 13 176.085 0.300 . 1 . . . . 44 GLU C . 11190 1 447 . 1 1 44 44 GLU CA C 13 56.634 0.300 . 1 . . . . 44 GLU CA . 11190 1 448 . 1 1 44 44 GLU CB C 13 30.137 0.300 . 1 . . . . 44 GLU CB . 11190 1 449 . 1 1 44 44 GLU CG C 13 36.207 0.300 . 1 . . . . 44 GLU CG . 11190 1 450 . 1 1 44 44 GLU N N 15 120.863 0.300 . 1 . . . . 44 GLU N . 11190 1 451 . 1 1 45 45 ALA H H 1 8.341 0.030 . 1 . . . . 45 ALA H . 11190 1 452 . 1 1 45 45 ALA HA H 1 4.384 0.030 . 1 . . . . 45 ALA HA . 11190 1 453 . 1 1 45 45 ALA HB1 H 1 1.350 0.030 . 1 . . . . 45 ALA HB . 11190 1 454 . 1 1 45 45 ALA HB2 H 1 1.350 0.030 . 1 . . . . 45 ALA HB . 11190 1 455 . 1 1 45 45 ALA HB3 H 1 1.350 0.030 . 1 . . . . 45 ALA HB . 11190 1 456 . 1 1 45 45 ALA C C 13 177.718 0.300 . 1 . . . . 45 ALA C . 11190 1 457 . 1 1 45 45 ALA CA C 13 52.211 0.300 . 1 . . . . 45 ALA CA . 11190 1 458 . 1 1 45 45 ALA CB C 13 19.504 0.300 . 1 . . . . 45 ALA CB . 11190 1 459 . 1 1 45 45 ALA N N 15 124.394 0.300 . 1 . . . . 45 ALA N . 11190 1 460 . 1 1 46 46 SER H H 1 8.295 0.030 . 1 . . . . 46 SER H . 11190 1 461 . 1 1 46 46 SER HA H 1 4.595 0.030 . 1 . . . . 46 SER HA . 11190 1 462 . 1 1 46 46 SER HB2 H 1 3.943 0.030 . 1 . . . . 46 SER HB2 . 11190 1 463 . 1 1 46 46 SER HB3 H 1 3.943 0.030 . 1 . . . . 46 SER HB3 . 11190 1 464 . 1 1 46 46 SER C C 13 174.154 0.300 . 1 . . . . 46 SER C . 11190 1 465 . 1 1 46 46 SER CA C 13 58.463 0.300 . 1 . . . . 46 SER CA . 11190 1 466 . 1 1 46 46 SER CB C 13 64.198 0.300 . 1 . . . . 46 SER CB . 11190 1 467 . 1 1 46 46 SER N N 15 115.435 0.300 . 1 . . . . 46 SER N . 11190 1 468 . 1 1 47 47 GLY H H 1 8.570 0.030 . 1 . . . . 47 GLY H . 11190 1 469 . 1 1 47 47 GLY HA2 H 1 3.993 0.030 . 2 . . . . 47 GLY HA2 . 11190 1 470 . 1 1 47 47 GLY HA3 H 1 4.028 0.030 . 2 . . . . 47 GLY HA3 . 11190 1 471 . 1 1 47 47 GLY C C 13 170.820 0.300 . 1 . . . . 47 GLY C . 11190 1 472 . 1 1 47 47 GLY CA C 13 44.781 0.300 . 1 . . . . 47 GLY CA . 11190 1 473 . 1 1 47 47 GLY N N 15 110.487 0.300 . 1 . . . . 47 GLY N . 11190 1 474 . 1 1 48 48 ILE H H 1 8.385 0.030 . 1 . . . . 48 ILE H . 11190 1 475 . 1 1 48 48 ILE HA H 1 4.649 0.030 . 1 . . . . 48 ILE HA . 11190 1 476 . 1 1 48 48 ILE HB H 1 1.979 0.030 . 1 . . . . 48 ILE HB . 11190 1 477 . 1 1 48 48 ILE HD11 H 1 0.747 0.030 . 1 . . . . 48 ILE HD1 . 11190 1 478 . 1 1 48 48 ILE HD12 H 1 0.747 0.030 . 1 . . . . 48 ILE HD1 . 11190 1 479 . 1 1 48 48 ILE HD13 H 1 0.747 0.030 . 1 . . . . 48 ILE HD1 . 11190 1 480 . 1 1 48 48 ILE HG12 H 1 1.331 0.030 . 2 . . . . 48 ILE HG12 . 11190 1 481 . 1 1 48 48 ILE HG13 H 1 1.535 0.030 . 2 . . . . 48 ILE HG13 . 11190 1 482 . 1 1 48 48 ILE HG21 H 1 0.773 0.030 . 1 . . . . 48 ILE HG2 . 11190 1 483 . 1 1 48 48 ILE HG22 H 1 0.773 0.030 . 1 . . . . 48 ILE HG2 . 11190 1 484 . 1 1 48 48 ILE HG23 H 1 0.773 0.030 . 1 . . . . 48 ILE HG2 . 11190 1 485 . 1 1 48 48 ILE C C 13 173.961 0.300 . 1 . . . . 48 ILE C . 11190 1 486 . 1 1 48 48 ILE CA C 13 58.419 0.300 . 1 . . . . 48 ILE CA . 11190 1 487 . 1 1 48 48 ILE CB C 13 37.017 0.300 . 1 . . . . 48 ILE CB . 11190 1 488 . 1 1 48 48 ILE CD1 C 13 10.701 0.300 . 1 . . . . 48 ILE CD1 . 11190 1 489 . 1 1 48 48 ILE CG1 C 13 26.564 0.300 . 1 . . . . 48 ILE CG1 . 11190 1 490 . 1 1 48 48 ILE CG2 C 13 18.708 0.300 . 1 . . . . 48 ILE CG2 . 11190 1 491 . 1 1 48 48 ILE N N 15 121.896 0.300 . 1 . . . . 48 ILE N . 11190 1 492 . 1 1 49 49 TYR H H 1 9.036 0.030 . 1 . . . . 49 TYR H . 11190 1 493 . 1 1 49 49 TYR HA H 1 5.379 0.030 . 1 . . . . 49 TYR HA . 11190 1 494 . 1 1 49 49 TYR HB2 H 1 2.636 0.030 . 1 . . . . 49 TYR HB2 . 11190 1 495 . 1 1 49 49 TYR HB3 H 1 2.636 0.030 . 1 . . . . 49 TYR HB3 . 11190 1 496 . 1 1 49 49 TYR HD1 H 1 7.008 0.030 . 1 . . . . 49 TYR HD1 . 11190 1 497 . 1 1 49 49 TYR HD2 H 1 7.008 0.030 . 1 . . . . 49 TYR HD2 . 11190 1 498 . 1 1 49 49 TYR HE1 H 1 6.731 0.030 . 1 . . . . 49 TYR HE1 . 11190 1 499 . 1 1 49 49 TYR HE2 H 1 6.731 0.030 . 1 . . . . 49 TYR HE2 . 11190 1 500 . 1 1 49 49 TYR C C 13 176.085 0.300 . 1 . . . . 49 TYR C . 11190 1 501 . 1 1 49 49 TYR CA C 13 55.854 0.300 . 1 . . . . 49 TYR CA . 11190 1 502 . 1 1 49 49 TYR CB C 13 42.286 0.300 . 1 . . . . 49 TYR CB . 11190 1 503 . 1 1 49 49 TYR CD1 C 13 133.780 0.300 . 1 . . . . 49 TYR CD1 . 11190 1 504 . 1 1 49 49 TYR CD2 C 13 133.780 0.300 . 1 . . . . 49 TYR CD2 . 11190 1 505 . 1 1 49 49 TYR CE1 C 13 117.318 0.300 . 1 . . . . 49 TYR CE1 . 11190 1 506 . 1 1 49 49 TYR CE2 C 13 117.318 0.300 . 1 . . . . 49 TYR CE2 . 11190 1 507 . 1 1 49 49 TYR N N 15 123.711 0.300 . 1 . . . . 49 TYR N . 11190 1 508 . 1 1 50 50 VAL H H 1 9.002 0.030 . 1 . . . . 50 VAL H . 11190 1 509 . 1 1 50 50 VAL HA H 1 3.848 0.030 . 1 . . . . 50 VAL HA . 11190 1 510 . 1 1 50 50 VAL HB H 1 2.334 0.030 . 1 . . . . 50 VAL HB . 11190 1 511 . 1 1 50 50 VAL HG11 H 1 0.691 0.030 . 1 . . . . 50 VAL HG1 . 11190 1 512 . 1 1 50 50 VAL HG12 H 1 0.691 0.030 . 1 . . . . 50 VAL HG1 . 11190 1 513 . 1 1 50 50 VAL HG13 H 1 0.691 0.030 . 1 . . . . 50 VAL HG1 . 11190 1 514 . 1 1 50 50 VAL HG21 H 1 0.851 0.030 . 1 . . . . 50 VAL HG2 . 11190 1 515 . 1 1 50 50 VAL HG22 H 1 0.851 0.030 . 1 . . . . 50 VAL HG2 . 11190 1 516 . 1 1 50 50 VAL HG23 H 1 0.851 0.030 . 1 . . . . 50 VAL HG2 . 11190 1 517 . 1 1 50 50 VAL C C 13 175.980 0.300 . 1 . . . . 50 VAL C . 11190 1 518 . 1 1 50 50 VAL CA C 13 63.876 0.300 . 1 . . . . 50 VAL CA . 11190 1 519 . 1 1 50 50 VAL CB C 13 31.857 0.300 . 1 . . . . 50 VAL CB . 11190 1 520 . 1 1 50 50 VAL CG1 C 13 21.752 0.300 . 2 . . . . 50 VAL CG1 . 11190 1 521 . 1 1 50 50 VAL CG2 C 13 21.130 0.300 . 2 . . . . 50 VAL CG2 . 11190 1 522 . 1 1 50 50 VAL N N 15 119.535 0.300 . 1 . . . . 50 VAL N . 11190 1 523 . 1 1 51 51 LYS H H 1 9.700 0.030 . 1 . . . . 51 LYS H . 11190 1 524 . 1 1 51 51 LYS HA H 1 4.411 0.030 . 1 . . . . 51 LYS HA . 11190 1 525 . 1 1 51 51 LYS HB2 H 1 1.564 0.030 . 2 . . . . 51 LYS HB2 . 11190 1 526 . 1 1 51 51 LYS HB3 H 1 1.473 0.030 . 2 . . . . 51 LYS HB3 . 11190 1 527 . 1 1 51 51 LYS HD2 H 1 1.547 0.030 . 2 . . . . 51 LYS HD2 . 11190 1 528 . 1 1 51 51 LYS HD3 H 1 1.679 0.030 . 2 . . . . 51 LYS HD3 . 11190 1 529 . 1 1 51 51 LYS HE2 H 1 2.957 0.030 . 1 . . . . 51 LYS HE2 . 11190 1 530 . 1 1 51 51 LYS HE3 H 1 2.957 0.030 . 1 . . . . 51 LYS HE3 . 11190 1 531 . 1 1 51 51 LYS HG2 H 1 1.388 0.030 . 1 . . . . 51 LYS HG2 . 11190 1 532 . 1 1 51 51 LYS HG3 H 1 1.388 0.030 . 1 . . . . 51 LYS HG3 . 11190 1 533 . 1 1 51 51 LYS C C 13 175.471 0.300 . 1 . . . . 51 LYS C . 11190 1 534 . 1 1 51 51 LYS CA C 13 56.691 0.300 . 1 . . . . 51 LYS CA . 11190 1 535 . 1 1 51 51 LYS CB C 13 34.394 0.300 . 1 . . . . 51 LYS CB . 11190 1 536 . 1 1 51 51 LYS CD C 13 28.987 0.300 . 1 . . . . 51 LYS CD . 11190 1 537 . 1 1 51 51 LYS CE C 13 42.176 0.300 . 1 . . . . 51 LYS CE . 11190 1 538 . 1 1 51 51 LYS CG C 13 24.626 0.300 . 1 . . . . 51 LYS CG . 11190 1 539 . 1 1 51 51 LYS N N 15 133.186 0.300 . 1 . . . . 51 LYS N . 11190 1 540 . 1 1 52 52 SER H H 1 7.609 0.030 . 1 . . . . 52 SER H . 11190 1 541 . 1 1 52 52 SER HA H 1 4.483 0.030 . 1 . . . . 52 SER HA . 11190 1 542 . 1 1 52 52 SER HB2 H 1 3.808 0.030 . 2 . . . . 52 SER HB2 . 11190 1 543 . 1 1 52 52 SER HB3 H 1 3.645 0.030 . 2 . . . . 52 SER HB3 . 11190 1 544 . 1 1 52 52 SER C C 13 171.311 0.300 . 1 . . . . 52 SER C . 11190 1 545 . 1 1 52 52 SER CA C 13 57.516 0.300 . 1 . . . . 52 SER CA . 11190 1 546 . 1 1 52 52 SER CB C 13 64.878 0.300 . 1 . . . . 52 SER CB . 11190 1 547 . 1 1 52 52 SER N N 15 108.903 0.300 . 1 . . . . 52 SER N . 11190 1 548 . 1 1 53 53 VAL H H 1 8.353 0.030 . 1 . . . . 53 VAL H . 11190 1 549 . 1 1 53 53 VAL HA H 1 4.822 0.030 . 1 . . . . 53 VAL HA . 11190 1 550 . 1 1 53 53 VAL HB H 1 1.873 0.030 . 1 . . . . 53 VAL HB . 11190 1 551 . 1 1 53 53 VAL HG11 H 1 0.751 0.030 . 1 . . . . 53 VAL HG1 . 11190 1 552 . 1 1 53 53 VAL HG12 H 1 0.751 0.030 . 1 . . . . 53 VAL HG1 . 11190 1 553 . 1 1 53 53 VAL HG13 H 1 0.751 0.030 . 1 . . . . 53 VAL HG1 . 11190 1 554 . 1 1 53 53 VAL HG21 H 1 0.682 0.030 . 1 . . . . 53 VAL HG2 . 11190 1 555 . 1 1 53 53 VAL HG22 H 1 0.682 0.030 . 1 . . . . 53 VAL HG2 . 11190 1 556 . 1 1 53 53 VAL HG23 H 1 0.682 0.030 . 1 . . . . 53 VAL HG2 . 11190 1 557 . 1 1 53 53 VAL C C 13 176.313 0.300 . 1 . . . . 53 VAL C . 11190 1 558 . 1 1 53 53 VAL CA C 13 60.443 0.300 . 1 . . . . 53 VAL CA . 11190 1 559 . 1 1 53 53 VAL CB C 13 33.415 0.300 . 1 . . . . 53 VAL CB . 11190 1 560 . 1 1 53 53 VAL CG1 C 13 21.567 0.300 . 2 . . . . 53 VAL CG1 . 11190 1 561 . 1 1 53 53 VAL CG2 C 13 20.510 0.300 . 2 . . . . 53 VAL CG2 . 11190 1 562 . 1 1 53 53 VAL N N 15 120.721 0.300 . 1 . . . . 53 VAL N . 11190 1 563 . 1 1 54 54 ILE H H 1 9.040 0.030 . 1 . . . . 54 ILE H . 11190 1 564 . 1 1 54 54 ILE HA H 1 4.169 0.030 . 1 . . . . 54 ILE HA . 11190 1 565 . 1 1 54 54 ILE HB H 1 1.635 0.030 . 1 . . . . 54 ILE HB . 11190 1 566 . 1 1 54 54 ILE HD11 H 1 0.746 0.030 . 1 . . . . 54 ILE HD1 . 11190 1 567 . 1 1 54 54 ILE HD12 H 1 0.746 0.030 . 1 . . . . 54 ILE HD1 . 11190 1 568 . 1 1 54 54 ILE HD13 H 1 0.746 0.030 . 1 . . . . 54 ILE HD1 . 11190 1 569 . 1 1 54 54 ILE HG12 H 1 1.155 0.030 . 2 . . . . 54 ILE HG12 . 11190 1 570 . 1 1 54 54 ILE HG13 H 1 1.436 0.030 . 2 . . . . 54 ILE HG13 . 11190 1 571 . 1 1 54 54 ILE HG21 H 1 0.962 0.030 . 1 . . . . 54 ILE HG2 . 11190 1 572 . 1 1 54 54 ILE HG22 H 1 0.962 0.030 . 1 . . . . 54 ILE HG2 . 11190 1 573 . 1 1 54 54 ILE HG23 H 1 0.962 0.030 . 1 . . . . 54 ILE HG2 . 11190 1 574 . 1 1 54 54 ILE C C 13 175.041 0.300 . 1 . . . . 54 ILE C . 11190 1 575 . 1 1 54 54 ILE CA C 13 59.081 0.300 . 1 . . . . 54 ILE CA . 11190 1 576 . 1 1 54 54 ILE CB C 13 38.796 0.300 . 1 . . . . 54 ILE CB . 11190 1 577 . 1 1 54 54 ILE CD1 C 13 11.637 0.300 . 1 . . . . 54 ILE CD1 . 11190 1 578 . 1 1 54 54 ILE CG1 C 13 27.390 0.300 . 1 . . . . 54 ILE CG1 . 11190 1 579 . 1 1 54 54 ILE CG2 C 13 15.858 0.300 . 1 . . . . 54 ILE CG2 . 11190 1 580 . 1 1 54 54 ILE N N 15 128.694 0.300 . 1 . . . . 54 ILE N . 11190 1 581 . 1 1 55 55 PRO HA H 1 3.098 0.030 . 1 . . . . 55 PRO HA . 11190 1 582 . 1 1 55 55 PRO HB2 H 1 1.609 0.030 . 2 . . . . 55 PRO HB2 . 11190 1 583 . 1 1 55 55 PRO HB3 H 1 1.828 0.030 . 2 . . . . 55 PRO HB3 . 11190 1 584 . 1 1 55 55 PRO HD2 H 1 3.573 0.030 . 2 . . . . 55 PRO HD2 . 11190 1 585 . 1 1 55 55 PRO HD3 H 1 4.130 0.030 . 2 . . . . 55 PRO HD3 . 11190 1 586 . 1 1 55 55 PRO HG2 H 1 2.038 0.030 . 2 . . . . 55 PRO HG2 . 11190 1 587 . 1 1 55 55 PRO HG3 H 1 1.802 0.030 . 2 . . . . 55 PRO HG3 . 11190 1 588 . 1 1 55 55 PRO C C 13 176.717 0.300 . 1 . . . . 55 PRO C . 11190 1 589 . 1 1 55 55 PRO CA C 13 63.953 0.300 . 1 . . . . 55 PRO CA . 11190 1 590 . 1 1 55 55 PRO CB C 13 31.302 0.300 . 1 . . . . 55 PRO CB . 11190 1 591 . 1 1 55 55 PRO CD C 13 51.560 0.300 . 1 . . . . 55 PRO CD . 11190 1 592 . 1 1 55 55 PRO CG C 13 27.746 0.300 . 1 . . . . 55 PRO CG . 11190 1 593 . 1 1 56 56 GLY H H 1 6.022 0.030 . 1 . . . . 56 GLY H . 11190 1 594 . 1 1 56 56 GLY HA2 H 1 3.670 0.030 . 2 . . . . 56 GLY HA2 . 11190 1 595 . 1 1 56 56 GLY HA3 H 1 4.156 0.030 . 2 . . . . 56 GLY HA3 . 11190 1 596 . 1 1 56 56 GLY C C 13 173.031 0.300 . 1 . . . . 56 GLY C . 11190 1 597 . 1 1 56 56 GLY CA C 13 45.349 0.300 . 1 . . . . 56 GLY CA . 11190 1 598 . 1 1 56 56 GLY N N 15 109.675 0.300 . 1 . . . . 56 GLY N . 11190 1 599 . 1 1 57 57 SER H H 1 7.436 0.030 . 1 . . . . 57 SER H . 11190 1 600 . 1 1 57 57 SER HA H 1 4.580 0.030 . 1 . . . . 57 SER HA . 11190 1 601 . 1 1 57 57 SER HB2 H 1 3.659 0.030 . 2 . . . . 57 SER HB2 . 11190 1 602 . 1 1 57 57 SER HB3 H 1 3.971 0.030 . 2 . . . . 57 SER HB3 . 11190 1 603 . 1 1 57 57 SER C C 13 174.541 0.300 . 1 . . . . 57 SER C . 11190 1 604 . 1 1 57 57 SER CA C 13 57.886 0.300 . 1 . . . . 57 SER CA . 11190 1 605 . 1 1 57 57 SER CB C 13 66.441 0.300 . 1 . . . . 57 SER CB . 11190 1 606 . 1 1 57 57 SER N N 15 114.764 0.300 . 1 . . . . 57 SER N . 11190 1 607 . 1 1 58 58 ALA H H 1 8.965 0.030 . 1 . . . . 58 ALA H . 11190 1 608 . 1 1 58 58 ALA HA H 1 4.308 0.030 . 1 . . . . 58 ALA HA . 11190 1 609 . 1 1 58 58 ALA HB1 H 1 1.557 0.030 . 1 . . . . 58 ALA HB . 11190 1 610 . 1 1 58 58 ALA HB2 H 1 1.557 0.030 . 1 . . . . 58 ALA HB . 11190 1 611 . 1 1 58 58 ALA HB3 H 1 1.557 0.030 . 1 . . . . 58 ALA HB . 11190 1 612 . 1 1 58 58 ALA C C 13 181.000 0.300 . 1 . . . . 58 ALA C . 11190 1 613 . 1 1 58 58 ALA CA C 13 55.540 0.300 . 1 . . . . 58 ALA CA . 11190 1 614 . 1 1 58 58 ALA CB C 13 18.999 0.300 . 1 . . . . 58 ALA CB . 11190 1 615 . 1 1 58 58 ALA N N 15 121.899 0.300 . 1 . . . . 58 ALA N . 11190 1 616 . 1 1 59 59 ALA H H 1 8.637 0.030 . 1 . . . . 59 ALA H . 11190 1 617 . 1 1 59 59 ALA HA H 1 3.985 0.030 . 1 . . . . 59 ALA HA . 11190 1 618 . 1 1 59 59 ALA HB1 H 1 1.349 0.030 . 1 . . . . 59 ALA HB . 11190 1 619 . 1 1 59 59 ALA HB2 H 1 1.349 0.030 . 1 . . . . 59 ALA HB . 11190 1 620 . 1 1 59 59 ALA HB3 H 1 1.349 0.030 . 1 . . . . 59 ALA HB . 11190 1 621 . 1 1 59 59 ALA C C 13 178.946 0.300 . 1 . . . . 59 ALA C . 11190 1 622 . 1 1 59 59 ALA CA C 13 55.069 0.300 . 1 . . . . 59 ALA CA . 11190 1 623 . 1 1 59 59 ALA CB C 13 19.150 0.300 . 1 . . . . 59 ALA CB . 11190 1 624 . 1 1 59 59 ALA N N 15 118.438 0.300 . 1 . . . . 59 ALA N . 11190 1 625 . 1 1 60 60 TYR H H 1 7.626 0.030 . 1 . . . . 60 TYR H . 11190 1 626 . 1 1 60 60 TYR HA H 1 3.862 0.030 . 1 . . . . 60 TYR HA . 11190 1 627 . 1 1 60 60 TYR HB2 H 1 3.054 0.030 . 1 . . . . 60 TYR HB2 . 11190 1 628 . 1 1 60 60 TYR HB3 H 1 3.054 0.030 . 1 . . . . 60 TYR HB3 . 11190 1 629 . 1 1 60 60 TYR HD1 H 1 6.576 0.030 . 1 . . . . 60 TYR HD1 . 11190 1 630 . 1 1 60 60 TYR HD2 H 1 6.576 0.030 . 1 . . . . 60 TYR HD2 . 11190 1 631 . 1 1 60 60 TYR HE1 H 1 6.825 0.030 . 1 . . . . 60 TYR HE1 . 11190 1 632 . 1 1 60 60 TYR HE2 H 1 6.825 0.030 . 1 . . . . 60 TYR HE2 . 11190 1 633 . 1 1 60 60 TYR C C 13 177.209 0.300 . 1 . . . . 60 TYR C . 11190 1 634 . 1 1 60 60 TYR CA C 13 61.077 0.300 . 1 . . . . 60 TYR CA . 11190 1 635 . 1 1 60 60 TYR CB C 13 38.570 0.300 . 1 . . . . 60 TYR CB . 11190 1 636 . 1 1 60 60 TYR CD1 C 13 132.760 0.300 . 1 . . . . 60 TYR CD1 . 11190 1 637 . 1 1 60 60 TYR CD2 C 13 132.760 0.300 . 1 . . . . 60 TYR CD2 . 11190 1 638 . 1 1 60 60 TYR CE1 C 13 119.310 0.300 . 1 . . . . 60 TYR CE1 . 11190 1 639 . 1 1 60 60 TYR CE2 C 13 119.310 0.300 . 1 . . . . 60 TYR CE2 . 11190 1 640 . 1 1 60 60 TYR N N 15 120.957 0.300 . 1 . . . . 60 TYR N . 11190 1 641 . 1 1 61 61 HIS H H 1 8.113 0.030 . 1 . . . . 61 HIS H . 11190 1 642 . 1 1 61 61 HIS HA H 1 4.228 0.030 . 1 . . . . 61 HIS HA . 11190 1 643 . 1 1 61 61 HIS HB2 H 1 3.091 0.030 . 2 . . . . 61 HIS HB2 . 11190 1 644 . 1 1 61 61 HIS HB3 H 1 3.237 0.030 . 2 . . . . 61 HIS HB3 . 11190 1 645 . 1 1 61 61 HIS HD2 H 1 6.916 0.030 . 1 . . . . 61 HIS HD2 . 11190 1 646 . 1 1 61 61 HIS HE1 H 1 7.885 0.030 . 1 . . . . 61 HIS HE1 . 11190 1 647 . 1 1 61 61 HIS C C 13 176.542 0.300 . 1 . . . . 61 HIS C . 11190 1 648 . 1 1 61 61 HIS CA C 13 58.754 0.300 . 1 . . . . 61 HIS CA . 11190 1 649 . 1 1 61 61 HIS CB C 13 30.696 0.300 . 1 . . . . 61 HIS CB . 11190 1 650 . 1 1 61 61 HIS CD2 C 13 120.912 0.300 . 1 . . . . 61 HIS CD2 . 11190 1 651 . 1 1 61 61 HIS CE1 C 13 139.088 0.300 . 1 . . . . 61 HIS CE1 . 11190 1 652 . 1 1 61 61 HIS N N 15 117.182 0.300 . 1 . . . . 61 HIS N . 11190 1 653 . 1 1 62 62 ASN H H 1 7.795 0.030 . 1 . . . . 62 ASN H . 11190 1 654 . 1 1 62 62 ASN HA H 1 4.390 0.030 . 1 . . . . 62 ASN HA . 11190 1 655 . 1 1 62 62 ASN HB2 H 1 2.634 0.030 . 2 . . . . 62 ASN HB2 . 11190 1 656 . 1 1 62 62 ASN HB3 H 1 2.961 0.030 . 2 . . . . 62 ASN HB3 . 11190 1 657 . 1 1 62 62 ASN HD21 H 1 6.808 0.030 . 2 . . . . 62 ASN HD21 . 11190 1 658 . 1 1 62 62 ASN HD22 H 1 8.056 0.030 . 2 . . . . 62 ASN HD22 . 11190 1 659 . 1 1 62 62 ASN C C 13 176.752 0.300 . 1 . . . . 62 ASN C . 11190 1 660 . 1 1 62 62 ASN CA C 13 56.880 0.300 . 1 . . . . 62 ASN CA . 11190 1 661 . 1 1 62 62 ASN CB C 13 40.970 0.300 . 1 . . . . 62 ASN CB . 11190 1 662 . 1 1 62 62 ASN N N 15 117.975 0.300 . 1 . . . . 62 ASN N . 11190 1 663 . 1 1 62 62 ASN ND2 N 15 113.023 0.300 . 1 . . . . 62 ASN ND2 . 11190 1 664 . 1 1 63 63 GLY H H 1 7.117 0.030 . 1 . . . . 63 GLY H . 11190 1 665 . 1 1 63 63 GLY HA2 H 1 3.703 0.030 . 2 . . . . 63 GLY HA2 . 11190 1 666 . 1 1 63 63 GLY HA3 H 1 3.867 0.030 . 2 . . . . 63 GLY HA3 . 11190 1 667 . 1 1 63 63 GLY C C 13 176.752 0.300 . 1 . . . . 63 GLY C . 11190 1 668 . 1 1 63 63 GLY CA C 13 46.209 0.300 . 1 . . . . 63 GLY CA . 11190 1 669 . 1 1 63 63 GLY N N 15 103.310 0.300 . 1 . . . . 63 GLY N . 11190 1 670 . 1 1 64 64 HIS H H 1 8.382 0.030 . 1 . . . . 64 HIS H . 11190 1 671 . 1 1 64 64 HIS HA H 1 4.554 0.030 . 1 . . . . 64 HIS HA . 11190 1 672 . 1 1 64 64 HIS HB2 H 1 3.257 0.030 . 2 . . . . 64 HIS HB2 . 11190 1 673 . 1 1 64 64 HIS HB3 H 1 3.153 0.030 . 2 . . . . 64 HIS HB3 . 11190 1 674 . 1 1 64 64 HIS HD2 H 1 7.015 0.030 . 1 . . . . 64 HIS HD2 . 11190 1 675 . 1 1 64 64 HIS HE1 H 1 8.006 0.030 . 1 . . . . 64 HIS HE1 . 11190 1 676 . 1 1 64 64 HIS C C 13 174.190 0.300 . 1 . . . . 64 HIS C . 11190 1 677 . 1 1 64 64 HIS CA C 13 57.048 0.300 . 1 . . . . 64 HIS CA . 11190 1 678 . 1 1 64 64 HIS CB C 13 30.135 0.300 . 1 . . . . 64 HIS CB . 11190 1 679 . 1 1 64 64 HIS CD2 C 13 120.281 0.300 . 1 . . . . 64 HIS CD2 . 11190 1 680 . 1 1 64 64 HIS CE1 C 13 137.600 0.300 . 1 . . . . 64 HIS CE1 . 11190 1 681 . 1 1 64 64 HIS N N 15 117.641 0.300 . 1 . . . . 64 HIS N . 11190 1 682 . 1 1 65 65 ILE H H 1 7.948 0.030 . 1 . . . . 65 ILE H . 11190 1 683 . 1 1 65 65 ILE HA H 1 4.260 0.030 . 1 . . . . 65 ILE HA . 11190 1 684 . 1 1 65 65 ILE HB H 1 1.576 0.030 . 1 . . . . 65 ILE HB . 11190 1 685 . 1 1 65 65 ILE HD11 H 1 0.823 0.030 . 1 . . . . 65 ILE HD1 . 11190 1 686 . 1 1 65 65 ILE HD12 H 1 0.823 0.030 . 1 . . . . 65 ILE HD1 . 11190 1 687 . 1 1 65 65 ILE HD13 H 1 0.823 0.030 . 1 . . . . 65 ILE HD1 . 11190 1 688 . 1 1 65 65 ILE HG12 H 1 1.142 0.030 . 2 . . . . 65 ILE HG12 . 11190 1 689 . 1 1 65 65 ILE HG13 H 1 1.667 0.030 . 2 . . . . 65 ILE HG13 . 11190 1 690 . 1 1 65 65 ILE HG21 H 1 0.778 0.030 . 1 . . . . 65 ILE HG2 . 11190 1 691 . 1 1 65 65 ILE HG22 H 1 0.778 0.030 . 1 . . . . 65 ILE HG2 . 11190 1 692 . 1 1 65 65 ILE HG23 H 1 0.778 0.030 . 1 . . . . 65 ILE HG2 . 11190 1 693 . 1 1 65 65 ILE C C 13 174.699 0.300 . 1 . . . . 65 ILE C . 11190 1 694 . 1 1 65 65 ILE CA C 13 61.046 0.300 . 1 . . . . 65 ILE CA . 11190 1 695 . 1 1 65 65 ILE CB C 13 39.290 0.300 . 1 . . . . 65 ILE CB . 11190 1 696 . 1 1 65 65 ILE CD1 C 13 14.953 0.300 . 1 . . . . 65 ILE CD1 . 11190 1 697 . 1 1 65 65 ILE CG1 C 13 27.798 0.300 . 1 . . . . 65 ILE CG1 . 11190 1 698 . 1 1 65 65 ILE CG2 C 13 18.004 0.300 . 1 . . . . 65 ILE CG2 . 11190 1 699 . 1 1 65 65 ILE N N 15 118.936 0.300 . 1 . . . . 65 ILE N . 11190 1 700 . 1 1 66 66 GLN H H 1 8.620 0.030 . 1 . . . . 66 GLN H . 11190 1 701 . 1 1 66 66 GLN HA H 1 4.598 0.030 . 1 . . . . 66 GLN HA . 11190 1 702 . 1 1 66 66 GLN HB2 H 1 1.918 0.030 . 2 . . . . 66 GLN HB2 . 11190 1 703 . 1 1 66 66 GLN HB3 H 1 2.055 0.030 . 2 . . . . 66 GLN HB3 . 11190 1 704 . 1 1 66 66 GLN HE21 H 1 6.791 0.030 . 2 . . . . 66 GLN HE21 . 11190 1 705 . 1 1 66 66 GLN HE22 H 1 7.252 0.030 . 2 . . . . 66 GLN HE22 . 11190 1 706 . 1 1 66 66 GLN HG2 H 1 2.256 0.030 . 1 . . . . 66 GLN HG2 . 11190 1 707 . 1 1 66 66 GLN HG3 H 1 2.256 0.030 . 1 . . . . 66 GLN HG3 . 11190 1 708 . 1 1 66 66 GLN C C 13 175.137 0.300 . 1 . . . . 66 GLN C . 11190 1 709 . 1 1 66 66 GLN CA C 13 53.306 0.300 . 1 . . . . 66 GLN CA . 11190 1 710 . 1 1 66 66 GLN CB C 13 31.549 0.300 . 1 . . . . 66 GLN CB . 11190 1 711 . 1 1 66 66 GLN CG C 13 33.481 0.300 . 1 . . . . 66 GLN CG . 11190 1 712 . 1 1 66 66 GLN N N 15 126.376 0.300 . 1 . . . . 66 GLN N . 11190 1 713 . 1 1 66 66 GLN NE2 N 15 111.639 0.300 . 1 . . . . 66 GLN NE2 . 11190 1 714 . 1 1 67 67 VAL H H 1 8.370 0.030 . 1 . . . . 67 VAL H . 11190 1 715 . 1 1 67 67 VAL HA H 1 3.306 0.030 . 1 . . . . 67 VAL HA . 11190 1 716 . 1 1 67 67 VAL HB H 1 1.888 0.030 . 1 . . . . 67 VAL HB . 11190 1 717 . 1 1 67 67 VAL HG11 H 1 1.001 0.030 . 1 . . . . 67 VAL HG1 . 11190 1 718 . 1 1 67 67 VAL HG12 H 1 1.001 0.030 . 1 . . . . 67 VAL HG1 . 11190 1 719 . 1 1 67 67 VAL HG13 H 1 1.001 0.030 . 1 . . . . 67 VAL HG1 . 11190 1 720 . 1 1 67 67 VAL HG21 H 1 0.981 0.030 . 1 . . . . 67 VAL HG2 . 11190 1 721 . 1 1 67 67 VAL HG22 H 1 0.981 0.030 . 1 . . . . 67 VAL HG2 . 11190 1 722 . 1 1 67 67 VAL HG23 H 1 0.981 0.030 . 1 . . . . 67 VAL HG2 . 11190 1 723 . 1 1 67 67 VAL C C 13 177.630 0.300 . 1 . . . . 67 VAL C . 11190 1 724 . 1 1 67 67 VAL CA C 13 65.093 0.300 . 1 . . . . 67 VAL CA . 11190 1 725 . 1 1 67 67 VAL CB C 13 31.627 0.300 . 1 . . . . 67 VAL CB . 11190 1 726 . 1 1 67 67 VAL CG1 C 13 22.732 0.300 . 2 . . . . 67 VAL CG1 . 11190 1 727 . 1 1 67 67 VAL CG2 C 13 21.131 0.300 . 2 . . . . 67 VAL CG2 . 11190 1 728 . 1 1 67 67 VAL N N 15 120.411 0.300 . 1 . . . . 67 VAL N . 11190 1 729 . 1 1 68 68 ASN H H 1 9.429 0.030 . 1 . . . . 68 ASN H . 11190 1 730 . 1 1 68 68 ASN HA H 1 4.382 0.030 . 1 . . . . 68 ASN HA . 11190 1 731 . 1 1 68 68 ASN HB2 H 1 3.398 0.030 . 2 . . . . 68 ASN HB2 . 11190 1 732 . 1 1 68 68 ASN HB3 H 1 3.178 0.030 . 2 . . . . 68 ASN HB3 . 11190 1 733 . 1 1 68 68 ASN HD21 H 1 6.891 0.030 . 2 . . . . 68 ASN HD21 . 11190 1 734 . 1 1 68 68 ASN HD22 H 1 7.692 0.030 . 2 . . . . 68 ASN HD22 . 11190 1 735 . 1 1 68 68 ASN C C 13 174.892 0.300 . 1 . . . . 68 ASN C . 11190 1 736 . 1 1 68 68 ASN CA C 13 56.132 0.300 . 1 . . . . 68 ASN CA . 11190 1 737 . 1 1 68 68 ASN CB C 13 37.414 0.300 . 1 . . . . 68 ASN CB . 11190 1 738 . 1 1 68 68 ASN N N 15 119.863 0.300 . 1 . . . . 68 ASN N . 11190 1 739 . 1 1 68 68 ASN ND2 N 15 113.082 0.300 . 1 . . . . 68 ASN ND2 . 11190 1 740 . 1 1 69 69 ASP H H 1 8.128 0.030 . 1 . . . . 69 ASP H . 11190 1 741 . 1 1 69 69 ASP HA H 1 4.818 0.030 . 1 . . . . 69 ASP HA . 11190 1 742 . 1 1 69 69 ASP HB2 H 1 2.486 0.030 . 2 . . . . 69 ASP HB2 . 11190 1 743 . 1 1 69 69 ASP HB3 H 1 2.809 0.030 . 2 . . . . 69 ASP HB3 . 11190 1 744 . 1 1 69 69 ASP C C 13 174.857 0.300 . 1 . . . . 69 ASP C . 11190 1 745 . 1 1 69 69 ASP CA C 13 56.165 0.300 . 1 . . . . 69 ASP CA . 11190 1 746 . 1 1 69 69 ASP CB C 13 41.451 0.300 . 1 . . . . 69 ASP CB . 11190 1 747 . 1 1 69 69 ASP N N 15 122.040 0.300 . 1 . . . . 69 ASP N . 11190 1 748 . 1 1 70 70 LYS H H 1 8.841 0.030 . 1 . . . . 70 LYS H . 11190 1 749 . 1 1 70 70 LYS HA H 1 4.592 0.030 . 1 . . . . 70 LYS HA . 11190 1 750 . 1 1 70 70 LYS HB2 H 1 1.479 0.030 . 2 . . . . 70 LYS HB2 . 11190 1 751 . 1 1 70 70 LYS HB3 H 1 1.726 0.030 . 2 . . . . 70 LYS HB3 . 11190 1 752 . 1 1 70 70 LYS HD2 H 1 1.307 0.030 . 2 . . . . 70 LYS HD2 . 11190 1 753 . 1 1 70 70 LYS HD3 H 1 1.454 0.030 . 2 . . . . 70 LYS HD3 . 11190 1 754 . 1 1 70 70 LYS HE2 H 1 2.679 0.030 . 1 . . . . 70 LYS HE2 . 11190 1 755 . 1 1 70 70 LYS HE3 H 1 2.679 0.030 . 1 . . . . 70 LYS HE3 . 11190 1 756 . 1 1 70 70 LYS HG2 H 1 0.532 0.030 . 2 . . . . 70 LYS HG2 . 11190 1 757 . 1 1 70 70 LYS HG3 H 1 0.725 0.030 . 2 . . . . 70 LYS HG3 . 11190 1 758 . 1 1 70 70 LYS C C 13 176.629 0.300 . 1 . . . . 70 LYS C . 11190 1 759 . 1 1 70 70 LYS CA C 13 54.636 0.300 . 1 . . . . 70 LYS CA . 11190 1 760 . 1 1 70 70 LYS CB C 13 35.318 0.300 . 1 . . . . 70 LYS CB . 11190 1 761 . 1 1 70 70 LYS CD C 13 29.581 0.300 . 1 . . . . 70 LYS CD . 11190 1 762 . 1 1 70 70 LYS CE C 13 42.286 0.300 . 1 . . . . 70 LYS CE . 11190 1 763 . 1 1 70 70 LYS CG C 13 24.953 0.300 . 1 . . . . 70 LYS CG . 11190 1 764 . 1 1 70 70 LYS N N 15 123.591 0.300 . 1 . . . . 70 LYS N . 11190 1 765 . 1 1 71 71 ILE H H 1 8.716 0.030 . 1 . . . . 71 ILE H . 11190 1 766 . 1 1 71 71 ILE HA H 1 4.187 0.030 . 1 . . . . 71 ILE HA . 11190 1 767 . 1 1 71 71 ILE HB H 1 1.478 0.030 . 1 . . . . 71 ILE HB . 11190 1 768 . 1 1 71 71 ILE HD11 H 1 0.591 0.030 . 1 . . . . 71 ILE HD1 . 11190 1 769 . 1 1 71 71 ILE HD12 H 1 0.591 0.030 . 1 . . . . 71 ILE HD1 . 11190 1 770 . 1 1 71 71 ILE HD13 H 1 0.591 0.030 . 1 . . . . 71 ILE HD1 . 11190 1 771 . 1 1 71 71 ILE HG12 H 1 1.519 0.030 . 2 . . . . 71 ILE HG12 . 11190 1 772 . 1 1 71 71 ILE HG13 H 1 0.671 0.030 . 2 . . . . 71 ILE HG13 . 11190 1 773 . 1 1 71 71 ILE HG21 H 1 0.646 0.030 . 1 . . . . 71 ILE HG2 . 11190 1 774 . 1 1 71 71 ILE HG22 H 1 0.646 0.030 . 1 . . . . 71 ILE HG2 . 11190 1 775 . 1 1 71 71 ILE HG23 H 1 0.646 0.030 . 1 . . . . 71 ILE HG2 . 11190 1 776 . 1 1 71 71 ILE C C 13 175.015 0.300 . 1 . . . . 71 ILE C . 11190 1 777 . 1 1 71 71 ILE CA C 13 61.770 0.300 . 1 . . . . 71 ILE CA . 11190 1 778 . 1 1 71 71 ILE CB C 13 38.306 0.300 . 1 . . . . 71 ILE CB . 11190 1 779 . 1 1 71 71 ILE CD1 C 13 13.496 0.300 . 1 . . . . 71 ILE CD1 . 11190 1 780 . 1 1 71 71 ILE CG1 C 13 27.391 0.300 . 1 . . . . 71 ILE CG1 . 11190 1 781 . 1 1 71 71 ILE CG2 C 13 18.202 0.300 . 1 . . . . 71 ILE CG2 . 11190 1 782 . 1 1 71 71 ILE N N 15 126.111 0.300 . 1 . . . . 71 ILE N . 11190 1 783 . 1 1 72 72 VAL H H 1 8.578 0.030 . 1 . . . . 72 VAL H . 11190 1 784 . 1 1 72 72 VAL HA H 1 4.393 0.030 . 1 . . . . 72 VAL HA . 11190 1 785 . 1 1 72 72 VAL HB H 1 2.053 0.030 . 1 . . . . 72 VAL HB . 11190 1 786 . 1 1 72 72 VAL HG11 H 1 0.730 0.030 . 1 . . . . 72 VAL HG1 . 11190 1 787 . 1 1 72 72 VAL HG12 H 1 0.730 0.030 . 1 . . . . 72 VAL HG1 . 11190 1 788 . 1 1 72 72 VAL HG13 H 1 0.730 0.030 . 1 . . . . 72 VAL HG1 . 11190 1 789 . 1 1 72 72 VAL HG21 H 1 0.638 0.030 . 1 . . . . 72 VAL HG2 . 11190 1 790 . 1 1 72 72 VAL HG22 H 1 0.638 0.030 . 1 . . . . 72 VAL HG2 . 11190 1 791 . 1 1 72 72 VAL HG23 H 1 0.638 0.030 . 1 . . . . 72 VAL HG2 . 11190 1 792 . 1 1 72 72 VAL C C 13 176.085 0.300 . 1 . . . . 72 VAL C . 11190 1 793 . 1 1 72 72 VAL CA C 13 61.471 0.300 . 1 . . . . 72 VAL CA . 11190 1 794 . 1 1 72 72 VAL CB C 13 33.238 0.300 . 1 . . . . 72 VAL CB . 11190 1 795 . 1 1 72 72 VAL CG1 C 13 21.790 0.300 . 2 . . . . 72 VAL CG1 . 11190 1 796 . 1 1 72 72 VAL CG2 C 13 19.564 0.300 . 2 . . . . 72 VAL CG2 . 11190 1 797 . 1 1 72 72 VAL N N 15 118.554 0.300 . 1 . . . . 72 VAL N . 11190 1 798 . 1 1 73 73 ALA H H 1 7.705 0.030 . 1 . . . . 73 ALA H . 11190 1 799 . 1 1 73 73 ALA HA H 1 5.145 0.030 . 1 . . . . 73 ALA HA . 11190 1 800 . 1 1 73 73 ALA HB1 H 1 1.095 0.030 . 1 . . . . 73 ALA HB . 11190 1 801 . 1 1 73 73 ALA HB2 H 1 1.095 0.030 . 1 . . . . 73 ALA HB . 11190 1 802 . 1 1 73 73 ALA HB3 H 1 1.095 0.030 . 1 . . . . 73 ALA HB . 11190 1 803 . 1 1 73 73 ALA C C 13 175.418 0.300 . 1 . . . . 73 ALA C . 11190 1 804 . 1 1 73 73 ALA CA C 13 52.349 0.300 . 1 . . . . 73 ALA CA . 11190 1 805 . 1 1 73 73 ALA CB C 13 22.071 0.300 . 1 . . . . 73 ALA CB . 11190 1 806 . 1 1 73 73 ALA N N 15 122.150 0.300 . 1 . . . . 73 ALA N . 11190 1 807 . 1 1 74 74 VAL H H 1 8.093 0.030 . 1 . . . . 74 VAL H . 11190 1 808 . 1 1 74 74 VAL HA H 1 4.576 0.030 . 1 . . . . 74 VAL HA . 11190 1 809 . 1 1 74 74 VAL HB H 1 1.744 0.030 . 1 . . . . 74 VAL HB . 11190 1 810 . 1 1 74 74 VAL HG11 H 1 0.739 0.030 . 1 . . . . 74 VAL HG1 . 11190 1 811 . 1 1 74 74 VAL HG12 H 1 0.739 0.030 . 1 . . . . 74 VAL HG1 . 11190 1 812 . 1 1 74 74 VAL HG13 H 1 0.739 0.030 . 1 . . . . 74 VAL HG1 . 11190 1 813 . 1 1 74 74 VAL HG21 H 1 0.670 0.030 . 1 . . . . 74 VAL HG2 . 11190 1 814 . 1 1 74 74 VAL HG22 H 1 0.670 0.030 . 1 . . . . 74 VAL HG2 . 11190 1 815 . 1 1 74 74 VAL HG23 H 1 0.670 0.030 . 1 . . . . 74 VAL HG2 . 11190 1 816 . 1 1 74 74 VAL C C 13 175.945 0.300 . 1 . . . . 74 VAL C . 11190 1 817 . 1 1 74 74 VAL CA C 13 60.928 0.300 . 1 . . . . 74 VAL CA . 11190 1 818 . 1 1 74 74 VAL CB C 13 34.235 0.300 . 1 . . . . 74 VAL CB . 11190 1 819 . 1 1 74 74 VAL CG1 C 13 20.559 0.300 . 2 . . . . 74 VAL CG1 . 11190 1 820 . 1 1 74 74 VAL CG2 C 13 20.328 0.300 . 2 . . . . 74 VAL CG2 . 11190 1 821 . 1 1 74 74 VAL N N 15 118.711 0.300 . 1 . . . . 74 VAL N . 11190 1 822 . 1 1 75 75 ASP H H 1 10.353 0.030 . 1 . . . . 75 ASP H . 11190 1 823 . 1 1 75 75 ASP HA H 1 4.498 0.030 . 1 . . . . 75 ASP HA . 11190 1 824 . 1 1 75 75 ASP HB2 H 1 3.006 0.030 . 2 . . . . 75 ASP HB2 . 11190 1 825 . 1 1 75 75 ASP HB3 H 1 2.669 0.030 . 2 . . . . 75 ASP HB3 . 11190 1 826 . 1 1 75 75 ASP C C 13 175.787 0.300 . 1 . . . . 75 ASP C . 11190 1 827 . 1 1 75 75 ASP CA C 13 56.187 0.300 . 1 . . . . 75 ASP CA . 11190 1 828 . 1 1 75 75 ASP CB C 13 39.588 0.300 . 1 . . . . 75 ASP CB . 11190 1 829 . 1 1 75 75 ASP N N 15 129.702 0.300 . 1 . . . . 75 ASP N . 11190 1 830 . 1 1 76 76 GLY H H 1 8.582 0.030 . 1 . . . . 76 GLY H . 11190 1 831 . 1 1 76 76 GLY HA2 H 1 3.506 0.030 . 2 . . . . 76 GLY HA2 . 11190 1 832 . 1 1 76 76 GLY HA3 H 1 4.060 0.030 . 2 . . . . 76 GLY HA3 . 11190 1 833 . 1 1 76 76 GLY C C 13 173.979 0.300 . 1 . . . . 76 GLY C . 11190 1 834 . 1 1 76 76 GLY CA C 13 45.106 0.300 . 1 . . . . 76 GLY CA . 11190 1 835 . 1 1 76 76 GLY N N 15 102.682 0.300 . 1 . . . . 76 GLY N . 11190 1 836 . 1 1 77 77 VAL H H 1 7.997 0.030 . 1 . . . . 77 VAL H . 11190 1 837 . 1 1 77 77 VAL HA H 1 3.971 0.030 . 1 . . . . 77 VAL HA . 11190 1 838 . 1 1 77 77 VAL HB H 1 2.177 0.030 . 1 . . . . 77 VAL HB . 11190 1 839 . 1 1 77 77 VAL HG11 H 1 0.859 0.030 . 1 . . . . 77 VAL HG1 . 11190 1 840 . 1 1 77 77 VAL HG12 H 1 0.859 0.030 . 1 . . . . 77 VAL HG1 . 11190 1 841 . 1 1 77 77 VAL HG13 H 1 0.859 0.030 . 1 . . . . 77 VAL HG1 . 11190 1 842 . 1 1 77 77 VAL HG21 H 1 0.953 0.030 . 1 . . . . 77 VAL HG2 . 11190 1 843 . 1 1 77 77 VAL HG22 H 1 0.953 0.030 . 1 . . . . 77 VAL HG2 . 11190 1 844 . 1 1 77 77 VAL HG23 H 1 0.953 0.030 . 1 . . . . 77 VAL HG2 . 11190 1 845 . 1 1 77 77 VAL C C 13 175.137 0.300 . 1 . . . . 77 VAL C . 11190 1 846 . 1 1 77 77 VAL CA C 13 61.864 0.300 . 1 . . . . 77 VAL CA . 11190 1 847 . 1 1 77 77 VAL CB C 13 32.633 0.300 . 1 . . . . 77 VAL CB . 11190 1 848 . 1 1 77 77 VAL CG1 C 13 20.720 0.300 . 2 . . . . 77 VAL CG1 . 11190 1 849 . 1 1 77 77 VAL CG2 C 13 21.286 0.300 . 2 . . . . 77 VAL CG2 . 11190 1 850 . 1 1 77 77 VAL N N 15 123.894 0.300 . 1 . . . . 77 VAL N . 11190 1 851 . 1 1 78 78 ASN H H 1 8.646 0.030 . 1 . . . . 78 ASN H . 11190 1 852 . 1 1 78 78 ASN HA H 1 4.655 0.030 . 1 . . . . 78 ASN HA . 11190 1 853 . 1 1 78 78 ASN HB2 H 1 2.792 0.030 . 2 . . . . 78 ASN HB2 . 11190 1 854 . 1 1 78 78 ASN HB3 H 1 2.869 0.030 . 2 . . . . 78 ASN HB3 . 11190 1 855 . 1 1 78 78 ASN HD21 H 1 6.926 0.030 . 2 . . . . 78 ASN HD21 . 11190 1 856 . 1 1 78 78 ASN HD22 H 1 7.615 0.030 . 2 . . . . 78 ASN HD22 . 11190 1 857 . 1 1 78 78 ASN C C 13 176.691 0.300 . 1 . . . . 78 ASN C . 11190 1 858 . 1 1 78 78 ASN CA C 13 53.586 0.300 . 1 . . . . 78 ASN CA . 11190 1 859 . 1 1 78 78 ASN CB C 13 38.447 0.300 . 1 . . . . 78 ASN CB . 11190 1 860 . 1 1 78 78 ASN N N 15 125.982 0.300 . 1 . . . . 78 ASN N . 11190 1 861 . 1 1 78 78 ASN ND2 N 15 111.933 0.300 . 1 . . . . 78 ASN ND2 . 11190 1 862 . 1 1 79 79 ILE H H 1 7.495 0.030 . 1 . . . . 79 ILE H . 11190 1 863 . 1 1 79 79 ILE HA H 1 3.490 0.030 . 1 . . . . 79 ILE HA . 11190 1 864 . 1 1 79 79 ILE HB H 1 1.635 0.030 . 1 . . . . 79 ILE HB . 11190 1 865 . 1 1 79 79 ILE HD11 H 1 0.593 0.030 . 1 . . . . 79 ILE HD1 . 11190 1 866 . 1 1 79 79 ILE HD12 H 1 0.593 0.030 . 1 . . . . 79 ILE HD1 . 11190 1 867 . 1 1 79 79 ILE HD13 H 1 0.593 0.030 . 1 . . . . 79 ILE HD1 . 11190 1 868 . 1 1 79 79 ILE HG12 H 1 0.469 0.030 . 2 . . . . 79 ILE HG12 . 11190 1 869 . 1 1 79 79 ILE HG13 H 1 0.871 0.030 . 2 . . . . 79 ILE HG13 . 11190 1 870 . 1 1 79 79 ILE HG21 H 1 0.388 0.030 . 1 . . . . 79 ILE HG2 . 11190 1 871 . 1 1 79 79 ILE HG22 H 1 0.388 0.030 . 1 . . . . 79 ILE HG2 . 11190 1 872 . 1 1 79 79 ILE HG23 H 1 0.388 0.030 . 1 . . . . 79 ILE HG2 . 11190 1 873 . 1 1 79 79 ILE C C 13 176.787 0.300 . 1 . . . . 79 ILE C . 11190 1 874 . 1 1 79 79 ILE CA C 13 60.106 0.300 . 1 . . . . 79 ILE CA . 11190 1 875 . 1 1 79 79 ILE CB C 13 37.693 0.300 . 1 . . . . 79 ILE CB . 11190 1 876 . 1 1 79 79 ILE CD1 C 13 15.229 0.300 . 1 . . . . 79 ILE CD1 . 11190 1 877 . 1 1 79 79 ILE CG1 C 13 27.096 0.300 . 1 . . . . 79 ILE CG1 . 11190 1 878 . 1 1 79 79 ILE CG2 C 13 17.449 0.300 . 1 . . . . 79 ILE CG2 . 11190 1 879 . 1 1 79 79 ILE N N 15 118.820 0.300 . 1 . . . . 79 ILE N . 11190 1 880 . 1 1 80 80 GLN H H 1 8.294 0.030 . 1 . . . . 80 GLN H . 11190 1 881 . 1 1 80 80 GLN HA H 1 4.087 0.030 . 1 . . . . 80 GLN HA . 11190 1 882 . 1 1 80 80 GLN HB2 H 1 2.205 0.030 . 2 . . . . 80 GLN HB2 . 11190 1 883 . 1 1 80 80 GLN HB3 H 1 2.028 0.030 . 2 . . . . 80 GLN HB3 . 11190 1 884 . 1 1 80 80 GLN HE21 H 1 6.904 0.030 . 2 . . . . 80 GLN HE21 . 11190 1 885 . 1 1 80 80 GLN HE22 H 1 7.549 0.030 . 2 . . . . 80 GLN HE22 . 11190 1 886 . 1 1 80 80 GLN HG2 H 1 2.283 0.030 . 2 . . . . 80 GLN HG2 . 11190 1 887 . 1 1 80 80 GLN HG3 H 1 2.555 0.030 . 2 . . . . 80 GLN HG3 . 11190 1 888 . 1 1 80 80 GLN C C 13 177.226 0.300 . 1 . . . . 80 GLN C . 11190 1 889 . 1 1 80 80 GLN CA C 13 58.668 0.300 . 1 . . . . 80 GLN CA . 11190 1 890 . 1 1 80 80 GLN CB C 13 28.745 0.300 . 1 . . . . 80 GLN CB . 11190 1 891 . 1 1 80 80 GLN CG C 13 34.738 0.300 . 1 . . . . 80 GLN CG . 11190 1 892 . 1 1 80 80 GLN N N 15 123.317 0.300 . 1 . . . . 80 GLN N . 11190 1 893 . 1 1 80 80 GLN NE2 N 15 112.333 0.300 . 1 . . . . 80 GLN NE2 . 11190 1 894 . 1 1 81 81 GLY H H 1 8.822 0.030 . 1 . . . . 81 GLY H . 11190 1 895 . 1 1 81 81 GLY HA2 H 1 4.049 0.030 . 2 . . . . 81 GLY HA2 . 11190 1 896 . 1 1 81 81 GLY HA3 H 1 3.948 0.030 . 2 . . . . 81 GLY HA3 . 11190 1 897 . 1 1 81 81 GLY C C 13 174.558 0.300 . 1 . . . . 81 GLY C . 11190 1 898 . 1 1 81 81 GLY CA C 13 45.107 0.300 . 1 . . . . 81 GLY CA . 11190 1 899 . 1 1 81 81 GLY N N 15 111.483 0.300 . 1 . . . . 81 GLY N . 11190 1 900 . 1 1 82 82 PHE H H 1 8.055 0.030 . 1 . . . . 82 PHE H . 11190 1 901 . 1 1 82 82 PHE HA H 1 4.587 0.030 . 1 . . . . 82 PHE HA . 11190 1 902 . 1 1 82 82 PHE HB2 H 1 3.335 0.030 . 2 . . . . 82 PHE HB2 . 11190 1 903 . 1 1 82 82 PHE HB3 H 1 3.036 0.030 . 2 . . . . 82 PHE HB3 . 11190 1 904 . 1 1 82 82 PHE HD1 H 1 6.945 0.030 . 1 . . . . 82 PHE HD1 . 11190 1 905 . 1 1 82 82 PHE HD2 H 1 6.945 0.030 . 1 . . . . 82 PHE HD2 . 11190 1 906 . 1 1 82 82 PHE HE1 H 1 7.295 0.030 . 1 . . . . 82 PHE HE1 . 11190 1 907 . 1 1 82 82 PHE HE2 H 1 7.295 0.030 . 1 . . . . 82 PHE HE2 . 11190 1 908 . 1 1 82 82 PHE HZ H 1 7.219 0.030 . 1 . . . . 82 PHE HZ . 11190 1 909 . 1 1 82 82 PHE C C 13 176.155 0.300 . 1 . . . . 82 PHE C . 11190 1 910 . 1 1 82 82 PHE CA C 13 56.487 0.300 . 1 . . . . 82 PHE CA . 11190 1 911 . 1 1 82 82 PHE CB C 13 39.096 0.300 . 1 . . . . 82 PHE CB . 11190 1 912 . 1 1 82 82 PHE CD1 C 13 129.340 0.300 . 1 . . . . 82 PHE CD1 . 11190 1 913 . 1 1 82 82 PHE CD2 C 13 129.340 0.300 . 1 . . . . 82 PHE CD2 . 11190 1 914 . 1 1 82 82 PHE CE1 C 13 131.679 0.300 . 1 . . . . 82 PHE CE1 . 11190 1 915 . 1 1 82 82 PHE CE2 C 13 131.679 0.300 . 1 . . . . 82 PHE CE2 . 11190 1 916 . 1 1 82 82 PHE CZ C 13 129.633 0.300 . 1 . . . . 82 PHE CZ . 11190 1 917 . 1 1 82 82 PHE N N 15 122.087 0.300 . 1 . . . . 82 PHE N . 11190 1 918 . 1 1 83 83 ALA H H 1 8.964 0.030 . 1 . . . . 83 ALA H . 11190 1 919 . 1 1 83 83 ALA HA H 1 4.419 0.030 . 1 . . . . 83 ALA HA . 11190 1 920 . 1 1 83 83 ALA HB1 H 1 1.349 0.030 . 1 . . . . 83 ALA HB . 11190 1 921 . 1 1 83 83 ALA HB2 H 1 1.349 0.030 . 1 . . . . 83 ALA HB . 11190 1 922 . 1 1 83 83 ALA HB3 H 1 1.349 0.030 . 1 . . . . 83 ALA HB . 11190 1 923 . 1 1 83 83 ALA C C 13 179.306 0.300 . 1 . . . . 83 ALA C . 11190 1 924 . 1 1 83 83 ALA CA C 13 51.270 0.300 . 1 . . . . 83 ALA CA . 11190 1 925 . 1 1 83 83 ALA CB C 13 19.204 0.300 . 1 . . . . 83 ALA CB . 11190 1 926 . 1 1 83 83 ALA N N 15 123.383 0.300 . 1 . . . . 83 ALA N . 11190 1 927 . 1 1 84 84 ASN H H 1 9.014 0.030 . 1 . . . . 84 ASN H . 11190 1 928 . 1 1 84 84 ASN HA H 1 4.105 0.030 . 1 . . . . 84 ASN HA . 11190 1 929 . 1 1 84 84 ASN HB2 H 1 2.776 0.030 . 1 . . . . 84 ASN HB2 . 11190 1 930 . 1 1 84 84 ASN HB3 H 1 2.776 0.030 . 1 . . . . 84 ASN HB3 . 11190 1 931 . 1 1 84 84 ASN HD21 H 1 6.556 0.030 . 2 . . . . 84 ASN HD21 . 11190 1 932 . 1 1 84 84 ASN HD22 H 1 7.498 0.030 . 2 . . . . 84 ASN HD22 . 11190 1 933 . 1 1 84 84 ASN CA C 13 57.579 0.300 . 1 . . . . 84 ASN CA . 11190 1 934 . 1 1 84 84 ASN CB C 13 38.192 0.300 . 1 . . . . 84 ASN CB . 11190 1 935 . 1 1 84 84 ASN N N 15 121.673 0.300 . 1 . . . . 84 ASN N . 11190 1 936 . 1 1 84 84 ASN ND2 N 15 109.923 0.300 . 1 . . . . 84 ASN ND2 . 11190 1 937 . 1 1 85 85 HIS H H 1 8.464 0.030 . 1 . . . . 85 HIS H . 11190 1 938 . 1 1 85 85 HIS HA H 1 4.296 0.030 . 1 . . . . 85 HIS HA . 11190 1 939 . 1 1 85 85 HIS HB2 H 1 3.073 0.030 . 2 . . . . 85 HIS HB2 . 11190 1 940 . 1 1 85 85 HIS HB3 H 1 3.228 0.030 . 2 . . . . 85 HIS HB3 . 11190 1 941 . 1 1 85 85 HIS HD2 H 1 7.029 0.030 . 1 . . . . 85 HIS HD2 . 11190 1 942 . 1 1 85 85 HIS HE1 H 1 7.822 0.030 . 1 . . . . 85 HIS HE1 . 11190 1 943 . 1 1 85 85 HIS C C 13 177.296 0.300 . 1 . . . . 85 HIS C . 11190 1 944 . 1 1 85 85 HIS CA C 13 59.183 0.300 . 1 . . . . 85 HIS CA . 11190 1 945 . 1 1 85 85 HIS CB C 13 29.653 0.300 . 1 . . . . 85 HIS CB . 11190 1 946 . 1 1 85 85 HIS CD2 C 13 119.720 0.300 . 1 . . . . 85 HIS CD2 . 11190 1 947 . 1 1 85 85 HIS CE1 C 13 138.471 0.300 . 1 . . . . 85 HIS CE1 . 11190 1 948 . 1 1 86 86 ASP H H 1 6.873 0.030 . 1 . . . . 86 ASP H . 11190 1 949 . 1 1 86 86 ASP HA H 1 4.566 0.030 . 1 . . . . 86 ASP HA . 11190 1 950 . 1 1 86 86 ASP HB2 H 1 2.544 0.030 . 2 . . . . 86 ASP HB2 . 11190 1 951 . 1 1 86 86 ASP HB3 H 1 2.785 0.030 . 2 . . . . 86 ASP HB3 . 11190 1 952 . 1 1 86 86 ASP C C 13 178.858 0.300 . 1 . . . . 86 ASP C . 11190 1 953 . 1 1 86 86 ASP CA C 13 56.828 0.300 . 1 . . . . 86 ASP CA . 11190 1 954 . 1 1 86 86 ASP CB C 13 40.522 0.300 . 1 . . . . 86 ASP CB . 11190 1 955 . 1 1 86 86 ASP N N 15 119.247 0.300 . 1 . . . . 86 ASP N . 11190 1 956 . 1 1 87 87 VAL H H 1 7.856 0.030 . 1 . . . . 87 VAL H . 11190 1 957 . 1 1 87 87 VAL HA H 1 3.608 0.030 . 1 . . . . 87 VAL HA . 11190 1 958 . 1 1 87 87 VAL HB H 1 2.217 0.030 . 1 . . . . 87 VAL HB . 11190 1 959 . 1 1 87 87 VAL HG11 H 1 0.824 0.030 . 1 . . . . 87 VAL HG1 . 11190 1 960 . 1 1 87 87 VAL HG12 H 1 0.824 0.030 . 1 . . . . 87 VAL HG1 . 11190 1 961 . 1 1 87 87 VAL HG13 H 1 0.824 0.030 . 1 . . . . 87 VAL HG1 . 11190 1 962 . 1 1 87 87 VAL HG21 H 1 1.092 0.030 . 1 . . . . 87 VAL HG2 . 11190 1 963 . 1 1 87 87 VAL HG22 H 1 1.092 0.030 . 1 . . . . 87 VAL HG2 . 11190 1 964 . 1 1 87 87 VAL HG23 H 1 1.092 0.030 . 1 . . . . 87 VAL HG2 . 11190 1 965 . 1 1 87 87 VAL C C 13 177.156 0.300 . 1 . . . . 87 VAL C . 11190 1 966 . 1 1 87 87 VAL CA C 13 66.778 0.300 . 1 . . . . 87 VAL CA . 11190 1 967 . 1 1 87 87 VAL CB C 13 31.088 0.300 . 1 . . . . 87 VAL CB . 11190 1 968 . 1 1 87 87 VAL CG1 C 13 21.659 0.300 . 2 . . . . 87 VAL CG1 . 11190 1 969 . 1 1 87 87 VAL CG2 C 13 24.385 0.300 . 2 . . . . 87 VAL CG2 . 11190 1 970 . 1 1 87 87 VAL N N 15 121.762 0.300 . 1 . . . . 87 VAL N . 11190 1 971 . 1 1 88 88 VAL H H 1 8.170 0.030 . 1 . . . . 88 VAL H . 11190 1 972 . 1 1 88 88 VAL HA H 1 3.478 0.030 . 1 . . . . 88 VAL HA . 11190 1 973 . 1 1 88 88 VAL HB H 1 2.206 0.030 . 1 . . . . 88 VAL HB . 11190 1 974 . 1 1 88 88 VAL HG11 H 1 0.976 0.030 . 1 . . . . 88 VAL HG1 . 11190 1 975 . 1 1 88 88 VAL HG12 H 1 0.976 0.030 . 1 . . . . 88 VAL HG1 . 11190 1 976 . 1 1 88 88 VAL HG13 H 1 0.976 0.030 . 1 . . . . 88 VAL HG1 . 11190 1 977 . 1 1 88 88 VAL HG21 H 1 1.099 0.030 . 1 . . . . 88 VAL HG2 . 11190 1 978 . 1 1 88 88 VAL HG22 H 1 1.099 0.030 . 1 . . . . 88 VAL HG2 . 11190 1 979 . 1 1 88 88 VAL HG23 H 1 1.099 0.030 . 1 . . . . 88 VAL HG2 . 11190 1 980 . 1 1 88 88 VAL C C 13 178.946 0.300 . 1 . . . . 88 VAL C . 11190 1 981 . 1 1 88 88 VAL CA C 13 67.342 0.300 . 1 . . . . 88 VAL CA . 11190 1 982 . 1 1 88 88 VAL CB C 13 31.635 0.300 . 1 . . . . 88 VAL CB . 11190 1 983 . 1 1 88 88 VAL CG1 C 13 21.191 0.300 . 2 . . . . 88 VAL CG1 . 11190 1 984 . 1 1 88 88 VAL CG2 C 13 23.067 0.300 . 2 . . . . 88 VAL CG2 . 11190 1 985 . 1 1 88 88 VAL N N 15 120.294 0.300 . 1 . . . . 88 VAL N . 11190 1 986 . 1 1 89 89 GLU H H 1 7.434 0.030 . 1 . . . . 89 GLU H . 11190 1 987 . 1 1 89 89 GLU HA H 1 4.154 0.030 . 1 . . . . 89 GLU HA . 11190 1 988 . 1 1 89 89 GLU HB2 H 1 2.129 0.030 . 1 . . . . 89 GLU HB2 . 11190 1 989 . 1 1 89 89 GLU HB3 H 1 2.129 0.030 . 1 . . . . 89 GLU HB3 . 11190 1 990 . 1 1 89 89 GLU HG2 H 1 2.287 0.030 . 1 . . . . 89 GLU HG2 . 11190 1 991 . 1 1 89 89 GLU HG3 H 1 2.287 0.030 . 1 . . . . 89 GLU HG3 . 11190 1 992 . 1 1 89 89 GLU C C 13 178.192 0.300 . 1 . . . . 89 GLU C . 11190 1 993 . 1 1 89 89 GLU CA C 13 59.077 0.300 . 1 . . . . 89 GLU CA . 11190 1 994 . 1 1 89 89 GLU CB C 13 29.429 0.300 . 1 . . . . 89 GLU CB . 11190 1 995 . 1 1 89 89 GLU CG C 13 35.755 0.300 . 1 . . . . 89 GLU CG . 11190 1 996 . 1 1 89 89 GLU N N 15 118.663 0.300 . 1 . . . . 89 GLU N . 11190 1 997 . 1 1 90 90 VAL H H 1 7.826 0.030 . 1 . . . . 90 VAL H . 11190 1 998 . 1 1 90 90 VAL HA H 1 3.796 0.030 . 1 . . . . 90 VAL HA . 11190 1 999 . 1 1 90 90 VAL HB H 1 2.322 0.030 . 1 . . . . 90 VAL HB . 11190 1 1000 . 1 1 90 90 VAL HG11 H 1 0.962 0.030 . 1 . . . . 90 VAL HG1 . 11190 1 1001 . 1 1 90 90 VAL HG12 H 1 0.962 0.030 . 1 . . . . 90 VAL HG1 . 11190 1 1002 . 1 1 90 90 VAL HG13 H 1 0.962 0.030 . 1 . . . . 90 VAL HG1 . 11190 1 1003 . 1 1 90 90 VAL HG21 H 1 1.180 0.030 . 1 . . . . 90 VAL HG2 . 11190 1 1004 . 1 1 90 90 VAL HG22 H 1 1.180 0.030 . 1 . . . . 90 VAL HG2 . 11190 1 1005 . 1 1 90 90 VAL HG23 H 1 1.180 0.030 . 1 . . . . 90 VAL HG2 . 11190 1 1006 . 1 1 90 90 VAL C C 13 179.227 0.300 . 1 . . . . 90 VAL C . 11190 1 1007 . 1 1 90 90 VAL CA C 13 66.358 0.300 . 1 . . . . 90 VAL CA . 11190 1 1008 . 1 1 90 90 VAL CB C 13 31.589 0.300 . 1 . . . . 90 VAL CB . 11190 1 1009 . 1 1 90 90 VAL CG1 C 13 21.400 0.300 . 2 . . . . 90 VAL CG1 . 11190 1 1010 . 1 1 90 90 VAL CG2 C 13 22.809 0.300 . 2 . . . . 90 VAL CG2 . 11190 1 1011 . 1 1 90 90 VAL N N 15 120.570 0.300 . 1 . . . . 90 VAL N . 11190 1 1012 . 1 1 91 91 LEU H H 1 8.114 0.030 . 1 . . . . 91 LEU H . 11190 1 1013 . 1 1 91 91 LEU HA H 1 3.984 0.030 . 1 . . . . 91 LEU HA . 11190 1 1014 . 1 1 91 91 LEU HB2 H 1 1.976 0.030 . 2 . . . . 91 LEU HB2 . 11190 1 1015 . 1 1 91 91 LEU HB3 H 1 1.510 0.030 . 2 . . . . 91 LEU HB3 . 11190 1 1016 . 1 1 91 91 LEU HD11 H 1 0.751 0.030 . 1 . . . . 91 LEU HD1 . 11190 1 1017 . 1 1 91 91 LEU HD12 H 1 0.751 0.030 . 1 . . . . 91 LEU HD1 . 11190 1 1018 . 1 1 91 91 LEU HD13 H 1 0.751 0.030 . 1 . . . . 91 LEU HD1 . 11190 1 1019 . 1 1 91 91 LEU HD21 H 1 0.700 0.030 . 1 . . . . 91 LEU HD2 . 11190 1 1020 . 1 1 91 91 LEU HD22 H 1 0.700 0.030 . 1 . . . . 91 LEU HD2 . 11190 1 1021 . 1 1 91 91 LEU HD23 H 1 0.700 0.030 . 1 . . . . 91 LEU HD2 . 11190 1 1022 . 1 1 91 91 LEU HG H 1 1.804 0.030 . 1 . . . . 91 LEU HG . 11190 1 1023 . 1 1 91 91 LEU C C 13 179.174 0.300 . 1 . . . . 91 LEU C . 11190 1 1024 . 1 1 91 91 LEU CA C 13 57.761 0.300 . 1 . . . . 91 LEU CA . 11190 1 1025 . 1 1 91 91 LEU CB C 13 40.871 0.300 . 1 . . . . 91 LEU CB . 11190 1 1026 . 1 1 91 91 LEU CD1 C 13 25.670 0.300 . 2 . . . . 91 LEU CD1 . 11190 1 1027 . 1 1 91 91 LEU CD2 C 13 22.447 0.300 . 2 . . . . 91 LEU CD2 . 11190 1 1028 . 1 1 91 91 LEU CG C 13 26.841 0.300 . 1 . . . . 91 LEU CG . 11190 1 1029 . 1 1 91 91 LEU N N 15 118.098 0.300 . 1 . . . . 91 LEU N . 11190 1 1030 . 1 1 92 92 ARG H H 1 8.280 0.030 . 1 . . . . 92 ARG H . 11190 1 1031 . 1 1 92 92 ARG HA H 1 4.098 0.030 . 1 . . . . 92 ARG HA . 11190 1 1032 . 1 1 92 92 ARG HB2 H 1 1.942 0.030 . 1 . . . . 92 ARG HB2 . 11190 1 1033 . 1 1 92 92 ARG HB3 H 1 1.942 0.030 . 1 . . . . 92 ARG HB3 . 11190 1 1034 . 1 1 92 92 ARG HD2 H 1 3.165 0.030 . 2 . . . . 92 ARG HD2 . 11190 1 1035 . 1 1 92 92 ARG HD3 H 1 3.253 0.030 . 2 . . . . 92 ARG HD3 . 11190 1 1036 . 1 1 92 92 ARG HG2 H 1 1.677 0.030 . 2 . . . . 92 ARG HG2 . 11190 1 1037 . 1 1 92 92 ARG HG3 H 1 1.762 0.030 . 2 . . . . 92 ARG HG3 . 11190 1 1038 . 1 1 92 92 ARG C C 13 177.805 0.300 . 1 . . . . 92 ARG C . 11190 1 1039 . 1 1 92 92 ARG CA C 13 59.093 0.300 . 1 . . . . 92 ARG CA . 11190 1 1040 . 1 1 92 92 ARG CB C 13 30.601 0.300 . 1 . . . . 92 ARG CB . 11190 1 1041 . 1 1 92 92 ARG CD C 13 43.548 0.300 . 1 . . . . 92 ARG CD . 11190 1 1042 . 1 1 92 92 ARG CG C 13 27.427 0.300 . 1 . . . . 92 ARG CG . 11190 1 1043 . 1 1 92 92 ARG N N 15 120.171 0.300 . 1 . . . . 92 ARG N . 11190 1 1044 . 1 1 93 93 ASN H H 1 7.782 0.030 . 1 . . . . 93 ASN H . 11190 1 1045 . 1 1 93 93 ASN HA H 1 4.760 0.030 . 1 . . . . 93 ASN HA . 11190 1 1046 . 1 1 93 93 ASN HB2 H 1 2.697 0.030 . 2 . . . . 93 ASN HB2 . 11190 1 1047 . 1 1 93 93 ASN HB3 H 1 2.992 0.030 . 2 . . . . 93 ASN HB3 . 11190 1 1048 . 1 1 93 93 ASN HD21 H 1 7.592 0.030 . 2 . . . . 93 ASN HD21 . 11190 1 1049 . 1 1 93 93 ASN HD22 H 1 6.894 0.030 . 2 . . . . 93 ASN HD22 . 11190 1 1050 . 1 1 93 93 ASN C C 13 174.470 0.300 . 1 . . . . 93 ASN C . 11190 1 1051 . 1 1 93 93 ASN CA C 13 53.123 0.300 . 1 . . . . 93 ASN CA . 11190 1 1052 . 1 1 93 93 ASN CB C 13 39.250 0.300 . 1 . . . . 93 ASN CB . 11190 1 1053 . 1 1 93 93 ASN N N 15 115.111 0.300 . 1 . . . . 93 ASN N . 11190 1 1054 . 1 1 93 93 ASN ND2 N 15 113.914 0.300 . 1 . . . . 93 ASN ND2 . 11190 1 1055 . 1 1 94 94 ALA H H 1 7.113 0.030 . 1 . . . . 94 ALA H . 11190 1 1056 . 1 1 94 94 ALA HA H 1 4.270 0.030 . 1 . . . . 94 ALA HA . 11190 1 1057 . 1 1 94 94 ALA HB1 H 1 1.573 0.030 . 1 . . . . 94 ALA HB . 11190 1 1058 . 1 1 94 94 ALA HB2 H 1 1.573 0.030 . 1 . . . . 94 ALA HB . 11190 1 1059 . 1 1 94 94 ALA HB3 H 1 1.573 0.030 . 1 . . . . 94 ALA HB . 11190 1 1060 . 1 1 94 94 ALA C C 13 177.612 0.300 . 1 . . . . 94 ALA C . 11190 1 1061 . 1 1 94 94 ALA CA C 13 53.003 0.300 . 1 . . . . 94 ALA CA . 11190 1 1062 . 1 1 94 94 ALA CB C 13 19.077 0.300 . 1 . . . . 94 ALA CB . 11190 1 1063 . 1 1 94 94 ALA N N 15 123.601 0.300 . 1 . . . . 94 ALA N . 11190 1 1064 . 1 1 95 95 GLY H H 1 8.771 0.030 . 1 . . . . 95 GLY H . 11190 1 1065 . 1 1 95 95 GLY HA2 H 1 4.311 0.030 . 2 . . . . 95 GLY HA2 . 11190 1 1066 . 1 1 95 95 GLY HA3 H 1 3.831 0.030 . 2 . . . . 95 GLY HA3 . 11190 1 1067 . 1 1 95 95 GLY C C 13 173.347 0.300 . 1 . . . . 95 GLY C . 11190 1 1068 . 1 1 95 95 GLY CA C 13 44.279 0.300 . 1 . . . . 95 GLY CA . 11190 1 1069 . 1 1 95 95 GLY N N 15 108.689 0.300 . 1 . . . . 95 GLY N . 11190 1 1070 . 1 1 96 96 GLN H H 1 8.406 0.030 . 1 . . . . 96 GLN H . 11190 1 1071 . 1 1 96 96 GLN HA H 1 3.984 0.030 . 1 . . . . 96 GLN HA . 11190 1 1072 . 1 1 96 96 GLN HB2 H 1 2.245 0.030 . 2 . . . . 96 GLN HB2 . 11190 1 1073 . 1 1 96 96 GLN HB3 H 1 2.067 0.030 . 2 . . . . 96 GLN HB3 . 11190 1 1074 . 1 1 96 96 GLN HE21 H 1 7.452 0.030 . 2 . . . . 96 GLN HE21 . 11190 1 1075 . 1 1 96 96 GLN HE22 H 1 6.808 0.030 . 2 . . . . 96 GLN HE22 . 11190 1 1076 . 1 1 96 96 GLN HG2 H 1 2.392 0.030 . 2 . . . . 96 GLN HG2 . 11190 1 1077 . 1 1 96 96 GLN HG3 H 1 2.574 0.030 . 2 . . . . 96 GLN HG3 . 11190 1 1078 . 1 1 96 96 GLN C C 13 175.085 0.300 . 1 . . . . 96 GLN C . 11190 1 1079 . 1 1 96 96 GLN CA C 13 58.582 0.300 . 1 . . . . 96 GLN CA . 11190 1 1080 . 1 1 96 96 GLN CB C 13 29.348 0.300 . 1 . . . . 96 GLN CB . 11190 1 1081 . 1 1 96 96 GLN CG C 13 34.677 0.300 . 1 . . . . 96 GLN CG . 11190 1 1082 . 1 1 96 96 GLN N N 15 118.902 0.300 . 1 . . . . 96 GLN N . 11190 1 1083 . 1 1 96 96 GLN NE2 N 15 111.595 0.300 . 1 . . . . 96 GLN NE2 . 11190 1 1084 . 1 1 97 97 VAL H H 1 7.651 0.030 . 1 . . . . 97 VAL H . 11190 1 1085 . 1 1 97 97 VAL HA H 1 4.822 0.030 . 1 . . . . 97 VAL HA . 11190 1 1086 . 1 1 97 97 VAL HB H 1 1.873 0.030 . 1 . . . . 97 VAL HB . 11190 1 1087 . 1 1 97 97 VAL HG11 H 1 0.670 0.030 . 1 . . . . 97 VAL HG1 . 11190 1 1088 . 1 1 97 97 VAL HG12 H 1 0.670 0.030 . 1 . . . . 97 VAL HG1 . 11190 1 1089 . 1 1 97 97 VAL HG13 H 1 0.670 0.030 . 1 . . . . 97 VAL HG1 . 11190 1 1090 . 1 1 97 97 VAL HG21 H 1 0.923 0.030 . 1 . . . . 97 VAL HG2 . 11190 1 1091 . 1 1 97 97 VAL HG22 H 1 0.923 0.030 . 1 . . . . 97 VAL HG2 . 11190 1 1092 . 1 1 97 97 VAL HG23 H 1 0.923 0.030 . 1 . . . . 97 VAL HG2 . 11190 1 1093 . 1 1 97 97 VAL C C 13 175.488 0.300 . 1 . . . . 97 VAL C . 11190 1 1094 . 1 1 97 97 VAL CA C 13 61.101 0.300 . 1 . . . . 97 VAL CA . 11190 1 1095 . 1 1 97 97 VAL CB C 13 33.252 0.300 . 1 . . . . 97 VAL CB . 11190 1 1096 . 1 1 97 97 VAL CG1 C 13 21.130 0.300 . 2 . . . . 97 VAL CG1 . 11190 1 1097 . 1 1 97 97 VAL CG2 C 13 21.302 0.300 . 2 . . . . 97 VAL CG2 . 11190 1 1098 . 1 1 97 97 VAL N N 15 116.127 0.300 . 1 . . . . 97 VAL N . 11190 1 1099 . 1 1 98 98 VAL H H 1 9.142 0.030 . 1 . . . . 98 VAL H . 11190 1 1100 . 1 1 98 98 VAL HA H 1 4.669 0.030 . 1 . . . . 98 VAL HA . 11190 1 1101 . 1 1 98 98 VAL HB H 1 1.845 0.030 . 1 . . . . 98 VAL HB . 11190 1 1102 . 1 1 98 98 VAL HG11 H 1 0.857 0.030 . 1 . . . . 98 VAL HG1 . 11190 1 1103 . 1 1 98 98 VAL HG12 H 1 0.857 0.030 . 1 . . . . 98 VAL HG1 . 11190 1 1104 . 1 1 98 98 VAL HG13 H 1 0.857 0.030 . 1 . . . . 98 VAL HG1 . 11190 1 1105 . 1 1 98 98 VAL HG21 H 1 0.915 0.030 . 1 . . . . 98 VAL HG2 . 11190 1 1106 . 1 1 98 98 VAL HG22 H 1 0.915 0.030 . 1 . . . . 98 VAL HG2 . 11190 1 1107 . 1 1 98 98 VAL HG23 H 1 0.915 0.030 . 1 . . . . 98 VAL HG2 . 11190 1 1108 . 1 1 98 98 VAL C C 13 173.874 0.300 . 1 . . . . 98 VAL C . 11190 1 1109 . 1 1 98 98 VAL CA C 13 60.398 0.300 . 1 . . . . 98 VAL CA . 11190 1 1110 . 1 1 98 98 VAL CB C 13 35.130 0.300 . 1 . . . . 98 VAL CB . 11190 1 1111 . 1 1 98 98 VAL CG1 C 13 20.899 0.300 . 2 . . . . 98 VAL CG1 . 11190 1 1112 . 1 1 98 98 VAL CG2 C 13 22.172 0.300 . 2 . . . . 98 VAL CG2 . 11190 1 1113 . 1 1 98 98 VAL N N 15 128.737 0.300 . 1 . . . . 98 VAL N . 11190 1 1114 . 1 1 99 99 HIS H H 1 9.256 0.030 . 1 . . . . 99 HIS H . 11190 1 1115 . 1 1 99 99 HIS HA H 1 5.343 0.030 . 1 . . . . 99 HIS HA . 11190 1 1116 . 1 1 99 99 HIS HB2 H 1 3.069 0.030 . 2 . . . . 99 HIS HB2 . 11190 1 1117 . 1 1 99 99 HIS HB3 H 1 3.235 0.030 . 2 . . . . 99 HIS HB3 . 11190 1 1118 . 1 1 99 99 HIS HD2 H 1 7.095 0.030 . 1 . . . . 99 HIS HD2 . 11190 1 1119 . 1 1 99 99 HIS HE1 H 1 7.979 0.030 . 1 . . . . 99 HIS HE1 . 11190 1 1120 . 1 1 99 99 HIS C C 13 175.085 0.300 . 1 . . . . 99 HIS C . 11190 1 1121 . 1 1 99 99 HIS CA C 13 55.169 0.300 . 1 . . . . 99 HIS CA . 11190 1 1122 . 1 1 99 99 HIS CB C 13 31.030 0.300 . 1 . . . . 99 HIS CB . 11190 1 1123 . 1 1 99 99 HIS CD2 C 13 118.719 0.300 . 1 . . . . 99 HIS CD2 . 11190 1 1124 . 1 1 99 99 HIS CE1 C 13 137.057 0.300 . 1 . . . . 99 HIS CE1 . 11190 1 1125 . 1 1 99 99 HIS N N 15 127.221 0.300 . 1 . . . . 99 HIS N . 11190 1 1126 . 1 1 100 100 LEU H H 1 9.013 0.030 . 1 . . . . 100 LEU H . 11190 1 1127 . 1 1 100 100 LEU HA H 1 5.218 0.030 . 1 . . . . 100 LEU HA . 11190 1 1128 . 1 1 100 100 LEU HB2 H 1 1.599 0.030 . 2 . . . . 100 LEU HB2 . 11190 1 1129 . 1 1 100 100 LEU HB3 H 1 1.325 0.030 . 2 . . . . 100 LEU HB3 . 11190 1 1130 . 1 1 100 100 LEU HD11 H 1 0.797 0.030 . 1 . . . . 100 LEU HD1 . 11190 1 1131 . 1 1 100 100 LEU HD12 H 1 0.797 0.030 . 1 . . . . 100 LEU HD1 . 11190 1 1132 . 1 1 100 100 LEU HD13 H 1 0.797 0.030 . 1 . . . . 100 LEU HD1 . 11190 1 1133 . 1 1 100 100 LEU HD21 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11190 1 1134 . 1 1 100 100 LEU HD22 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11190 1 1135 . 1 1 100 100 LEU HD23 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11190 1 1136 . 1 1 100 100 LEU HG H 1 1.584 0.030 . 1 . . . . 100 LEU HG . 11190 1 1137 . 1 1 100 100 LEU C C 13 175.524 0.300 . 1 . . . . 100 LEU C . 11190 1 1138 . 1 1 100 100 LEU CA C 13 53.837 0.300 . 1 . . . . 100 LEU CA . 11190 1 1139 . 1 1 100 100 LEU CB C 13 46.068 0.300 . 1 . . . . 100 LEU CB . 11190 1 1140 . 1 1 100 100 LEU CD1 C 13 26.742 0.300 . 2 . . . . 100 LEU CD1 . 11190 1 1141 . 1 1 100 100 LEU CD2 C 13 25.831 0.300 . 2 . . . . 100 LEU CD2 . 11190 1 1142 . 1 1 100 100 LEU CG C 13 27.228 0.300 . 1 . . . . 100 LEU CG . 11190 1 1143 . 1 1 100 100 LEU N N 15 124.247 0.300 . 1 . . . . 100 LEU N . 11190 1 1144 . 1 1 101 101 THR H H 1 8.362 0.030 . 1 . . . . 101 THR H . 11190 1 1145 . 1 1 101 101 THR HA H 1 5.083 0.030 . 1 . . . . 101 THR HA . 11190 1 1146 . 1 1 101 101 THR HB H 1 3.721 0.030 . 1 . . . . 101 THR HB . 11190 1 1147 . 1 1 101 101 THR HG21 H 1 1.046 0.030 . 1 . . . . 101 THR HG2 . 11190 1 1148 . 1 1 101 101 THR HG22 H 1 1.046 0.030 . 1 . . . . 101 THR HG2 . 11190 1 1149 . 1 1 101 101 THR HG23 H 1 1.046 0.030 . 1 . . . . 101 THR HG2 . 11190 1 1150 . 1 1 101 101 THR C C 13 173.452 0.300 . 1 . . . . 101 THR C . 11190 1 1151 . 1 1 101 101 THR CA C 13 62.165 0.300 . 1 . . . . 101 THR CA . 11190 1 1152 . 1 1 101 101 THR CB C 13 69.625 0.300 . 1 . . . . 101 THR CB . 11190 1 1153 . 1 1 101 101 THR CG2 C 13 22.105 0.300 . 1 . . . . 101 THR CG2 . 11190 1 1154 . 1 1 101 101 THR N N 15 119.452 0.300 . 1 . . . . 101 THR N . 11190 1 1155 . 1 1 102 102 LEU H H 1 9.207 0.030 . 1 . . . . 102 LEU H . 11190 1 1156 . 1 1 102 102 LEU HA H 1 5.624 0.030 . 1 . . . . 102 LEU HA . 11190 1 1157 . 1 1 102 102 LEU HB2 H 1 1.303 0.030 . 2 . . . . 102 LEU HB2 . 11190 1 1158 . 1 1 102 102 LEU HB3 H 1 1.363 0.030 . 2 . . . . 102 LEU HB3 . 11190 1 1159 . 1 1 102 102 LEU HD11 H 1 0.798 0.030 . 1 . . . . 102 LEU HD1 . 11190 1 1160 . 1 1 102 102 LEU HD12 H 1 0.798 0.030 . 1 . . . . 102 LEU HD1 . 11190 1 1161 . 1 1 102 102 LEU HD13 H 1 0.798 0.030 . 1 . . . . 102 LEU HD1 . 11190 1 1162 . 1 1 102 102 LEU HD21 H 1 0.711 0.030 . 1 . . . . 102 LEU HD2 . 11190 1 1163 . 1 1 102 102 LEU HD22 H 1 0.711 0.030 . 1 . . . . 102 LEU HD2 . 11190 1 1164 . 1 1 102 102 LEU HD23 H 1 0.711 0.030 . 1 . . . . 102 LEU HD2 . 11190 1 1165 . 1 1 102 102 LEU HG H 1 1.538 0.030 . 1 . . . . 102 LEU HG . 11190 1 1166 . 1 1 102 102 LEU C C 13 174.769 0.300 . 1 . . . . 102 LEU C . 11190 1 1167 . 1 1 102 102 LEU CA C 13 53.567 0.300 . 1 . . . . 102 LEU CA . 11190 1 1168 . 1 1 102 102 LEU CB C 13 45.845 0.300 . 1 . . . . 102 LEU CB . 11190 1 1169 . 1 1 102 102 LEU CD1 C 13 26.815 0.300 . 2 . . . . 102 LEU CD1 . 11190 1 1170 . 1 1 102 102 LEU CD2 C 13 26.779 0.300 . 2 . . . . 102 LEU CD2 . 11190 1 1171 . 1 1 102 102 LEU CG C 13 27.772 0.300 . 1 . . . . 102 LEU CG . 11190 1 1172 . 1 1 102 102 LEU N N 15 128.085 0.300 . 1 . . . . 102 LEU N . 11190 1 1173 . 1 1 103 103 VAL H H 1 9.271 0.030 . 1 . . . . 103 VAL H . 11190 1 1174 . 1 1 103 103 VAL HA H 1 5.135 0.030 . 1 . . . . 103 VAL HA . 11190 1 1175 . 1 1 103 103 VAL HB H 1 1.746 0.030 . 1 . . . . 103 VAL HB . 11190 1 1176 . 1 1 103 103 VAL HG11 H 1 0.857 0.030 . 1 . . . . 103 VAL HG1 . 11190 1 1177 . 1 1 103 103 VAL HG12 H 1 0.857 0.030 . 1 . . . . 103 VAL HG1 . 11190 1 1178 . 1 1 103 103 VAL HG13 H 1 0.857 0.030 . 1 . . . . 103 VAL HG1 . 11190 1 1179 . 1 1 103 103 VAL HG21 H 1 0.854 0.030 . 1 . . . . 103 VAL HG2 . 11190 1 1180 . 1 1 103 103 VAL HG22 H 1 0.854 0.030 . 1 . . . . 103 VAL HG2 . 11190 1 1181 . 1 1 103 103 VAL HG23 H 1 0.854 0.030 . 1 . . . . 103 VAL HG2 . 11190 1 1182 . 1 1 103 103 VAL C C 13 175.506 0.300 . 1 . . . . 103 VAL C . 11190 1 1183 . 1 1 103 103 VAL CA C 13 61.046 0.300 . 1 . . . . 103 VAL CA . 11190 1 1184 . 1 1 103 103 VAL CB C 13 35.133 0.300 . 1 . . . . 103 VAL CB . 11190 1 1185 . 1 1 103 103 VAL CG1 C 13 21.813 0.300 . 2 . . . . 103 VAL CG1 . 11190 1 1186 . 1 1 103 103 VAL CG2 C 13 22.008 0.300 . 2 . . . . 103 VAL CG2 . 11190 1 1187 . 1 1 103 103 VAL N N 15 118.633 0.300 . 1 . . . . 103 VAL N . 11190 1 1188 . 1 1 104 104 ARG H H 1 9.446 0.030 . 1 . . . . 104 ARG H . 11190 1 1189 . 1 1 104 104 ARG HA H 1 5.057 0.030 . 1 . . . . 104 ARG HA . 11190 1 1190 . 1 1 104 104 ARG HB2 H 1 1.911 0.030 . 2 . . . . 104 ARG HB2 . 11190 1 1191 . 1 1 104 104 ARG HB3 H 1 1.962 0.030 . 2 . . . . 104 ARG HB3 . 11190 1 1192 . 1 1 104 104 ARG HD2 H 1 3.052 0.030 . 2 . . . . 104 ARG HD2 . 11190 1 1193 . 1 1 104 104 ARG HD3 H 1 3.147 0.030 . 2 . . . . 104 ARG HD3 . 11190 1 1194 . 1 1 104 104 ARG HE H 1 8.793 0.030 . 1 . . . . 104 ARG HE . 11190 1 1195 . 1 1 104 104 ARG HG2 H 1 1.661 0.030 . 2 . . . . 104 ARG HG2 . 11190 1 1196 . 1 1 104 104 ARG HG3 H 1 1.750 0.030 . 2 . . . . 104 ARG HG3 . 11190 1 1197 . 1 1 104 104 ARG C C 13 175.137 0.300 . 1 . . . . 104 ARG C . 11190 1 1198 . 1 1 104 104 ARG CA C 13 54.307 0.300 . 1 . . . . 104 ARG CA . 11190 1 1199 . 1 1 104 104 ARG CB C 13 35.224 0.300 . 1 . . . . 104 ARG CB . 11190 1 1200 . 1 1 104 104 ARG CD C 13 43.411 0.300 . 1 . . . . 104 ARG CD . 11190 1 1201 . 1 1 104 104 ARG CG C 13 26.130 0.300 . 1 . . . . 104 ARG CG . 11190 1 1202 . 1 1 104 104 ARG N N 15 129.086 0.300 . 1 . . . . 104 ARG N . 11190 1 1203 . 1 1 104 104 ARG NE N 15 84.244 0.300 . 1 . . . . 104 ARG NE . 11190 1 1204 . 1 1 105 105 ARG H H 1 9.003 0.030 . 1 . . . . 105 ARG H . 11190 1 1205 . 1 1 105 105 ARG HA H 1 4.290 0.030 . 1 . . . . 105 ARG HA . 11190 1 1206 . 1 1 105 105 ARG HB2 H 1 1.760 0.030 . 2 . . . . 105 ARG HB2 . 11190 1 1207 . 1 1 105 105 ARG HB3 H 1 1.814 0.030 . 2 . . . . 105 ARG HB3 . 11190 1 1208 . 1 1 105 105 ARG HD2 H 1 3.098 0.030 . 1 . . . . 105 ARG HD2 . 11190 1 1209 . 1 1 105 105 ARG HD3 H 1 3.098 0.030 . 1 . . . . 105 ARG HD3 . 11190 1 1210 . 1 1 105 105 ARG HG2 H 1 1.425 0.030 . 2 . . . . 105 ARG HG2 . 11190 1 1211 . 1 1 105 105 ARG HG3 H 1 1.498 0.030 . 2 . . . . 105 ARG HG3 . 11190 1 1212 . 1 1 105 105 ARG C C 13 176.454 0.300 . 1 . . . . 105 ARG C . 11190 1 1213 . 1 1 105 105 ARG CA C 13 56.415 0.300 . 1 . . . . 105 ARG CA . 11190 1 1214 . 1 1 105 105 ARG CB C 13 30.838 0.300 . 1 . . . . 105 ARG CB . 11190 1 1215 . 1 1 105 105 ARG CD C 13 43.181 0.300 . 1 . . . . 105 ARG CD . 11190 1 1216 . 1 1 105 105 ARG CG C 13 27.678 0.300 . 1 . . . . 105 ARG CG . 11190 1 1217 . 1 1 105 105 ARG N N 15 126.871 0.300 . 1 . . . . 105 ARG N . 11190 1 1218 . 1 1 106 106 LYS H H 1 8.515 0.030 . 1 . . . . 106 LYS H . 11190 1 1219 . 1 1 106 106 LYS HA H 1 4.282 0.030 . 1 . . . . 106 LYS HA . 11190 1 1220 . 1 1 106 106 LYS HB2 H 1 1.514 0.030 . 2 . . . . 106 LYS HB2 . 11190 1 1221 . 1 1 106 106 LYS HB3 H 1 1.795 0.030 . 2 . . . . 106 LYS HB3 . 11190 1 1222 . 1 1 106 106 LYS HD2 H 1 1.623 0.030 . 1 . . . . 106 LYS HD2 . 11190 1 1223 . 1 1 106 106 LYS HD3 H 1 1.623 0.030 . 1 . . . . 106 LYS HD3 . 11190 1 1224 . 1 1 106 106 LYS HE2 H 1 2.912 0.030 . 1 . . . . 106 LYS HE2 . 11190 1 1225 . 1 1 106 106 LYS HE3 H 1 2.912 0.030 . 1 . . . . 106 LYS HE3 . 11190 1 1226 . 1 1 106 106 LYS HG2 H 1 1.293 0.030 . 2 . . . . 106 LYS HG2 . 11190 1 1227 . 1 1 106 106 LYS HG3 H 1 1.377 0.030 . 2 . . . . 106 LYS HG3 . 11190 1 1228 . 1 1 106 106 LYS C C 13 176.612 0.300 . 1 . . . . 106 LYS C . 11190 1 1229 . 1 1 106 106 LYS CA C 13 56.884 0.300 . 1 . . . . 106 LYS CA . 11190 1 1230 . 1 1 106 106 LYS CB C 13 33.333 0.300 . 1 . . . . 106 LYS CB . 11190 1 1231 . 1 1 106 106 LYS CD C 13 29.317 0.300 . 1 . . . . 106 LYS CD . 11190 1 1232 . 1 1 106 106 LYS CE C 13 42.005 0.300 . 1 . . . . 106 LYS CE . 11190 1 1233 . 1 1 106 106 LYS CG C 13 25.380 0.300 . 1 . . . . 106 LYS CG . 11190 1 1234 . 1 1 106 106 LYS N N 15 126.344 0.300 . 1 . . . . 106 LYS N . 11190 1 1235 . 1 1 107 107 THR H H 1 8.334 0.030 . 1 . . . . 107 THR H . 11190 1 1236 . 1 1 107 107 THR HA H 1 4.390 0.030 . 1 . . . . 107 THR HA . 11190 1 1237 . 1 1 107 107 THR HB H 1 4.228 0.030 . 1 . . . . 107 THR HB . 11190 1 1238 . 1 1 107 107 THR HG21 H 1 1.196 0.030 . 1 . . . . 107 THR HG2 . 11190 1 1239 . 1 1 107 107 THR HG22 H 1 1.196 0.030 . 1 . . . . 107 THR HG2 . 11190 1 1240 . 1 1 107 107 THR HG23 H 1 1.196 0.030 . 1 . . . . 107 THR HG2 . 11190 1 1241 . 1 1 107 107 THR C C 13 174.418 0.300 . 1 . . . . 107 THR C . 11190 1 1242 . 1 1 107 107 THR CA C 13 61.594 0.300 . 1 . . . . 107 THR CA . 11190 1 1243 . 1 1 107 107 THR CB C 13 70.005 0.300 . 1 . . . . 107 THR CB . 11190 1 1244 . 1 1 107 107 THR CG2 C 13 21.507 0.300 . 1 . . . . 107 THR CG2 . 11190 1 1245 . 1 1 107 107 THR N N 15 115.793 0.300 . 1 . . . . 107 THR N . 11190 1 1246 . 1 1 108 108 SER H H 1 8.339 0.030 . 1 . . . . 108 SER H . 11190 1 1247 . 1 1 108 108 SER HA H 1 4.773 0.030 . 1 . . . . 108 SER HA . 11190 1 1248 . 1 1 108 108 SER HB2 H 1 3.825 0.030 . 2 . . . . 108 SER HB2 . 11190 1 1249 . 1 1 108 108 SER HB3 H 1 3.863 0.030 . 2 . . . . 108 SER HB3 . 11190 1 1250 . 1 1 108 108 SER C C 13 172.759 0.300 . 1 . . . . 108 SER C . 11190 1 1251 . 1 1 108 108 SER CA C 13 56.422 0.300 . 1 . . . . 108 SER CA . 11190 1 1252 . 1 1 108 108 SER CB C 13 63.390 0.300 . 1 . . . . 108 SER CB . 11190 1 1253 . 1 1 108 108 SER N N 15 119.763 0.300 . 1 . . . . 108 SER N . 11190 1 1254 . 1 1 110 110 SER HA H 1 4.535 0.030 . 1 . . . . 110 SER HA . 11190 1 1255 . 1 1 110 110 SER HB2 H 1 3.900 0.030 . 1 . . . . 110 SER HB2 . 11190 1 1256 . 1 1 110 110 SER HB3 H 1 3.900 0.030 . 1 . . . . 110 SER HB3 . 11190 1 1257 . 1 1 110 110 SER C C 13 174.734 0.300 . 1 . . . . 110 SER C . 11190 1 1258 . 1 1 110 110 SER CA C 13 58.322 0.300 . 1 . . . . 110 SER CA . 11190 1 1259 . 1 1 110 110 SER CB C 13 63.953 0.300 . 1 . . . . 110 SER CB . 11190 1 1260 . 1 1 111 111 THR H H 1 8.202 0.030 . 1 . . . . 111 THR H . 11190 1 1261 . 1 1 111 111 THR HA H 1 4.415 0.030 . 1 . . . . 111 THR HA . 11190 1 1262 . 1 1 111 111 THR HB H 1 4.236 0.030 . 1 . . . . 111 THR HB . 11190 1 1263 . 1 1 111 111 THR HG21 H 1 1.198 0.030 . 1 . . . . 111 THR HG2 . 11190 1 1264 . 1 1 111 111 THR HG22 H 1 1.198 0.030 . 1 . . . . 111 THR HG2 . 11190 1 1265 . 1 1 111 111 THR HG23 H 1 1.198 0.030 . 1 . . . . 111 THR HG2 . 11190 1 1266 . 1 1 111 111 THR C C 13 174.374 0.300 . 1 . . . . 111 THR C . 11190 1 1267 . 1 1 111 111 THR CA C 13 61.702 0.300 . 1 . . . . 111 THR CA . 11190 1 1268 . 1 1 111 111 THR CB C 13 69.744 0.300 . 1 . . . . 111 THR CB . 11190 1 1269 . 1 1 111 111 THR CG2 C 13 21.614 0.300 . 1 . . . . 111 THR CG2 . 11190 1 1270 . 1 1 111 111 THR N N 15 115.542 0.300 . 1 . . . . 111 THR N . 11190 1 1271 . 1 1 113 113 PRO HA H 1 4.441 0.030 . 1 . . . . 113 PRO HA . 11190 1 1272 . 1 1 113 113 PRO HB2 H 1 1.914 0.030 . 2 . . . . 113 PRO HB2 . 11190 1 1273 . 1 1 113 113 PRO HB3 H 1 2.278 0.030 . 2 . . . . 113 PRO HB3 . 11190 1 1274 . 1 1 113 113 PRO HD2 H 1 3.713 0.030 . 2 . . . . 113 PRO HD2 . 11190 1 1275 . 1 1 113 113 PRO HD3 H 1 3.811 0.030 . 2 . . . . 113 PRO HD3 . 11190 1 1276 . 1 1 113 113 PRO HG2 H 1 2.032 0.030 . 1 . . . . 113 PRO HG2 . 11190 1 1277 . 1 1 113 113 PRO HG3 H 1 2.032 0.030 . 1 . . . . 113 PRO HG3 . 11190 1 1278 . 1 1 113 113 PRO C C 13 176.664 0.300 . 1 . . . . 113 PRO C . 11190 1 1279 . 1 1 113 113 PRO CA C 13 63.187 0.300 . 1 . . . . 113 PRO CA . 11190 1 1280 . 1 1 113 113 PRO CB C 13 32.101 0.300 . 1 . . . . 113 PRO CB . 11190 1 1281 . 1 1 113 113 PRO CD C 13 50.735 0.300 . 1 . . . . 113 PRO CD . 11190 1 1282 . 1 1 113 113 PRO CG C 13 27.380 0.300 . 1 . . . . 113 PRO CG . 11190 1 1283 . 1 1 114 114 LEU H H 1 8.262 0.030 . 1 . . . . 114 LEU H . 11190 1 1284 . 1 1 114 114 LEU HA H 1 4.288 0.030 . 1 . . . . 114 LEU HA . 11190 1 1285 . 1 1 114 114 LEU HB2 H 1 1.574 0.030 . 1 . . . . 114 LEU HB2 . 11190 1 1286 . 1 1 114 114 LEU HB3 H 1 1.574 0.030 . 1 . . . . 114 LEU HB3 . 11190 1 1287 . 1 1 114 114 LEU HD11 H 1 0.845 0.030 . 1 . . . . 114 LEU HD1 . 11190 1 1288 . 1 1 114 114 LEU HD12 H 1 0.845 0.030 . 1 . . . . 114 LEU HD1 . 11190 1 1289 . 1 1 114 114 LEU HD13 H 1 0.845 0.030 . 1 . . . . 114 LEU HD1 . 11190 1 1290 . 1 1 114 114 LEU HD21 H 1 0.897 0.030 . 1 . . . . 114 LEU HD2 . 11190 1 1291 . 1 1 114 114 LEU HD22 H 1 0.897 0.030 . 1 . . . . 114 LEU HD2 . 11190 1 1292 . 1 1 114 114 LEU HD23 H 1 0.897 0.030 . 1 . . . . 114 LEU HD2 . 11190 1 1293 . 1 1 114 114 LEU HG H 1 1.599 0.030 . 1 . . . . 114 LEU HG . 11190 1 1294 . 1 1 114 114 LEU C C 13 177.068 0.300 . 1 . . . . 114 LEU C . 11190 1 1295 . 1 1 114 114 LEU CA C 13 55.034 0.300 . 1 . . . . 114 LEU CA . 11190 1 1296 . 1 1 114 114 LEU CB C 13 42.314 0.300 . 1 . . . . 114 LEU CB . 11190 1 1297 . 1 1 114 114 LEU CD1 C 13 23.431 0.300 . 2 . . . . 114 LEU CD1 . 11190 1 1298 . 1 1 114 114 LEU CD2 C 13 24.884 0.300 . 2 . . . . 114 LEU CD2 . 11190 1 1299 . 1 1 114 114 LEU CG C 13 27.059 0.300 . 1 . . . . 114 LEU CG . 11190 1 1300 . 1 1 114 114 LEU N N 15 121.881 0.300 . 1 . . . . 114 LEU N . 11190 1 1301 . 1 1 115 115 GLU H H 1 8.202 0.030 . 1 . . . . 115 GLU H . 11190 1 1302 . 1 1 115 115 GLU HA H 1 4.590 0.030 . 1 . . . . 115 GLU HA . 11190 1 1303 . 1 1 115 115 GLU HB2 H 1 1.874 0.030 . 2 . . . . 115 GLU HB2 . 11190 1 1304 . 1 1 115 115 GLU HB3 H 1 2.006 0.030 . 2 . . . . 115 GLU HB3 . 11190 1 1305 . 1 1 115 115 GLU HG2 H 1 2.263 0.030 . 1 . . . . 115 GLU HG2 . 11190 1 1306 . 1 1 115 115 GLU HG3 H 1 2.263 0.030 . 1 . . . . 115 GLU HG3 . 11190 1 1307 . 1 1 115 115 GLU C C 13 173.865 0.300 . 1 . . . . 115 GLU C . 11190 1 1308 . 1 1 115 115 GLU CA C 13 53.994 0.300 . 1 . . . . 115 GLU CA . 11190 1 1309 . 1 1 115 115 GLU CB C 13 29.890 0.300 . 1 . . . . 115 GLU CB . 11190 1 1310 . 1 1 115 115 GLU CG C 13 35.829 0.300 . 1 . . . . 115 GLU CG . 11190 1 1311 . 1 1 115 115 GLU N N 15 122.927 0.300 . 1 . . . . 115 GLU N . 11190 1 1312 . 1 1 116 116 PRO HA H 1 4.674 0.030 . 1 . . . . 116 PRO HA . 11190 1 1313 . 1 1 116 116 PRO HB2 H 1 1.886 0.030 . 2 . . . . 116 PRO HB2 . 11190 1 1314 . 1 1 116 116 PRO HB3 H 1 2.331 0.030 . 2 . . . . 116 PRO HB3 . 11190 1 1315 . 1 1 116 116 PRO HD2 H 1 3.670 0.030 . 2 . . . . 116 PRO HD2 . 11190 1 1316 . 1 1 116 116 PRO HD3 H 1 3.816 0.030 . 2 . . . . 116 PRO HD3 . 11190 1 1317 . 1 1 116 116 PRO HG2 H 1 1.995 0.030 . 1 . . . . 116 PRO HG2 . 11190 1 1318 . 1 1 116 116 PRO HG3 H 1 1.995 0.030 . 1 . . . . 116 PRO HG3 . 11190 1 1319 . 1 1 116 116 PRO CA C 13 61.387 0.300 . 1 . . . . 116 PRO CA . 11190 1 1320 . 1 1 116 116 PRO CB C 13 30.817 0.300 . 1 . . . . 116 PRO CB . 11190 1 1321 . 1 1 116 116 PRO CD C 13 50.556 0.300 . 1 . . . . 116 PRO CD . 11190 1 1322 . 1 1 116 116 PRO CG C 13 27.276 0.300 . 1 . . . . 116 PRO CG . 11190 1 1323 . 1 1 117 117 PRO HA H 1 4.454 0.030 . 1 . . . . 117 PRO HA . 11190 1 1324 . 1 1 117 117 PRO HB2 H 1 2.328 0.030 . 2 . . . . 117 PRO HB2 . 11190 1 1325 . 1 1 117 117 PRO HB3 H 1 1.808 0.030 . 2 . . . . 117 PRO HB3 . 11190 1 1326 . 1 1 117 117 PRO HD2 H 1 3.629 0.030 . 2 . . . . 117 PRO HD2 . 11190 1 1327 . 1 1 117 117 PRO HD3 H 1 3.817 0.030 . 2 . . . . 117 PRO HD3 . 11190 1 1328 . 1 1 117 117 PRO HG2 H 1 2.033 0.030 . 1 . . . . 117 PRO HG2 . 11190 1 1329 . 1 1 117 117 PRO HG3 H 1 2.033 0.030 . 1 . . . . 117 PRO HG3 . 11190 1 1330 . 1 1 117 117 PRO C C 13 177.182 0.300 . 1 . . . . 117 PRO C . 11190 1 1331 . 1 1 117 117 PRO CA C 13 62.948 0.300 . 1 . . . . 117 PRO CA . 11190 1 1332 . 1 1 117 117 PRO CB C 13 32.023 0.300 . 1 . . . . 117 PRO CB . 11190 1 1333 . 1 1 117 117 PRO CD C 13 50.419 0.300 . 1 . . . . 117 PRO CD . 11190 1 1334 . 1 1 117 117 PRO CG C 13 27.358 0.300 . 1 . . . . 117 PRO CG . 11190 1 1335 . 1 1 118 118 SER H H 1 8.460 0.030 . 1 . . . . 118 SER H . 11190 1 1336 . 1 1 118 118 SER HA H 1 4.421 0.030 . 1 . . . . 118 SER HA . 11190 1 1337 . 1 1 118 118 SER HB2 H 1 3.740 0.030 . 2 . . . . 118 SER HB2 . 11190 1 1338 . 1 1 118 118 SER HB3 H 1 3.843 0.030 . 2 . . . . 118 SER HB3 . 11190 1 1339 . 1 1 118 118 SER C C 13 174.515 0.300 . 1 . . . . 118 SER C . 11190 1 1340 . 1 1 118 118 SER CA C 13 58.427 0.300 . 1 . . . . 118 SER CA . 11190 1 1341 . 1 1 118 118 SER CB C 13 63.755 0.300 . 1 . . . . 118 SER CB . 11190 1 1342 . 1 1 118 118 SER N N 15 116.199 0.300 . 1 . . . . 118 SER N . 11190 1 1343 . 1 1 119 119 ASP H H 1 8.420 0.030 . 1 . . . . 119 ASP H . 11190 1 1344 . 1 1 119 119 ASP HA H 1 4.633 0.030 . 1 . . . . 119 ASP HA . 11190 1 1345 . 1 1 119 119 ASP HB2 H 1 2.693 0.030 . 1 . . . . 119 ASP HB2 . 11190 1 1346 . 1 1 119 119 ASP HB3 H 1 2.693 0.030 . 1 . . . . 119 ASP HB3 . 11190 1 1347 . 1 1 119 119 ASP C C 13 176.419 0.300 . 1 . . . . 119 ASP C . 11190 1 1348 . 1 1 119 119 ASP CA C 13 54.206 0.300 . 1 . . . . 119 ASP CA . 11190 1 1349 . 1 1 119 119 ASP CB C 13 41.085 0.300 . 1 . . . . 119 ASP CB . 11190 1 1350 . 1 1 119 119 ASP N N 15 122.393 0.300 . 1 . . . . 119 ASP N . 11190 1 1351 . 1 1 120 120 ARG H H 1 8.312 0.030 . 1 . . . . 120 ARG H . 11190 1 1352 . 1 1 120 120 ARG HA H 1 4.318 0.030 . 1 . . . . 120 ARG HA . 11190 1 1353 . 1 1 120 120 ARG HB2 H 1 1.776 0.030 . 2 . . . . 120 ARG HB2 . 11190 1 1354 . 1 1 120 120 ARG HB3 H 1 1.915 0.030 . 2 . . . . 120 ARG HB3 . 11190 1 1355 . 1 1 120 120 ARG HD2 H 1 3.180 0.030 . 1 . . . . 120 ARG HD2 . 11190 1 1356 . 1 1 120 120 ARG HD3 H 1 3.180 0.030 . 1 . . . . 120 ARG HD3 . 11190 1 1357 . 1 1 120 120 ARG HG2 H 1 1.628 0.030 . 2 . . . . 120 ARG HG2 . 11190 1 1358 . 1 1 120 120 ARG HG3 H 1 1.671 0.030 . 2 . . . . 120 ARG HG3 . 11190 1 1359 . 1 1 120 120 ARG C C 13 176.945 0.300 . 1 . . . . 120 ARG C . 11190 1 1360 . 1 1 120 120 ARG CA C 13 56.341 0.300 . 1 . . . . 120 ARG CA . 11190 1 1361 . 1 1 120 120 ARG CB C 13 30.501 0.300 . 1 . . . . 120 ARG CB . 11190 1 1362 . 1 1 120 120 ARG CD C 13 43.290 0.300 . 1 . . . . 120 ARG CD . 11190 1 1363 . 1 1 120 120 ARG CG C 13 26.970 0.300 . 1 . . . . 120 ARG CG . 11190 1 1364 . 1 1 120 120 ARG N N 15 121.280 0.300 . 1 . . . . 120 ARG N . 11190 1 1365 . 1 1 121 121 GLY H H 1 8.471 0.030 . 1 . . . . 121 GLY H . 11190 1 1366 . 1 1 121 121 GLY HA2 H 1 3.990 0.030 . 1 . . . . 121 GLY HA2 . 11190 1 1367 . 1 1 121 121 GLY HA3 H 1 3.990 0.030 . 1 . . . . 121 GLY HA3 . 11190 1 1368 . 1 1 121 121 GLY C C 13 174.295 0.300 . 1 . . . . 121 GLY C . 11190 1 1369 . 1 1 121 121 GLY CA C 13 45.338 0.300 . 1 . . . . 121 GLY CA . 11190 1 1370 . 1 1 121 121 GLY N N 15 109.446 0.300 . 1 . . . . 121 GLY N . 11190 1 1371 . 1 1 122 122 THR H H 1 8.087 0.030 . 1 . . . . 122 THR H . 11190 1 1372 . 1 1 122 122 THR HA H 1 4.371 0.030 . 1 . . . . 122 THR HA . 11190 1 1373 . 1 1 122 122 THR HB H 1 4.193 0.030 . 1 . . . . 122 THR HB . 11190 1 1374 . 1 1 122 122 THR HG21 H 1 1.184 0.030 . 1 . . . . 122 THR HG2 . 11190 1 1375 . 1 1 122 122 THR HG22 H 1 1.184 0.030 . 1 . . . . 122 THR HG2 . 11190 1 1376 . 1 1 122 122 THR HG23 H 1 1.184 0.030 . 1 . . . . 122 THR HG2 . 11190 1 1377 . 1 1 122 122 THR C C 13 174.699 0.300 . 1 . . . . 122 THR C . 11190 1 1378 . 1 1 122 122 THR CA C 13 61.864 0.300 . 1 . . . . 122 THR CA . 11190 1 1379 . 1 1 122 122 THR CB C 13 69.911 0.300 . 1 . . . . 122 THR CB . 11190 1 1380 . 1 1 122 122 THR CG2 C 13 21.607 0.300 . 1 . . . . 122 THR CG2 . 11190 1 1381 . 1 1 122 122 THR N N 15 114.237 0.300 . 1 . . . . 122 THR N . 11190 1 1382 . 1 1 123 123 VAL H H 1 8.265 0.030 . 1 . . . . 123 VAL H . 11190 1 1383 . 1 1 123 123 VAL HA H 1 4.208 0.030 . 1 . . . . 123 VAL HA . 11190 1 1384 . 1 1 123 123 VAL HB H 1 2.099 0.030 . 1 . . . . 123 VAL HB . 11190 1 1385 . 1 1 123 123 VAL HG11 H 1 0.935 0.030 . 1 . . . . 123 VAL HG1 . 11190 1 1386 . 1 1 123 123 VAL HG12 H 1 0.935 0.030 . 1 . . . . 123 VAL HG1 . 11190 1 1387 . 1 1 123 123 VAL HG13 H 1 0.935 0.030 . 1 . . . . 123 VAL HG1 . 11190 1 1388 . 1 1 123 123 VAL HG21 H 1 0.933 0.030 . 1 . . . . 123 VAL HG2 . 11190 1 1389 . 1 1 123 123 VAL HG22 H 1 0.933 0.030 . 1 . . . . 123 VAL HG2 . 11190 1 1390 . 1 1 123 123 VAL HG23 H 1 0.933 0.030 . 1 . . . . 123 VAL HG2 . 11190 1 1391 . 1 1 123 123 VAL C C 13 176.120 0.300 . 1 . . . . 123 VAL C . 11190 1 1392 . 1 1 123 123 VAL CA C 13 62.220 0.300 . 1 . . . . 123 VAL CA . 11190 1 1393 . 1 1 123 123 VAL CB C 13 32.818 0.300 . 1 . . . . 123 VAL CB . 11190 1 1394 . 1 1 123 123 VAL CG1 C 13 21.345 0.300 . 2 . . . . 123 VAL CG1 . 11190 1 1395 . 1 1 123 123 VAL CG2 C 13 20.383 0.300 . 2 . . . . 123 VAL CG2 . 11190 1 1396 . 1 1 123 123 VAL N N 15 122.791 0.300 . 1 . . . . 123 VAL N . 11190 1 1397 . 1 1 124 124 SER H H 1 8.457 0.030 . 1 . . . . 124 SER H . 11190 1 1398 . 1 1 124 124 SER HA H 1 4.522 0.030 . 1 . . . . 124 SER HA . 11190 1 1399 . 1 1 124 124 SER HB2 H 1 3.870 0.030 . 1 . . . . 124 SER HB2 . 11190 1 1400 . 1 1 124 124 SER HB3 H 1 3.870 0.030 . 1 . . . . 124 SER HB3 . 11190 1 1401 . 1 1 124 124 SER C C 13 174.470 0.300 . 1 . . . . 124 SER C . 11190 1 1402 . 1 1 124 124 SER CA C 13 58.249 0.300 . 1 . . . . 124 SER CA . 11190 1 1403 . 1 1 124 124 SER CB C 13 63.953 0.300 . 1 . . . . 124 SER CB . 11190 1 1404 . 1 1 124 124 SER N N 15 119.952 0.300 . 1 . . . . 124 SER N . 11190 1 1405 . 1 1 125 125 GLY H H 1 8.274 0.030 . 1 . . . . 125 GLY H . 11190 1 1406 . 1 1 125 125 GLY HA2 H 1 4.082 0.030 . 2 . . . . 125 GLY HA2 . 11190 1 1407 . 1 1 125 125 GLY HA3 H 1 4.175 0.030 . 2 . . . . 125 GLY HA3 . 11190 1 1408 . 1 1 125 125 GLY C C 13 171.724 0.300 . 1 . . . . 125 GLY C . 11190 1 1409 . 1 1 125 125 GLY CA C 13 44.641 0.300 . 1 . . . . 125 GLY CA . 11190 1 1410 . 1 1 125 125 GLY N N 15 110.973 0.300 . 1 . . . . 125 GLY N . 11190 1 1411 . 1 1 126 126 PRO HA H 1 4.487 0.030 . 1 . . . . 126 PRO HA . 11190 1 1412 . 1 1 126 126 PRO HB2 H 1 1.940 0.030 . 2 . . . . 126 PRO HB2 . 11190 1 1413 . 1 1 126 126 PRO HB3 H 1 2.296 0.030 . 2 . . . . 126 PRO HB3 . 11190 1 1414 . 1 1 126 126 PRO HD2 H 1 3.622 0.030 . 1 . . . . 126 PRO HD2 . 11190 1 1415 . 1 1 126 126 PRO HD3 H 1 3.622 0.030 . 1 . . . . 126 PRO HD3 . 11190 1 1416 . 1 1 126 126 PRO HG2 H 1 2.033 0.030 . 1 . . . . 126 PRO HG2 . 11190 1 1417 . 1 1 126 126 PRO HG3 H 1 2.033 0.030 . 1 . . . . 126 PRO HG3 . 11190 1 1418 . 1 1 126 126 PRO C C 13 177.384 0.300 . 1 . . . . 126 PRO C . 11190 1 1419 . 1 1 126 126 PRO CA C 13 63.268 0.300 . 1 . . . . 126 PRO CA . 11190 1 1420 . 1 1 126 126 PRO CB C 13 32.101 0.300 . 1 . . . . 126 PRO CB . 11190 1 1421 . 1 1 126 126 PRO CD C 13 49.756 0.300 . 1 . . . . 126 PRO CD . 11190 1 1422 . 1 1 126 126 PRO CG C 13 27.172 0.300 . 1 . . . . 126 PRO CG . 11190 1 1423 . 1 1 127 127 SER H H 1 8.561 0.030 . 1 . . . . 127 SER H . 11190 1 1424 . 1 1 127 127 SER HA H 1 4.517 0.030 . 1 . . . . 127 SER HA . 11190 1 1425 . 1 1 127 127 SER HB2 H 1 3.916 0.030 . 1 . . . . 127 SER HB2 . 11190 1 1426 . 1 1 127 127 SER HB3 H 1 3.916 0.030 . 1 . . . . 127 SER HB3 . 11190 1 1427 . 1 1 127 127 SER C C 13 174.646 0.300 . 1 . . . . 127 SER C . 11190 1 1428 . 1 1 127 127 SER CA C 13 58.359 0.300 . 1 . . . . 127 SER CA . 11190 1 1429 . 1 1 127 127 SER CB C 13 63.834 0.300 . 1 . . . . 127 SER CB . 11190 1 1430 . 1 1 127 127 SER N N 15 116.458 0.300 . 1 . . . . 127 SER N . 11190 1 1431 . 1 1 128 128 SER H H 1 8.364 0.030 . 1 . . . . 128 SER H . 11190 1 1432 . 1 1 128 128 SER HA H 1 4.511 0.030 . 1 . . . . 128 SER HA . 11190 1 1433 . 1 1 128 128 SER HB2 H 1 3.904 0.030 . 1 . . . . 128 SER HB2 . 11190 1 1434 . 1 1 128 128 SER HB3 H 1 3.904 0.030 . 1 . . . . 128 SER HB3 . 11190 1 1435 . 1 1 128 128 SER C C 13 173.926 0.300 . 1 . . . . 128 SER C . 11190 1 1436 . 1 1 128 128 SER CA C 13 58.413 0.300 . 1 . . . . 128 SER CA . 11190 1 1437 . 1 1 128 128 SER CB C 13 64.131 0.300 . 1 . . . . 128 SER CB . 11190 1 1438 . 1 1 128 128 SER N N 15 117.899 0.300 . 1 . . . . 128 SER N . 11190 1 1439 . 1 1 129 129 GLY H H 1 8.077 0.030 . 1 . . . . 129 GLY H . 11190 1 1440 . 1 1 129 129 GLY HA2 H 1 3.797 0.030 . 1 . . . . 129 GLY HA2 . 11190 1 1441 . 1 1 129 129 GLY HA3 H 1 3.797 0.030 . 1 . . . . 129 GLY HA3 . 11190 1 1442 . 1 1 129 129 GLY C C 13 178.973 0.300 . 1 . . . . 129 GLY C . 11190 1 1443 . 1 1 129 129 GLY CA C 13 46.300 0.300 . 1 . . . . 129 GLY CA . 11190 1 1444 . 1 1 129 129 GLY N N 15 116.897 0.300 . 1 . . . . 129 GLY N . 11190 1 stop_ save_