data_11203 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11203 _Entry.Title ; Solution structure of the core domain of calcyclin binding protein; siah-interacting protein (SIP) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-22 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-21 _Entry.Original_release_date 2011-07-21 _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 X. Qin . . . 11203 2 T. Nagashima . . . 11203 3 F. Hayashi . . . 11203 4 S. Yokoyama . . . 11203 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)' . 11203 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11203 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 565 11203 '15N chemical shifts' 126 11203 '1H chemical shifts' 890 11203 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 . . 2011-07-21 2010-07-22 original author . 11203 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1X5M 'BMRB Entry Tracking System' 11203 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11203 _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 core domain of calcyclin binding protein; siah-interacting protein (SIP) ; _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 X. Qin . . . 11203 1 2 T. Nagashima . . . 11203 1 3 F. Hayashi . . . 11203 1 4 S. Yokoyama . . . 11203 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11203 _Assembly.ID 1 _Assembly.Name 'Calcyclin-binding 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 'CS domain' 1 $entity_1 A . yes native no no . . . 11203 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 1x5m . . . . . . 11203 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11203 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'CS 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 ; GSSGSSGVVAPITTGYTVKI SNYGWDQSDKFVKIYITLTG VHQVPTENVQVHFTERSFDL LVKNLNGKSYSMIVNNLLKP ISVEGSSKKVKTDTVLILCR KKVENTRWDYLTQVEKECKE KSGPSSG ; _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 127 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 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 1X5M . "Solution Structure Of The Core Domain Of Calcyclin Binding Protein; Siah-Interacting Protein (Sip)" . . . . . 100.00 127 100.00 100.00 1.04e-85 . . . . 11203 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CS domain' . 11203 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 . 11203 1 2 . SER . 11203 1 3 . SER . 11203 1 4 . GLY . 11203 1 5 . SER . 11203 1 6 . SER . 11203 1 7 . GLY . 11203 1 8 . VAL . 11203 1 9 . VAL . 11203 1 10 . ALA . 11203 1 11 . PRO . 11203 1 12 . ILE . 11203 1 13 . THR . 11203 1 14 . THR . 11203 1 15 . GLY . 11203 1 16 . TYR . 11203 1 17 . THR . 11203 1 18 . VAL . 11203 1 19 . LYS . 11203 1 20 . ILE . 11203 1 21 . SER . 11203 1 22 . ASN . 11203 1 23 . TYR . 11203 1 24 . GLY . 11203 1 25 . TRP . 11203 1 26 . ASP . 11203 1 27 . GLN . 11203 1 28 . SER . 11203 1 29 . ASP . 11203 1 30 . LYS . 11203 1 31 . PHE . 11203 1 32 . VAL . 11203 1 33 . LYS . 11203 1 34 . ILE . 11203 1 35 . TYR . 11203 1 36 . ILE . 11203 1 37 . THR . 11203 1 38 . LEU . 11203 1 39 . THR . 11203 1 40 . GLY . 11203 1 41 . VAL . 11203 1 42 . HIS . 11203 1 43 . GLN . 11203 1 44 . VAL . 11203 1 45 . PRO . 11203 1 46 . THR . 11203 1 47 . GLU . 11203 1 48 . ASN . 11203 1 49 . VAL . 11203 1 50 . GLN . 11203 1 51 . VAL . 11203 1 52 . HIS . 11203 1 53 . PHE . 11203 1 54 . THR . 11203 1 55 . GLU . 11203 1 56 . ARG . 11203 1 57 . SER . 11203 1 58 . PHE . 11203 1 59 . ASP . 11203 1 60 . LEU . 11203 1 61 . LEU . 11203 1 62 . VAL . 11203 1 63 . LYS . 11203 1 64 . ASN . 11203 1 65 . LEU . 11203 1 66 . ASN . 11203 1 67 . GLY . 11203 1 68 . LYS . 11203 1 69 . SER . 11203 1 70 . TYR . 11203 1 71 . SER . 11203 1 72 . MET . 11203 1 73 . ILE . 11203 1 74 . VAL . 11203 1 75 . ASN . 11203 1 76 . ASN . 11203 1 77 . LEU . 11203 1 78 . LEU . 11203 1 79 . LYS . 11203 1 80 . PRO . 11203 1 81 . ILE . 11203 1 82 . SER . 11203 1 83 . VAL . 11203 1 84 . GLU . 11203 1 85 . GLY . 11203 1 86 . SER . 11203 1 87 . SER . 11203 1 88 . LYS . 11203 1 89 . LYS . 11203 1 90 . VAL . 11203 1 91 . LYS . 11203 1 92 . THR . 11203 1 93 . ASP . 11203 1 94 . THR . 11203 1 95 . VAL . 11203 1 96 . LEU . 11203 1 97 . ILE . 11203 1 98 . LEU . 11203 1 99 . CYS . 11203 1 100 . ARG . 11203 1 101 . LYS . 11203 1 102 . LYS . 11203 1 103 . VAL . 11203 1 104 . GLU . 11203 1 105 . ASN . 11203 1 106 . THR . 11203 1 107 . ARG . 11203 1 108 . TRP . 11203 1 109 . ASP . 11203 1 110 . TYR . 11203 1 111 . LEU . 11203 1 112 . THR . 11203 1 113 . GLN . 11203 1 114 . VAL . 11203 1 115 . GLU . 11203 1 116 . LYS . 11203 1 117 . GLU . 11203 1 118 . CYS . 11203 1 119 . LYS . 11203 1 120 . GLU . 11203 1 121 . LYS . 11203 1 122 . SER . 11203 1 123 . GLY . 11203 1 124 . PRO . 11203 1 125 . SER . 11203 1 126 . SER . 11203 1 127 . GLY . 11203 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 11203 1 . SER 2 2 11203 1 . SER 3 3 11203 1 . GLY 4 4 11203 1 . SER 5 5 11203 1 . SER 6 6 11203 1 . GLY 7 7 11203 1 . VAL 8 8 11203 1 . VAL 9 9 11203 1 . ALA 10 10 11203 1 . PRO 11 11 11203 1 . ILE 12 12 11203 1 . THR 13 13 11203 1 . THR 14 14 11203 1 . GLY 15 15 11203 1 . TYR 16 16 11203 1 . THR 17 17 11203 1 . VAL 18 18 11203 1 . LYS 19 19 11203 1 . ILE 20 20 11203 1 . SER 21 21 11203 1 . ASN 22 22 11203 1 . TYR 23 23 11203 1 . GLY 24 24 11203 1 . TRP 25 25 11203 1 . ASP 26 26 11203 1 . GLN 27 27 11203 1 . SER 28 28 11203 1 . ASP 29 29 11203 1 . LYS 30 30 11203 1 . PHE 31 31 11203 1 . VAL 32 32 11203 1 . LYS 33 33 11203 1 . ILE 34 34 11203 1 . TYR 35 35 11203 1 . ILE 36 36 11203 1 . THR 37 37 11203 1 . LEU 38 38 11203 1 . THR 39 39 11203 1 . GLY 40 40 11203 1 . VAL 41 41 11203 1 . HIS 42 42 11203 1 . GLN 43 43 11203 1 . VAL 44 44 11203 1 . PRO 45 45 11203 1 . THR 46 46 11203 1 . GLU 47 47 11203 1 . ASN 48 48 11203 1 . VAL 49 49 11203 1 . GLN 50 50 11203 1 . VAL 51 51 11203 1 . HIS 52 52 11203 1 . PHE 53 53 11203 1 . THR 54 54 11203 1 . GLU 55 55 11203 1 . ARG 56 56 11203 1 . SER 57 57 11203 1 . PHE 58 58 11203 1 . ASP 59 59 11203 1 . LEU 60 60 11203 1 . LEU 61 61 11203 1 . VAL 62 62 11203 1 . LYS 63 63 11203 1 . ASN 64 64 11203 1 . LEU 65 65 11203 1 . ASN 66 66 11203 1 . GLY 67 67 11203 1 . LYS 68 68 11203 1 . SER 69 69 11203 1 . TYR 70 70 11203 1 . SER 71 71 11203 1 . MET 72 72 11203 1 . ILE 73 73 11203 1 . VAL 74 74 11203 1 . ASN 75 75 11203 1 . ASN 76 76 11203 1 . LEU 77 77 11203 1 . LEU 78 78 11203 1 . LYS 79 79 11203 1 . PRO 80 80 11203 1 . ILE 81 81 11203 1 . SER 82 82 11203 1 . VAL 83 83 11203 1 . GLU 84 84 11203 1 . GLY 85 85 11203 1 . SER 86 86 11203 1 . SER 87 87 11203 1 . LYS 88 88 11203 1 . LYS 89 89 11203 1 . VAL 90 90 11203 1 . LYS 91 91 11203 1 . THR 92 92 11203 1 . ASP 93 93 11203 1 . THR 94 94 11203 1 . VAL 95 95 11203 1 . LEU 96 96 11203 1 . ILE 97 97 11203 1 . LEU 98 98 11203 1 . CYS 99 99 11203 1 . ARG 100 100 11203 1 . LYS 101 101 11203 1 . LYS 102 102 11203 1 . VAL 103 103 11203 1 . GLU 104 104 11203 1 . ASN 105 105 11203 1 . THR 106 106 11203 1 . ARG 107 107 11203 1 . TRP 108 108 11203 1 . ASP 109 109 11203 1 . TYR 110 110 11203 1 . LEU 111 111 11203 1 . THR 112 112 11203 1 . GLN 113 113 11203 1 . VAL 114 114 11203 1 . GLU 115 115 11203 1 . LYS 116 116 11203 1 . GLU 117 117 11203 1 . CYS 118 118 11203 1 . LYS 119 119 11203 1 . GLU 120 120 11203 1 . LYS 121 121 11203 1 . SER 122 122 11203 1 . GLY 123 123 11203 1 . PRO 124 124 11203 1 . SER 125 125 11203 1 . SER 126 126 11203 1 . GLY 127 127 11203 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 11203 _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 . . . . . . . . . . . . . . . . . . . . . 11203 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 11203 _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 . . p040329-62 . . . . . . 11203 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11203 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.98mM 13C,15N-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% NaN3 ; _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 'CS domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 0.98 . . mM . . . . 11203 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11203 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11203 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11203 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11203 1 6 H2O . . . . . . solvent 90 . . % . . . . 11203 1 7 D2O . . . . . . solvent 10 . . % . . . . 11203 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 11203 _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 11203 1 pH 7.0 0.05 pH 11203 1 pressure 1 0.001 atm 11203 1 temperature 298 0.1 K 11203 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 11203 _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 . . 11203 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11203 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11203 _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.' . . 11203 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11203 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11203 _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.' . . 11203 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11203 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11203 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9296 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11203 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11203 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11203 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11203 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11203 5 'structure solution' 11203 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 11203 _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_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11203 _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 . . . 11203 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 11203 _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 . . . . . . . . . . . . . . . . 11203 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11203 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 11203 _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 . . . . . . . . . 11203 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11203 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11203 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 11203 _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 11203 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11203 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 . . 11203 1 2 $NMRPipe . . 11203 1 3 $NMRView . . 11203 1 4 $Kujira . . 11203 1 5 $CYANA . . 11203 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 HA H 1 4.491 0.030 . 1 . . . . 6 SER HA . 11203 1 2 . 1 1 6 6 SER HB2 H 1 3.917 0.030 . 1 . . . . 6 SER HB2 . 11203 1 3 . 1 1 6 6 SER HB3 H 1 3.917 0.030 . 1 . . . . 6 SER HB3 . 11203 1 4 . 1 1 6 6 SER C C 13 174.937 0.300 . 1 . . . . 6 SER C . 11203 1 5 . 1 1 6 6 SER CA C 13 58.751 0.300 . 1 . . . . 6 SER CA . 11203 1 6 . 1 1 6 6 SER CB C 13 63.909 0.300 . 1 . . . . 6 SER CB . 11203 1 7 . 1 1 7 7 GLY H H 1 8.383 0.030 . 1 . . . . 7 GLY H . 11203 1 8 . 1 1 7 7 GLY HA2 H 1 3.983 0.030 . 1 . . . . 7 GLY HA2 . 11203 1 9 . 1 1 7 7 GLY HA3 H 1 3.983 0.030 . 1 . . . . 7 GLY HA3 . 11203 1 10 . 1 1 7 7 GLY C C 13 173.817 0.300 . 1 . . . . 7 GLY C . 11203 1 11 . 1 1 7 7 GLY CA C 13 45.283 0.300 . 1 . . . . 7 GLY CA . 11203 1 12 . 1 1 7 7 GLY N N 15 110.776 0.300 . 1 . . . . 7 GLY N . 11203 1 13 . 1 1 8 8 VAL H H 1 7.955 0.030 . 1 . . . . 8 VAL H . 11203 1 14 . 1 1 8 8 VAL HA H 1 4.110 0.030 . 1 . . . . 8 VAL HA . 11203 1 15 . 1 1 8 8 VAL HB H 1 2.010 0.030 . 1 . . . . 8 VAL HB . 11203 1 16 . 1 1 8 8 VAL HG11 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11203 1 17 . 1 1 8 8 VAL HG12 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11203 1 18 . 1 1 8 8 VAL HG13 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11203 1 19 . 1 1 8 8 VAL HG21 H 1 0.888 0.030 . 1 . . . . 8 VAL HG2 . 11203 1 20 . 1 1 8 8 VAL HG22 H 1 0.888 0.030 . 1 . . . . 8 VAL HG2 . 11203 1 21 . 1 1 8 8 VAL HG23 H 1 0.888 0.030 . 1 . . . . 8 VAL HG2 . 11203 1 22 . 1 1 8 8 VAL C C 13 176.149 0.300 . 1 . . . . 8 VAL C . 11203 1 23 . 1 1 8 8 VAL CA C 13 62.242 0.300 . 1 . . . . 8 VAL CA . 11203 1 24 . 1 1 8 8 VAL CB C 13 32.845 0.300 . 1 . . . . 8 VAL CB . 11203 1 25 . 1 1 8 8 VAL CG1 C 13 20.636 0.300 . 2 . . . . 8 VAL CG1 . 11203 1 26 . 1 1 8 8 VAL CG2 C 13 21.140 0.300 . 2 . . . . 8 VAL CG2 . 11203 1 27 . 1 1 8 8 VAL N N 15 119.861 0.300 . 1 . . . . 8 VAL N . 11203 1 28 . 1 1 9 9 VAL H H 1 8.266 0.030 . 1 . . . . 9 VAL H . 11203 1 29 . 1 1 9 9 VAL HA H 1 4.097 0.030 . 1 . . . . 9 VAL HA . 11203 1 30 . 1 1 9 9 VAL HB H 1 2.008 0.030 . 1 . . . . 9 VAL HB . 11203 1 31 . 1 1 9 9 VAL HG11 H 1 0.883 0.030 . 1 . . . . 9 VAL HG1 . 11203 1 32 . 1 1 9 9 VAL HG12 H 1 0.883 0.030 . 1 . . . . 9 VAL HG1 . 11203 1 33 . 1 1 9 9 VAL HG13 H 1 0.883 0.030 . 1 . . . . 9 VAL HG1 . 11203 1 34 . 1 1 9 9 VAL HG21 H 1 0.903 0.030 . 1 . . . . 9 VAL HG2 . 11203 1 35 . 1 1 9 9 VAL HG22 H 1 0.903 0.030 . 1 . . . . 9 VAL HG2 . 11203 1 36 . 1 1 9 9 VAL HG23 H 1 0.903 0.030 . 1 . . . . 9 VAL HG2 . 11203 1 37 . 1 1 9 9 VAL C C 13 175.347 0.300 . 1 . . . . 9 VAL C . 11203 1 38 . 1 1 9 9 VAL CA C 13 62.012 0.300 . 1 . . . . 9 VAL CA . 11203 1 39 . 1 1 9 9 VAL CB C 13 32.803 0.300 . 1 . . . . 9 VAL CB . 11203 1 40 . 1 1 9 9 VAL CG1 C 13 21.175 0.300 . 2 . . . . 9 VAL CG1 . 11203 1 41 . 1 1 9 9 VAL CG2 C 13 20.620 0.300 . 2 . . . . 9 VAL CG2 . 11203 1 42 . 1 1 9 9 VAL N N 15 125.295 0.300 . 1 . . . . 9 VAL N . 11203 1 43 . 1 1 10 10 ALA H H 1 8.360 0.030 . 1 . . . . 10 ALA H . 11203 1 44 . 1 1 10 10 ALA HA H 1 4.568 0.030 . 1 . . . . 10 ALA HA . 11203 1 45 . 1 1 10 10 ALA HB1 H 1 1.327 0.030 . 1 . . . . 10 ALA HB . 11203 1 46 . 1 1 10 10 ALA HB2 H 1 1.327 0.030 . 1 . . . . 10 ALA HB . 11203 1 47 . 1 1 10 10 ALA HB3 H 1 1.327 0.030 . 1 . . . . 10 ALA HB . 11203 1 48 . 1 1 10 10 ALA C C 13 175.340 0.300 . 1 . . . . 10 ALA C . 11203 1 49 . 1 1 10 10 ALA CA C 13 50.349 0.300 . 1 . . . . 10 ALA CA . 11203 1 50 . 1 1 10 10 ALA CB C 13 18.271 0.300 . 1 . . . . 10 ALA CB . 11203 1 51 . 1 1 10 10 ALA N N 15 129.856 0.300 . 1 . . . . 10 ALA N . 11203 1 52 . 1 1 11 11 PRO HA H 1 4.418 0.030 . 1 . . . . 11 PRO HA . 11203 1 53 . 1 1 11 11 PRO HB2 H 1 2.246 0.030 . 2 . . . . 11 PRO HB2 . 11203 1 54 . 1 1 11 11 PRO HB3 H 1 1.847 0.030 . 2 . . . . 11 PRO HB3 . 11203 1 55 . 1 1 11 11 PRO HD2 H 1 3.780 0.030 . 2 . . . . 11 PRO HD2 . 11203 1 56 . 1 1 11 11 PRO HD3 H 1 3.618 0.030 . 2 . . . . 11 PRO HD3 . 11203 1 57 . 1 1 11 11 PRO HG2 H 1 1.982 0.030 . 1 . . . . 11 PRO HG2 . 11203 1 58 . 1 1 11 11 PRO HG3 H 1 1.982 0.030 . 1 . . . . 11 PRO HG3 . 11203 1 59 . 1 1 11 11 PRO C C 13 176.855 0.300 . 1 . . . . 11 PRO C . 11203 1 60 . 1 1 11 11 PRO CA C 13 62.857 0.300 . 1 . . . . 11 PRO CA . 11203 1 61 . 1 1 11 11 PRO CB C 13 32.096 0.300 . 1 . . . . 11 PRO CB . 11203 1 62 . 1 1 11 11 PRO CD C 13 50.514 0.300 . 1 . . . . 11 PRO CD . 11203 1 63 . 1 1 11 11 PRO CG C 13 27.344 0.300 . 1 . . . . 11 PRO CG . 11203 1 64 . 1 1 12 12 ILE H H 1 8.251 0.030 . 1 . . . . 12 ILE H . 11203 1 65 . 1 1 12 12 ILE HA H 1 4.195 0.030 . 1 . . . . 12 ILE HA . 11203 1 66 . 1 1 12 12 ILE HB H 1 1.844 0.030 . 1 . . . . 12 ILE HB . 11203 1 67 . 1 1 12 12 ILE HD11 H 1 0.843 0.030 . 1 . . . . 12 ILE HD1 . 11203 1 68 . 1 1 12 12 ILE HD12 H 1 0.843 0.030 . 1 . . . . 12 ILE HD1 . 11203 1 69 . 1 1 12 12 ILE HD13 H 1 0.843 0.030 . 1 . . . . 12 ILE HD1 . 11203 1 70 . 1 1 12 12 ILE HG12 H 1 1.488 0.030 . 2 . . . . 12 ILE HG12 . 11203 1 71 . 1 1 12 12 ILE HG13 H 1 1.193 0.030 . 2 . . . . 12 ILE HG13 . 11203 1 72 . 1 1 12 12 ILE HG21 H 1 0.899 0.030 . 1 . . . . 12 ILE HG2 . 11203 1 73 . 1 1 12 12 ILE HG22 H 1 0.899 0.030 . 1 . . . . 12 ILE HG2 . 11203 1 74 . 1 1 12 12 ILE HG23 H 1 0.899 0.030 . 1 . . . . 12 ILE HG2 . 11203 1 75 . 1 1 12 12 ILE C C 13 176.748 0.300 . 1 . . . . 12 ILE C . 11203 1 76 . 1 1 12 12 ILE CA C 13 61.263 0.300 . 1 . . . . 12 ILE CA . 11203 1 77 . 1 1 12 12 ILE CB C 13 38.761 0.300 . 1 . . . . 12 ILE CB . 11203 1 78 . 1 1 12 12 ILE CD1 C 13 13.075 0.300 . 1 . . . . 12 ILE CD1 . 11203 1 79 . 1 1 12 12 ILE CG1 C 13 27.387 0.300 . 1 . . . . 12 ILE CG1 . 11203 1 80 . 1 1 12 12 ILE CG2 C 13 17.715 0.300 . 1 . . . . 12 ILE CG2 . 11203 1 81 . 1 1 12 12 ILE N N 15 120.967 0.300 . 1 . . . . 12 ILE N . 11203 1 82 . 1 1 13 13 THR H H 1 8.240 0.030 . 1 . . . . 13 THR H . 11203 1 83 . 1 1 13 13 THR HA H 1 4.433 0.030 . 1 . . . . 13 THR HA . 11203 1 84 . 1 1 13 13 THR HB H 1 4.224 0.030 . 1 . . . . 13 THR HB . 11203 1 85 . 1 1 13 13 THR HG21 H 1 1.208 0.030 . 1 . . . . 13 THR HG2 . 11203 1 86 . 1 1 13 13 THR HG22 H 1 1.208 0.030 . 1 . . . . 13 THR HG2 . 11203 1 87 . 1 1 13 13 THR HG23 H 1 1.208 0.030 . 1 . . . . 13 THR HG2 . 11203 1 88 . 1 1 13 13 THR C C 13 174.620 0.300 . 1 . . . . 13 THR C . 11203 1 89 . 1 1 13 13 THR CA C 13 61.507 0.300 . 1 . . . . 13 THR CA . 11203 1 90 . 1 1 13 13 THR CB C 13 69.840 0.300 . 1 . . . . 13 THR CB . 11203 1 91 . 1 1 13 13 THR CG2 C 13 21.277 0.300 . 1 . . . . 13 THR CG2 . 11203 1 92 . 1 1 13 13 THR N N 15 117.940 0.300 . 1 . . . . 13 THR N . 11203 1 93 . 1 1 14 14 THR H H 1 8.112 0.030 . 1 . . . . 14 THR H . 11203 1 94 . 1 1 14 14 THR HA H 1 4.315 0.030 . 1 . . . . 14 THR HA . 11203 1 95 . 1 1 14 14 THR HB H 1 4.178 0.030 . 1 . . . . 14 THR HB . 11203 1 96 . 1 1 14 14 THR HG21 H 1 1.158 0.030 . 1 . . . . 14 THR HG2 . 11203 1 97 . 1 1 14 14 THR HG22 H 1 1.158 0.030 . 1 . . . . 14 THR HG2 . 11203 1 98 . 1 1 14 14 THR HG23 H 1 1.158 0.030 . 1 . . . . 14 THR HG2 . 11203 1 99 . 1 1 14 14 THR C C 13 174.894 0.300 . 1 . . . . 14 THR C . 11203 1 100 . 1 1 14 14 THR CA C 13 61.876 0.300 . 1 . . . . 14 THR CA . 11203 1 101 . 1 1 14 14 THR CB C 13 69.847 0.300 . 1 . . . . 14 THR CB . 11203 1 102 . 1 1 14 14 THR CG2 C 13 21.499 0.300 . 1 . . . . 14 THR CG2 . 11203 1 103 . 1 1 14 14 THR N N 15 115.931 0.300 . 1 . . . . 14 THR N . 11203 1 104 . 1 1 15 15 GLY H H 1 8.330 0.030 . 1 . . . . 15 GLY H . 11203 1 105 . 1 1 15 15 GLY HA2 H 1 3.907 0.030 . 1 . . . . 15 GLY HA2 . 11203 1 106 . 1 1 15 15 GLY HA3 H 1 3.907 0.030 . 1 . . . . 15 GLY HA3 . 11203 1 107 . 1 1 15 15 GLY C C 13 173.625 0.300 . 1 . . . . 15 GLY C . 11203 1 108 . 1 1 15 15 GLY CA C 13 45.279 0.300 . 1 . . . . 15 GLY CA . 11203 1 109 . 1 1 15 15 GLY N N 15 110.905 0.300 . 1 . . . . 15 GLY N . 11203 1 110 . 1 1 16 16 TYR H H 1 8.035 0.030 . 1 . . . . 16 TYR H . 11203 1 111 . 1 1 16 16 TYR HA H 1 4.600 0.030 . 1 . . . . 16 TYR HA . 11203 1 112 . 1 1 16 16 TYR HB2 H 1 3.026 0.030 . 2 . . . . 16 TYR HB2 . 11203 1 113 . 1 1 16 16 TYR HB3 H 1 2.963 0.030 . 2 . . . . 16 TYR HB3 . 11203 1 114 . 1 1 16 16 TYR HD1 H 1 7.067 0.030 . 1 . . . . 16 TYR HD1 . 11203 1 115 . 1 1 16 16 TYR HD2 H 1 7.067 0.030 . 1 . . . . 16 TYR HD2 . 11203 1 116 . 1 1 16 16 TYR HE1 H 1 6.791 0.030 . 1 . . . . 16 TYR HE1 . 11203 1 117 . 1 1 16 16 TYR HE2 H 1 6.791 0.030 . 1 . . . . 16 TYR HE2 . 11203 1 118 . 1 1 16 16 TYR C C 13 175.522 0.300 . 1 . . . . 16 TYR C . 11203 1 119 . 1 1 16 16 TYR CA C 13 57.903 0.300 . 1 . . . . 16 TYR CA . 11203 1 120 . 1 1 16 16 TYR CB C 13 39.050 0.300 . 1 . . . . 16 TYR CB . 11203 1 121 . 1 1 16 16 TYR CD1 C 13 133.016 0.300 . 1 . . . . 16 TYR CD1 . 11203 1 122 . 1 1 16 16 TYR CD2 C 13 133.016 0.300 . 1 . . . . 16 TYR CD2 . 11203 1 123 . 1 1 16 16 TYR CE1 C 13 118.236 0.300 . 1 . . . . 16 TYR CE1 . 11203 1 124 . 1 1 16 16 TYR CE2 C 13 118.236 0.300 . 1 . . . . 16 TYR CE2 . 11203 1 125 . 1 1 16 16 TYR N N 15 120.144 0.300 . 1 . . . . 16 TYR N . 11203 1 126 . 1 1 17 17 THR H H 1 8.006 0.030 . 1 . . . . 17 THR H . 11203 1 127 . 1 1 17 17 THR HA H 1 4.374 0.030 . 1 . . . . 17 THR HA . 11203 1 128 . 1 1 17 17 THR HB H 1 3.746 0.030 . 1 . . . . 17 THR HB . 11203 1 129 . 1 1 17 17 THR HG21 H 1 0.873 0.030 . 1 . . . . 17 THR HG2 . 11203 1 130 . 1 1 17 17 THR HG22 H 1 0.873 0.030 . 1 . . . . 17 THR HG2 . 11203 1 131 . 1 1 17 17 THR HG23 H 1 0.873 0.030 . 1 . . . . 17 THR HG2 . 11203 1 132 . 1 1 17 17 THR C C 13 173.392 0.300 . 1 . . . . 17 THR C . 11203 1 133 . 1 1 17 17 THR CA C 13 60.919 0.300 . 1 . . . . 17 THR CA . 11203 1 134 . 1 1 17 17 THR CB C 13 70.528 0.300 . 1 . . . . 17 THR CB . 11203 1 135 . 1 1 17 17 THR CG2 C 13 21.894 0.300 . 1 . . . . 17 THR CG2 . 11203 1 136 . 1 1 17 17 THR N N 15 117.474 0.300 . 1 . . . . 17 THR N . 11203 1 137 . 1 1 18 18 VAL H H 1 8.879 0.030 . 1 . . . . 18 VAL H . 11203 1 138 . 1 1 18 18 VAL HA H 1 3.954 0.030 . 1 . . . . 18 VAL HA . 11203 1 139 . 1 1 18 18 VAL HB H 1 1.696 0.030 . 1 . . . . 18 VAL HB . 11203 1 140 . 1 1 18 18 VAL HG11 H 1 0.974 0.030 . 1 . . . . 18 VAL HG1 . 11203 1 141 . 1 1 18 18 VAL HG12 H 1 0.974 0.030 . 1 . . . . 18 VAL HG1 . 11203 1 142 . 1 1 18 18 VAL HG13 H 1 0.974 0.030 . 1 . . . . 18 VAL HG1 . 11203 1 143 . 1 1 18 18 VAL HG21 H 1 0.724 0.030 . 1 . . . . 18 VAL HG2 . 11203 1 144 . 1 1 18 18 VAL HG22 H 1 0.724 0.030 . 1 . . . . 18 VAL HG2 . 11203 1 145 . 1 1 18 18 VAL HG23 H 1 0.724 0.030 . 1 . . . . 18 VAL HG2 . 11203 1 146 . 1 1 18 18 VAL C C 13 175.267 0.300 . 1 . . . . 18 VAL C . 11203 1 147 . 1 1 18 18 VAL CA C 13 61.785 0.300 . 1 . . . . 18 VAL CA . 11203 1 148 . 1 1 18 18 VAL CB C 13 32.969 0.300 . 1 . . . . 18 VAL CB . 11203 1 149 . 1 1 18 18 VAL CG1 C 13 21.279 0.300 . 2 . . . . 18 VAL CG1 . 11203 1 150 . 1 1 18 18 VAL CG2 C 13 21.239 0.300 . 2 . . . . 18 VAL CG2 . 11203 1 151 . 1 1 18 18 VAL N N 15 127.089 0.300 . 1 . . . . 18 VAL N . 11203 1 152 . 1 1 19 19 LYS H H 1 8.531 0.030 . 1 . . . . 19 LYS H . 11203 1 153 . 1 1 19 19 LYS HA H 1 4.886 0.030 . 1 . . . . 19 LYS HA . 11203 1 154 . 1 1 19 19 LYS HB2 H 1 1.797 0.030 . 1 . . . . 19 LYS HB2 . 11203 1 155 . 1 1 19 19 LYS HB3 H 1 1.797 0.030 . 1 . . . . 19 LYS HB3 . 11203 1 156 . 1 1 19 19 LYS HD2 H 1 1.690 0.030 . 1 . . . . 19 LYS HD2 . 11203 1 157 . 1 1 19 19 LYS HD3 H 1 1.690 0.030 . 1 . . . . 19 LYS HD3 . 11203 1 158 . 1 1 19 19 LYS HE2 H 1 3.000 0.030 . 2 . . . . 19 LYS HE2 . 11203 1 159 . 1 1 19 19 LYS HG2 H 1 1.543 0.030 . 2 . . . . 19 LYS HG2 . 11203 1 160 . 1 1 19 19 LYS HG3 H 1 1.355 0.030 . 2 . . . . 19 LYS HG3 . 11203 1 161 . 1 1 19 19 LYS C C 13 177.384 0.300 . 1 . . . . 19 LYS C . 11203 1 162 . 1 1 19 19 LYS CA C 13 55.890 0.300 . 1 . . . . 19 LYS CA . 11203 1 163 . 1 1 19 19 LYS CB C 13 32.689 0.300 . 1 . . . . 19 LYS CB . 11203 1 164 . 1 1 19 19 LYS CD C 13 29.221 0.300 . 1 . . . . 19 LYS CD . 11203 1 165 . 1 1 19 19 LYS CE C 13 42.175 0.300 . 1 . . . . 19 LYS CE . 11203 1 166 . 1 1 19 19 LYS CG C 13 25.024 0.300 . 1 . . . . 19 LYS CG . 11203 1 167 . 1 1 19 19 LYS N N 15 127.374 0.300 . 1 . . . . 19 LYS N . 11203 1 168 . 1 1 20 20 ILE H H 1 8.796 0.030 . 1 . . . . 20 ILE H . 11203 1 169 . 1 1 20 20 ILE HA H 1 4.292 0.030 . 1 . . . . 20 ILE HA . 11203 1 170 . 1 1 20 20 ILE HB H 1 1.904 0.030 . 1 . . . . 20 ILE HB . 11203 1 171 . 1 1 20 20 ILE HD11 H 1 0.850 0.030 . 1 . . . . 20 ILE HD1 . 11203 1 172 . 1 1 20 20 ILE HD12 H 1 0.850 0.030 . 1 . . . . 20 ILE HD1 . 11203 1 173 . 1 1 20 20 ILE HD13 H 1 0.850 0.030 . 1 . . . . 20 ILE HD1 . 11203 1 174 . 1 1 20 20 ILE HG12 H 1 1.248 0.030 . 2 . . . . 20 ILE HG12 . 11203 1 175 . 1 1 20 20 ILE HG13 H 1 1.840 0.030 . 2 . . . . 20 ILE HG13 . 11203 1 176 . 1 1 20 20 ILE HG21 H 1 1.169 0.030 . 1 . . . . 20 ILE HG2 . 11203 1 177 . 1 1 20 20 ILE HG22 H 1 1.169 0.030 . 1 . . . . 20 ILE HG2 . 11203 1 178 . 1 1 20 20 ILE HG23 H 1 1.169 0.030 . 1 . . . . 20 ILE HG2 . 11203 1 179 . 1 1 20 20 ILE C C 13 176.062 0.300 . 1 . . . . 20 ILE C . 11203 1 180 . 1 1 20 20 ILE CA C 13 61.829 0.300 . 1 . . . . 20 ILE CA . 11203 1 181 . 1 1 20 20 ILE CB C 13 39.115 0.300 . 1 . . . . 20 ILE CB . 11203 1 182 . 1 1 20 20 ILE CD1 C 13 14.102 0.300 . 1 . . . . 20 ILE CD1 . 11203 1 183 . 1 1 20 20 ILE CG1 C 13 27.799 0.300 . 1 . . . . 20 ILE CG1 . 11203 1 184 . 1 1 20 20 ILE CG2 C 13 18.599 0.300 . 1 . . . . 20 ILE CG2 . 11203 1 185 . 1 1 20 20 ILE N N 15 126.680 0.300 . 1 . . . . 20 ILE N . 11203 1 186 . 1 1 21 21 SER H H 1 8.864 0.030 . 1 . . . . 21 SER H . 11203 1 187 . 1 1 21 21 SER HA H 1 4.815 0.030 . 1 . . . . 21 SER HA . 11203 1 188 . 1 1 21 21 SER HB2 H 1 4.009 0.030 . 2 . . . . 21 SER HB2 . 11203 1 189 . 1 1 21 21 SER HB3 H 1 3.854 0.030 . 2 . . . . 21 SER HB3 . 11203 1 190 . 1 1 21 21 SER C C 13 173.591 0.300 . 1 . . . . 21 SER C . 11203 1 191 . 1 1 21 21 SER CA C 13 58.650 0.300 . 1 . . . . 21 SER CA . 11203 1 192 . 1 1 21 21 SER CB C 13 65.107 0.300 . 1 . . . . 21 SER CB . 11203 1 193 . 1 1 21 21 SER N N 15 119.722 0.300 . 1 . . . . 21 SER N . 11203 1 194 . 1 1 22 22 ASN HA H 1 5.029 0.030 . 1 . . . . 22 ASN HA . 11203 1 195 . 1 1 22 22 ASN HB2 H 1 2.882 0.030 . 2 . . . . 22 ASN HB2 . 11203 1 196 . 1 1 22 22 ASN HB3 H 1 2.794 0.030 . 2 . . . . 22 ASN HB3 . 11203 1 197 . 1 1 22 22 ASN HD21 H 1 7.675 0.030 . 2 . . . . 22 ASN HD21 . 11203 1 198 . 1 1 22 22 ASN HD22 H 1 6.994 0.030 . 2 . . . . 22 ASN HD22 . 11203 1 199 . 1 1 22 22 ASN C C 13 173.075 0.300 . 1 . . . . 22 ASN C . 11203 1 200 . 1 1 22 22 ASN CA C 13 53.168 0.300 . 1 . . . . 22 ASN CA . 11203 1 201 . 1 1 22 22 ASN CB C 13 40.304 0.300 . 1 . . . . 22 ASN CB . 11203 1 202 . 1 1 22 22 ASN ND2 N 15 113.062 0.300 . 1 . . . . 22 ASN ND2 . 11203 1 203 . 1 1 23 23 TYR H H 1 7.704 0.030 . 1 . . . . 23 TYR H . 11203 1 204 . 1 1 23 23 TYR HA H 1 5.205 0.030 . 1 . . . . 23 TYR HA . 11203 1 205 . 1 1 23 23 TYR HB2 H 1 3.068 0.030 . 1 . . . . 23 TYR HB2 . 11203 1 206 . 1 1 23 23 TYR HB3 H 1 3.068 0.030 . 1 . . . . 23 TYR HB3 . 11203 1 207 . 1 1 23 23 TYR HD1 H 1 6.794 0.030 . 1 . . . . 23 TYR HD1 . 11203 1 208 . 1 1 23 23 TYR HD2 H 1 6.794 0.030 . 1 . . . . 23 TYR HD2 . 11203 1 209 . 1 1 23 23 TYR HE1 H 1 6.759 0.030 . 1 . . . . 23 TYR HE1 . 11203 1 210 . 1 1 23 23 TYR HE2 H 1 6.759 0.030 . 1 . . . . 23 TYR HE2 . 11203 1 211 . 1 1 23 23 TYR C C 13 173.881 0.300 . 1 . . . . 23 TYR C . 11203 1 212 . 1 1 23 23 TYR CA C 13 56.555 0.300 . 1 . . . . 23 TYR CA . 11203 1 213 . 1 1 23 23 TYR CB C 13 40.021 0.300 . 1 . . . . 23 TYR CB . 11203 1 214 . 1 1 23 23 TYR CD1 C 13 133.333 0.300 . 1 . . . . 23 TYR CD1 . 11203 1 215 . 1 1 23 23 TYR CD2 C 13 133.333 0.300 . 1 . . . . 23 TYR CD2 . 11203 1 216 . 1 1 23 23 TYR CE1 C 13 117.803 0.300 . 1 . . . . 23 TYR CE1 . 11203 1 217 . 1 1 23 23 TYR CE2 C 13 117.803 0.300 . 1 . . . . 23 TYR CE2 . 11203 1 218 . 1 1 23 23 TYR N N 15 117.589 0.300 . 1 . . . . 23 TYR N . 11203 1 219 . 1 1 24 24 GLY H H 1 8.661 0.030 . 1 . . . . 24 GLY H . 11203 1 220 . 1 1 24 24 GLY HA2 H 1 4.862 0.030 . 2 . . . . 24 GLY HA2 . 11203 1 221 . 1 1 24 24 GLY HA3 H 1 3.935 0.030 . 2 . . . . 24 GLY HA3 . 11203 1 222 . 1 1 24 24 GLY C C 13 172.300 0.300 . 1 . . . . 24 GLY C . 11203 1 223 . 1 1 24 24 GLY CA C 13 43.939 0.300 . 1 . . . . 24 GLY CA . 11203 1 224 . 1 1 24 24 GLY N N 15 107.712 0.300 . 1 . . . . 24 GLY N . 11203 1 225 . 1 1 25 25 TRP H H 1 8.822 0.030 . 1 . . . . 25 TRP H . 11203 1 226 . 1 1 25 25 TRP HA H 1 6.242 0.030 . 1 . . . . 25 TRP HA . 11203 1 227 . 1 1 25 25 TRP HB2 H 1 3.726 0.030 . 2 . . . . 25 TRP HB2 . 11203 1 228 . 1 1 25 25 TRP HB3 H 1 3.342 0.030 . 2 . . . . 25 TRP HB3 . 11203 1 229 . 1 1 25 25 TRP HD1 H 1 7.446 0.030 . 1 . . . . 25 TRP HD1 . 11203 1 230 . 1 1 25 25 TRP HE1 H 1 10.558 0.030 . 1 . . . . 25 TRP HE1 . 11203 1 231 . 1 1 25 25 TRP HE3 H 1 7.531 0.030 . 1 . . . . 25 TRP HE3 . 11203 1 232 . 1 1 25 25 TRP HH2 H 1 6.791 0.030 . 1 . . . . 25 TRP HH2 . 11203 1 233 . 1 1 25 25 TRP HZ2 H 1 7.405 0.030 . 1 . . . . 25 TRP HZ2 . 11203 1 234 . 1 1 25 25 TRP HZ3 H 1 6.691 0.030 . 1 . . . . 25 TRP HZ3 . 11203 1 235 . 1 1 25 25 TRP C C 13 173.798 0.300 . 1 . . . . 25 TRP C . 11203 1 236 . 1 1 25 25 TRP CA C 13 56.397 0.300 . 1 . . . . 25 TRP CA . 11203 1 237 . 1 1 25 25 TRP CB C 13 32.555 0.300 . 1 . . . . 25 TRP CB . 11203 1 238 . 1 1 25 25 TRP CD1 C 13 126.353 0.300 . 1 . . . . 25 TRP CD1 . 11203 1 239 . 1 1 25 25 TRP CE3 C 13 120.660 0.300 . 1 . . . . 25 TRP CE3 . 11203 1 240 . 1 1 25 25 TRP CH2 C 13 123.315 0.300 . 1 . . . . 25 TRP CH2 . 11203 1 241 . 1 1 25 25 TRP CZ2 C 13 114.115 0.300 . 1 . . . . 25 TRP CZ2 . 11203 1 242 . 1 1 25 25 TRP CZ3 C 13 120.640 0.300 . 1 . . . . 25 TRP CZ3 . 11203 1 243 . 1 1 25 25 TRP N N 15 117.787 0.300 . 1 . . . . 25 TRP N . 11203 1 244 . 1 1 25 25 TRP NE1 N 15 130.637 0.300 . 1 . . . . 25 TRP NE1 . 11203 1 245 . 1 1 26 26 ASP H H 1 9.816 0.030 . 1 . . . . 26 ASP H . 11203 1 246 . 1 1 26 26 ASP HA H 1 4.164 0.030 . 1 . . . . 26 ASP HA . 11203 1 247 . 1 1 26 26 ASP HB2 H 1 2.955 0.030 . 2 . . . . 26 ASP HB2 . 11203 1 248 . 1 1 26 26 ASP HB3 H 1 2.783 0.030 . 2 . . . . 26 ASP HB3 . 11203 1 249 . 1 1 26 26 ASP C C 13 173.906 0.300 . 1 . . . . 26 ASP C . 11203 1 250 . 1 1 26 26 ASP CA C 13 53.234 0.300 . 1 . . . . 26 ASP CA . 11203 1 251 . 1 1 26 26 ASP CB C 13 42.554 0.300 . 1 . . . . 26 ASP CB . 11203 1 252 . 1 1 26 26 ASP N N 15 120.769 0.300 . 1 . . . . 26 ASP N . 11203 1 253 . 1 1 27 27 GLN H H 1 8.707 0.030 . 1 . . . . 27 GLN H . 11203 1 254 . 1 1 27 27 GLN HA H 1 5.451 0.030 . 1 . . . . 27 GLN HA . 11203 1 255 . 1 1 27 27 GLN HB2 H 1 2.053 0.030 . 2 . . . . 27 GLN HB2 . 11203 1 256 . 1 1 27 27 GLN HB3 H 1 2.374 0.030 . 2 . . . . 27 GLN HB3 . 11203 1 257 . 1 1 27 27 GLN HE21 H 1 8.739 0.030 . 2 . . . . 27 GLN HE21 . 11203 1 258 . 1 1 27 27 GLN HE22 H 1 8.197 0.030 . 2 . . . . 27 GLN HE22 . 11203 1 259 . 1 1 27 27 GLN HG2 H 1 2.334 0.030 . 2 . . . . 27 GLN HG2 . 11203 1 260 . 1 1 27 27 GLN HG3 H 1 2.046 0.030 . 2 . . . . 27 GLN HG3 . 11203 1 261 . 1 1 27 27 GLN C C 13 172.827 0.300 . 1 . . . . 27 GLN C . 11203 1 262 . 1 1 27 27 GLN CA C 13 54.634 0.300 . 1 . . . . 27 GLN CA . 11203 1 263 . 1 1 27 27 GLN CB C 13 33.969 0.300 . 1 . . . . 27 GLN CB . 11203 1 264 . 1 1 27 27 GLN CG C 13 32.380 0.300 . 1 . . . . 27 GLN CG . 11203 1 265 . 1 1 27 27 GLN N N 15 112.156 0.300 . 1 . . . . 27 GLN N . 11203 1 266 . 1 1 27 27 GLN NE2 N 15 117.196 0.300 . 1 . . . . 27 GLN NE2 . 11203 1 267 . 1 1 28 28 SER H H 1 9.709 0.030 . 1 . . . . 28 SER H . 11203 1 268 . 1 1 28 28 SER HA H 1 5.030 0.030 . 1 . . . . 28 SER HA . 11203 1 269 . 1 1 28 28 SER HB2 H 1 4.542 0.030 . 2 . . . . 28 SER HB2 . 11203 1 270 . 1 1 28 28 SER HB3 H 1 3.866 0.030 . 2 . . . . 28 SER HB3 . 11203 1 271 . 1 1 28 28 SER C C 13 174.484 0.300 . 1 . . . . 28 SER C . 11203 1 272 . 1 1 28 28 SER CA C 13 55.327 0.300 . 1 . . . . 28 SER CA . 11203 1 273 . 1 1 28 28 SER CB C 13 67.597 0.300 . 1 . . . . 28 SER CB . 11203 1 274 . 1 1 28 28 SER N N 15 117.733 0.300 . 1 . . . . 28 SER N . 11203 1 275 . 1 1 29 29 ASP HA H 1 4.421 0.030 . 1 . . . . 29 ASP HA . 11203 1 276 . 1 1 29 29 ASP HB2 H 1 3.061 0.030 . 2 . . . . 29 ASP HB2 . 11203 1 277 . 1 1 29 29 ASP HB3 H 1 2.673 0.030 . 2 . . . . 29 ASP HB3 . 11203 1 278 . 1 1 29 29 ASP C C 13 176.951 0.300 . 1 . . . . 29 ASP C . 11203 1 279 . 1 1 29 29 ASP CA C 13 57.831 0.300 . 1 . . . . 29 ASP CA . 11203 1 280 . 1 1 29 29 ASP CB C 13 39.943 0.300 . 1 . . . . 29 ASP CB . 11203 1 281 . 1 1 30 30 LYS H H 1 7.747 0.030 . 1 . . . . 30 LYS H . 11203 1 282 . 1 1 30 30 LYS HA H 1 4.351 0.030 . 1 . . . . 30 LYS HA . 11203 1 283 . 1 1 30 30 LYS HB2 H 1 1.547 0.030 . 2 . . . . 30 LYS HB2 . 11203 1 284 . 1 1 30 30 LYS HB3 H 1 1.172 0.030 . 2 . . . . 30 LYS HB3 . 11203 1 285 . 1 1 30 30 LYS HD2 H 1 1.537 0.030 . 2 . . . . 30 LYS HD2 . 11203 1 286 . 1 1 30 30 LYS HD3 H 1 1.484 0.030 . 2 . . . . 30 LYS HD3 . 11203 1 287 . 1 1 30 30 LYS HE2 H 1 2.929 0.030 . 1 . . . . 30 LYS HE2 . 11203 1 288 . 1 1 30 30 LYS HE3 H 1 2.929 0.030 . 1 . . . . 30 LYS HE3 . 11203 1 289 . 1 1 30 30 LYS HG2 H 1 1.306 0.030 . 2 . . . . 30 LYS HG2 . 11203 1 290 . 1 1 30 30 LYS HG3 H 1 1.035 0.030 . 2 . . . . 30 LYS HG3 . 11203 1 291 . 1 1 30 30 LYS C C 13 175.722 0.300 . 1 . . . . 30 LYS C . 11203 1 292 . 1 1 30 30 LYS CA C 13 57.117 0.300 . 1 . . . . 30 LYS CA . 11203 1 293 . 1 1 30 30 LYS CB C 13 36.600 0.300 . 1 . . . . 30 LYS CB . 11203 1 294 . 1 1 30 30 LYS CD C 13 29.299 0.300 . 1 . . . . 30 LYS CD . 11203 1 295 . 1 1 30 30 LYS CE C 13 42.054 0.300 . 1 . . . . 30 LYS CE . 11203 1 296 . 1 1 30 30 LYS CG C 13 25.893 0.300 . 1 . . . . 30 LYS CG . 11203 1 297 . 1 1 30 30 LYS N N 15 113.708 0.300 . 1 . . . . 30 LYS N . 11203 1 298 . 1 1 31 31 PHE H H 1 7.594 0.030 . 1 . . . . 31 PHE H . 11203 1 299 . 1 1 31 31 PHE HA H 1 5.380 0.030 . 1 . . . . 31 PHE HA . 11203 1 300 . 1 1 31 31 PHE HB2 H 1 2.631 0.030 . 2 . . . . 31 PHE HB2 . 11203 1 301 . 1 1 31 31 PHE HB3 H 1 2.499 0.030 . 2 . . . . 31 PHE HB3 . 11203 1 302 . 1 1 31 31 PHE HD1 H 1 6.863 0.030 . 1 . . . . 31 PHE HD1 . 11203 1 303 . 1 1 31 31 PHE HD2 H 1 6.863 0.030 . 1 . . . . 31 PHE HD2 . 11203 1 304 . 1 1 31 31 PHE HE1 H 1 7.269 0.030 . 1 . . . . 31 PHE HE1 . 11203 1 305 . 1 1 31 31 PHE HE2 H 1 7.269 0.030 . 1 . . . . 31 PHE HE2 . 11203 1 306 . 1 1 31 31 PHE HZ H 1 7.343 0.030 . 1 . . . . 31 PHE HZ . 11203 1 307 . 1 1 31 31 PHE C C 13 175.139 0.300 . 1 . . . . 31 PHE C . 11203 1 308 . 1 1 31 31 PHE CA C 13 57.035 0.300 . 1 . . . . 31 PHE CA . 11203 1 309 . 1 1 31 31 PHE CB C 13 44.039 0.300 . 1 . . . . 31 PHE CB . 11203 1 310 . 1 1 31 31 PHE CD1 C 13 131.876 0.300 . 1 . . . . 31 PHE CD1 . 11203 1 311 . 1 1 31 31 PHE CD2 C 13 131.876 0.300 . 1 . . . . 31 PHE CD2 . 11203 1 312 . 1 1 31 31 PHE CE1 C 13 131.649 0.300 . 1 . . . . 31 PHE CE1 . 11203 1 313 . 1 1 31 31 PHE CE2 C 13 131.649 0.300 . 1 . . . . 31 PHE CE2 . 11203 1 314 . 1 1 31 31 PHE CZ C 13 130.228 0.300 . 1 . . . . 31 PHE CZ . 11203 1 315 . 1 1 31 31 PHE N N 15 115.214 0.300 . 1 . . . . 31 PHE N . 11203 1 316 . 1 1 32 32 VAL H H 1 9.290 0.030 . 1 . . . . 32 VAL H . 11203 1 317 . 1 1 32 32 VAL HA H 1 4.142 0.030 . 1 . . . . 32 VAL HA . 11203 1 318 . 1 1 32 32 VAL HB H 1 1.332 0.030 . 1 . . . . 32 VAL HB . 11203 1 319 . 1 1 32 32 VAL HG11 H 1 0.652 0.030 . 1 . . . . 32 VAL HG1 . 11203 1 320 . 1 1 32 32 VAL HG12 H 1 0.652 0.030 . 1 . . . . 32 VAL HG1 . 11203 1 321 . 1 1 32 32 VAL HG13 H 1 0.652 0.030 . 1 . . . . 32 VAL HG1 . 11203 1 322 . 1 1 32 32 VAL HG21 H 1 -0.568 0.030 . 1 . . . . 32 VAL HG2 . 11203 1 323 . 1 1 32 32 VAL HG22 H 1 -0.568 0.030 . 1 . . . . 32 VAL HG2 . 11203 1 324 . 1 1 32 32 VAL HG23 H 1 -0.568 0.030 . 1 . . . . 32 VAL HG2 . 11203 1 325 . 1 1 32 32 VAL C C 13 173.871 0.300 . 1 . . . . 32 VAL C . 11203 1 326 . 1 1 32 32 VAL CA C 13 63.504 0.300 . 1 . . . . 32 VAL CA . 11203 1 327 . 1 1 32 32 VAL CB C 13 33.200 0.300 . 1 . . . . 32 VAL CB . 11203 1 328 . 1 1 32 32 VAL CG1 C 13 21.659 0.300 . 2 . . . . 32 VAL CG1 . 11203 1 329 . 1 1 32 32 VAL CG2 C 13 20.259 0.300 . 2 . . . . 32 VAL CG2 . 11203 1 330 . 1 1 32 32 VAL N N 15 122.577 0.300 . 1 . . . . 32 VAL N . 11203 1 331 . 1 1 33 33 LYS H H 1 9.142 0.030 . 1 . . . . 33 LYS H . 11203 1 332 . 1 1 33 33 LYS HA H 1 5.127 0.030 . 1 . . . . 33 LYS HA . 11203 1 333 . 1 1 33 33 LYS HB2 H 1 1.742 0.030 . 2 . . . . 33 LYS HB2 . 11203 1 334 . 1 1 33 33 LYS HB3 H 1 1.271 0.030 . 2 . . . . 33 LYS HB3 . 11203 1 335 . 1 1 33 33 LYS HD2 H 1 1.562 0.030 . 2 . . . . 33 LYS HD2 . 11203 1 336 . 1 1 33 33 LYS HD3 H 1 1.523 0.030 . 2 . . . . 33 LYS HD3 . 11203 1 337 . 1 1 33 33 LYS HE2 H 1 2.717 0.030 . 2 . . . . 33 LYS HE2 . 11203 1 338 . 1 1 33 33 LYS HE3 H 1 2.609 0.030 . 2 . . . . 33 LYS HE3 . 11203 1 339 . 1 1 33 33 LYS HG2 H 1 1.120 0.030 . 2 . . . . 33 LYS HG2 . 11203 1 340 . 1 1 33 33 LYS HG3 H 1 0.982 0.030 . 2 . . . . 33 LYS HG3 . 11203 1 341 . 1 1 33 33 LYS C C 13 173.911 0.300 . 1 . . . . 33 LYS C . 11203 1 342 . 1 1 33 33 LYS CA C 13 55.044 0.300 . 1 . . . . 33 LYS CA . 11203 1 343 . 1 1 33 33 LYS CB C 13 34.191 0.300 . 1 . . . . 33 LYS CB . 11203 1 344 . 1 1 33 33 LYS CD C 13 29.710 0.300 . 1 . . . . 33 LYS CD . 11203 1 345 . 1 1 33 33 LYS CE C 13 42.016 0.300 . 1 . . . . 33 LYS CE . 11203 1 346 . 1 1 33 33 LYS CG C 13 25.740 0.300 . 1 . . . . 33 LYS CG . 11203 1 347 . 1 1 33 33 LYS N N 15 128.141 0.300 . 1 . . . . 33 LYS N . 11203 1 348 . 1 1 34 34 ILE H H 1 8.974 0.030 . 1 . . . . 34 ILE H . 11203 1 349 . 1 1 34 34 ILE HA H 1 4.978 0.030 . 1 . . . . 34 ILE HA . 11203 1 350 . 1 1 34 34 ILE HB H 1 1.593 0.030 . 1 . . . . 34 ILE HB . 11203 1 351 . 1 1 34 34 ILE HD11 H 1 0.782 0.030 . 1 . . . . 34 ILE HD1 . 11203 1 352 . 1 1 34 34 ILE HD12 H 1 0.782 0.030 . 1 . . . . 34 ILE HD1 . 11203 1 353 . 1 1 34 34 ILE HD13 H 1 0.782 0.030 . 1 . . . . 34 ILE HD1 . 11203 1 354 . 1 1 34 34 ILE HG12 H 1 1.355 0.030 . 2 . . . . 34 ILE HG12 . 11203 1 355 . 1 1 34 34 ILE HG13 H 1 1.226 0.030 . 2 . . . . 34 ILE HG13 . 11203 1 356 . 1 1 34 34 ILE HG21 H 1 0.911 0.030 . 1 . . . . 34 ILE HG2 . 11203 1 357 . 1 1 34 34 ILE HG22 H 1 0.911 0.030 . 1 . . . . 34 ILE HG2 . 11203 1 358 . 1 1 34 34 ILE HG23 H 1 0.911 0.030 . 1 . . . . 34 ILE HG2 . 11203 1 359 . 1 1 34 34 ILE C C 13 174.361 0.300 . 1 . . . . 34 ILE C . 11203 1 360 . 1 1 34 34 ILE CA C 13 60.490 0.300 . 1 . . . . 34 ILE CA . 11203 1 361 . 1 1 34 34 ILE CB C 13 39.744 0.300 . 1 . . . . 34 ILE CB . 11203 1 362 . 1 1 34 34 ILE CD1 C 13 16.467 0.300 . 1 . . . . 34 ILE CD1 . 11203 1 363 . 1 1 34 34 ILE CG1 C 13 29.902 0.300 . 1 . . . . 34 ILE CG1 . 11203 1 364 . 1 1 34 34 ILE CG2 C 13 20.331 0.300 . 1 . . . . 34 ILE CG2 . 11203 1 365 . 1 1 34 34 ILE N N 15 123.472 0.300 . 1 . . . . 34 ILE N . 11203 1 366 . 1 1 35 35 TYR H H 1 9.113 0.030 . 1 . . . . 35 TYR H . 11203 1 367 . 1 1 35 35 TYR HA H 1 4.940 0.030 . 1 . . . . 35 TYR HA . 11203 1 368 . 1 1 35 35 TYR HB2 H 1 2.803 0.030 . 2 . . . . 35 TYR HB2 . 11203 1 369 . 1 1 35 35 TYR HB3 H 1 2.731 0.030 . 2 . . . . 35 TYR HB3 . 11203 1 370 . 1 1 35 35 TYR HD1 H 1 6.832 0.030 . 1 . . . . 35 TYR HD1 . 11203 1 371 . 1 1 35 35 TYR HD2 H 1 6.832 0.030 . 1 . . . . 35 TYR HD2 . 11203 1 372 . 1 1 35 35 TYR HE1 H 1 6.618 0.030 . 1 . . . . 35 TYR HE1 . 11203 1 373 . 1 1 35 35 TYR HE2 H 1 6.618 0.030 . 1 . . . . 35 TYR HE2 . 11203 1 374 . 1 1 35 35 TYR C C 13 175.773 0.300 . 1 . . . . 35 TYR C . 11203 1 375 . 1 1 35 35 TYR CA C 13 56.361 0.300 . 1 . . . . 35 TYR CA . 11203 1 376 . 1 1 35 35 TYR CB C 13 39.773 0.300 . 1 . . . . 35 TYR CB . 11203 1 377 . 1 1 35 35 TYR CD1 C 13 133.400 0.300 . 1 . . . . 35 TYR CD1 . 11203 1 378 . 1 1 35 35 TYR CD2 C 13 133.400 0.300 . 1 . . . . 35 TYR CD2 . 11203 1 379 . 1 1 35 35 TYR CE1 C 13 117.918 0.300 . 1 . . . . 35 TYR CE1 . 11203 1 380 . 1 1 35 35 TYR CE2 C 13 117.918 0.300 . 1 . . . . 35 TYR CE2 . 11203 1 381 . 1 1 35 35 TYR N N 15 124.804 0.300 . 1 . . . . 35 TYR N . 11203 1 382 . 1 1 36 36 ILE H H 1 9.179 0.030 . 1 . . . . 36 ILE H . 11203 1 383 . 1 1 36 36 ILE HA H 1 4.536 0.030 . 1 . . . . 36 ILE HA . 11203 1 384 . 1 1 36 36 ILE HB H 1 1.920 0.030 . 1 . . . . 36 ILE HB . 11203 1 385 . 1 1 36 36 ILE HD11 H 1 0.812 0.030 . 1 . . . . 36 ILE HD1 . 11203 1 386 . 1 1 36 36 ILE HD12 H 1 0.812 0.030 . 1 . . . . 36 ILE HD1 . 11203 1 387 . 1 1 36 36 ILE HD13 H 1 0.812 0.030 . 1 . . . . 36 ILE HD1 . 11203 1 388 . 1 1 36 36 ILE HG12 H 1 1.488 0.030 . 2 . . . . 36 ILE HG12 . 11203 1 389 . 1 1 36 36 ILE HG13 H 1 1.141 0.030 . 2 . . . . 36 ILE HG13 . 11203 1 390 . 1 1 36 36 ILE HG21 H 1 0.900 0.030 . 1 . . . . 36 ILE HG2 . 11203 1 391 . 1 1 36 36 ILE HG22 H 1 0.900 0.030 . 1 . . . . 36 ILE HG2 . 11203 1 392 . 1 1 36 36 ILE HG23 H 1 0.900 0.030 . 1 . . . . 36 ILE HG2 . 11203 1 393 . 1 1 36 36 ILE C C 13 175.255 0.300 . 1 . . . . 36 ILE C . 11203 1 394 . 1 1 36 36 ILE CA C 13 60.609 0.300 . 1 . . . . 36 ILE CA . 11203 1 395 . 1 1 36 36 ILE CB C 13 41.132 0.300 . 1 . . . . 36 ILE CB . 11203 1 396 . 1 1 36 36 ILE CD1 C 13 16.330 0.300 . 1 . . . . 36 ILE CD1 . 11203 1 397 . 1 1 36 36 ILE CG1 C 13 28.816 0.300 . 1 . . . . 36 ILE CG1 . 11203 1 398 . 1 1 36 36 ILE CG2 C 13 19.103 0.300 . 1 . . . . 36 ILE CG2 . 11203 1 399 . 1 1 36 36 ILE N N 15 126.043 0.300 . 1 . . . . 36 ILE N . 11203 1 400 . 1 1 37 37 THR H H 1 8.855 0.030 . 1 . . . . 37 THR H . 11203 1 401 . 1 1 37 37 THR HA H 1 4.785 0.030 . 1 . . . . 37 THR HA . 11203 1 402 . 1 1 37 37 THR HB H 1 4.006 0.030 . 1 . . . . 37 THR HB . 11203 1 403 . 1 1 37 37 THR HG21 H 1 1.259 0.030 . 1 . . . . 37 THR HG2 . 11203 1 404 . 1 1 37 37 THR HG22 H 1 1.259 0.030 . 1 . . . . 37 THR HG2 . 11203 1 405 . 1 1 37 37 THR HG23 H 1 1.259 0.030 . 1 . . . . 37 THR HG2 . 11203 1 406 . 1 1 37 37 THR C C 13 173.673 0.300 . 1 . . . . 37 THR C . 11203 1 407 . 1 1 37 37 THR CA C 13 62.992 0.300 . 1 . . . . 37 THR CA . 11203 1 408 . 1 1 37 37 THR CB C 13 69.364 0.300 . 1 . . . . 37 THR CB . 11203 1 409 . 1 1 37 37 THR CG2 C 13 21.105 0.300 . 1 . . . . 37 THR CG2 . 11203 1 410 . 1 1 37 37 THR N N 15 125.710 0.300 . 1 . . . . 37 THR N . 11203 1 411 . 1 1 38 38 LEU H H 1 8.173 0.030 . 1 . . . . 38 LEU H . 11203 1 412 . 1 1 38 38 LEU HA H 1 4.395 0.030 . 1 . . . . 38 LEU HA . 11203 1 413 . 1 1 38 38 LEU HB2 H 1 1.148 0.030 . 2 . . . . 38 LEU HB2 . 11203 1 414 . 1 1 38 38 LEU HB3 H 1 1.068 0.030 . 2 . . . . 38 LEU HB3 . 11203 1 415 . 1 1 38 38 LEU HD11 H 1 0.293 0.030 . 1 . . . . 38 LEU HD1 . 11203 1 416 . 1 1 38 38 LEU HD12 H 1 0.293 0.030 . 1 . . . . 38 LEU HD1 . 11203 1 417 . 1 1 38 38 LEU HD13 H 1 0.293 0.030 . 1 . . . . 38 LEU HD1 . 11203 1 418 . 1 1 38 38 LEU HD21 H 1 0.277 0.030 . 1 . . . . 38 LEU HD2 . 11203 1 419 . 1 1 38 38 LEU HD22 H 1 0.277 0.030 . 1 . . . . 38 LEU HD2 . 11203 1 420 . 1 1 38 38 LEU HD23 H 1 0.277 0.030 . 1 . . . . 38 LEU HD2 . 11203 1 421 . 1 1 38 38 LEU HG H 1 1.055 0.030 . 1 . . . . 38 LEU HG . 11203 1 422 . 1 1 38 38 LEU C C 13 174.275 0.300 . 1 . . . . 38 LEU C . 11203 1 423 . 1 1 38 38 LEU CA C 13 53.781 0.300 . 1 . . . . 38 LEU CA . 11203 1 424 . 1 1 38 38 LEU CB C 13 44.345 0.300 . 1 . . . . 38 LEU CB . 11203 1 425 . 1 1 38 38 LEU CD1 C 13 24.856 0.300 . 2 . . . . 38 LEU CD1 . 11203 1 426 . 1 1 38 38 LEU CD2 C 13 23.980 0.300 . 2 . . . . 38 LEU CD2 . 11203 1 427 . 1 1 38 38 LEU CG C 13 26.403 0.300 . 1 . . . . 38 LEU CG . 11203 1 428 . 1 1 38 38 LEU N N 15 131.127 0.300 . 1 . . . . 38 LEU N . 11203 1 429 . 1 1 39 39 THR H H 1 8.503 0.030 . 1 . . . . 39 THR H . 11203 1 430 . 1 1 39 39 THR HA H 1 3.808 0.030 . 1 . . . . 39 THR HA . 11203 1 431 . 1 1 39 39 THR HB H 1 3.871 0.030 . 1 . . . . 39 THR HB . 11203 1 432 . 1 1 39 39 THR HG21 H 1 1.211 0.030 . 1 . . . . 39 THR HG2 . 11203 1 433 . 1 1 39 39 THR HG22 H 1 1.211 0.030 . 1 . . . . 39 THR HG2 . 11203 1 434 . 1 1 39 39 THR HG23 H 1 1.211 0.030 . 1 . . . . 39 THR HG2 . 11203 1 435 . 1 1 39 39 THR C C 13 175.957 0.300 . 1 . . . . 39 THR C . 11203 1 436 . 1 1 39 39 THR CA C 13 65.212 0.300 . 1 . . . . 39 THR CA . 11203 1 437 . 1 1 39 39 THR CB C 13 68.748 0.300 . 1 . . . . 39 THR CB . 11203 1 438 . 1 1 39 39 THR CG2 C 13 21.892 0.300 . 1 . . . . 39 THR CG2 . 11203 1 439 . 1 1 39 39 THR N N 15 123.231 0.300 . 1 . . . . 39 THR N . 11203 1 440 . 1 1 40 40 GLY H H 1 10.010 0.030 . 1 . . . . 40 GLY H . 11203 1 441 . 1 1 40 40 GLY HA2 H 1 4.211 0.030 . 2 . . . . 40 GLY HA2 . 11203 1 442 . 1 1 40 40 GLY HA3 H 1 3.562 0.030 . 2 . . . . 40 GLY HA3 . 11203 1 443 . 1 1 40 40 GLY C C 13 177.370 0.300 . 1 . . . . 40 GLY C . 11203 1 444 . 1 1 40 40 GLY CA C 13 45.748 0.300 . 1 . . . . 40 GLY CA . 11203 1 445 . 1 1 40 40 GLY N N 15 112.840 0.300 . 1 . . . . 40 GLY N . 11203 1 446 . 1 1 41 41 VAL H H 1 8.136 0.030 . 1 . . . . 41 VAL H . 11203 1 447 . 1 1 41 41 VAL HA H 1 3.773 0.030 . 1 . . . . 41 VAL HA . 11203 1 448 . 1 1 41 41 VAL HB H 1 2.049 0.030 . 1 . . . . 41 VAL HB . 11203 1 449 . 1 1 41 41 VAL HG11 H 1 0.951 0.030 . 1 . . . . 41 VAL HG1 . 11203 1 450 . 1 1 41 41 VAL HG12 H 1 0.951 0.030 . 1 . . . . 41 VAL HG1 . 11203 1 451 . 1 1 41 41 VAL HG13 H 1 0.951 0.030 . 1 . . . . 41 VAL HG1 . 11203 1 452 . 1 1 41 41 VAL HG21 H 1 1.076 0.030 . 1 . . . . 41 VAL HG2 . 11203 1 453 . 1 1 41 41 VAL HG22 H 1 1.076 0.030 . 1 . . . . 41 VAL HG2 . 11203 1 454 . 1 1 41 41 VAL HG23 H 1 1.076 0.030 . 1 . . . . 41 VAL HG2 . 11203 1 455 . 1 1 41 41 VAL C C 13 173.659 0.300 . 1 . . . . 41 VAL C . 11203 1 456 . 1 1 41 41 VAL CA C 13 64.770 0.300 . 1 . . . . 41 VAL CA . 11203 1 457 . 1 1 41 41 VAL CB C 13 31.164 0.300 . 1 . . . . 41 VAL CB . 11203 1 458 . 1 1 41 41 VAL CG1 C 13 22.818 0.300 . 2 . . . . 41 VAL CG1 . 11203 1 459 . 1 1 41 41 VAL CG2 C 13 20.389 0.300 . 2 . . . . 41 VAL CG2 . 11203 1 460 . 1 1 41 41 VAL N N 15 121.139 0.300 . 1 . . . . 41 VAL N . 11203 1 461 . 1 1 42 42 HIS H H 1 8.769 0.030 . 1 . . . . 42 HIS H . 11203 1 462 . 1 1 42 42 HIS HA H 1 4.422 0.030 . 1 . . . . 42 HIS HA . 11203 1 463 . 1 1 42 42 HIS HB2 H 1 3.224 0.030 . 2 . . . . 42 HIS HB2 . 11203 1 464 . 1 1 42 42 HIS HB3 H 1 3.002 0.030 . 2 . . . . 42 HIS HB3 . 11203 1 465 . 1 1 42 42 HIS HD2 H 1 7.084 0.030 . 1 . . . . 42 HIS HD2 . 11203 1 466 . 1 1 42 42 HIS HE1 H 1 8.213 0.030 . 1 . . . . 42 HIS HE1 . 11203 1 467 . 1 1 42 42 HIS C C 13 175.696 0.300 . 1 . . . . 42 HIS C . 11203 1 468 . 1 1 42 42 HIS CA C 13 57.409 0.300 . 1 . . . . 42 HIS CA . 11203 1 469 . 1 1 42 42 HIS CB C 13 29.040 0.300 . 1 . . . . 42 HIS CB . 11203 1 470 . 1 1 42 42 HIS CD2 C 13 118.856 0.300 . 1 . . . . 42 HIS CD2 . 11203 1 471 . 1 1 42 42 HIS CE1 C 13 140.963 0.300 . 1 . . . . 42 HIS CE1 . 11203 1 472 . 1 1 42 42 HIS N N 15 117.316 0.300 . 1 . . . . 42 HIS N . 11203 1 473 . 1 1 43 43 GLN H H 1 7.530 0.030 . 1 . . . . 43 GLN H . 11203 1 474 . 1 1 43 43 GLN HA H 1 4.334 0.030 . 1 . . . . 43 GLN HA . 11203 1 475 . 1 1 43 43 GLN HB2 H 1 2.115 0.030 . 2 . . . . 43 GLN HB2 . 11203 1 476 . 1 1 43 43 GLN HB3 H 1 1.839 0.030 . 2 . . . . 43 GLN HB3 . 11203 1 477 . 1 1 43 43 GLN HE21 H 1 7.269 0.030 . 2 . . . . 43 GLN HE21 . 11203 1 478 . 1 1 43 43 GLN HE22 H 1 6.825 0.030 . 2 . . . . 43 GLN HE22 . 11203 1 479 . 1 1 43 43 GLN HG2 H 1 1.860 0.030 . 2 . . . . 43 GLN HG2 . 11203 1 480 . 1 1 43 43 GLN HG3 H 1 1.368 0.030 . 2 . . . . 43 GLN HG3 . 11203 1 481 . 1 1 43 43 GLN C C 13 176.510 0.300 . 1 . . . . 43 GLN C . 11203 1 482 . 1 1 43 43 GLN CA C 13 55.529 0.300 . 1 . . . . 43 GLN CA . 11203 1 483 . 1 1 43 43 GLN CB C 13 29.016 0.300 . 1 . . . . 43 GLN CB . 11203 1 484 . 1 1 43 43 GLN CG C 13 33.669 0.300 . 1 . . . . 43 GLN CG . 11203 1 485 . 1 1 43 43 GLN N N 15 118.096 0.300 . 1 . . . . 43 GLN N . 11203 1 486 . 1 1 43 43 GLN NE2 N 15 110.854 0.300 . 1 . . . . 43 GLN NE2 . 11203 1 487 . 1 1 44 44 VAL H H 1 6.958 0.030 . 1 . . . . 44 VAL H . 11203 1 488 . 1 1 44 44 VAL HA H 1 4.614 0.030 . 1 . . . . 44 VAL HA . 11203 1 489 . 1 1 44 44 VAL HB H 1 2.361 0.030 . 1 . . . . 44 VAL HB . 11203 1 490 . 1 1 44 44 VAL HG11 H 1 1.051 0.030 . 1 . . . . 44 VAL HG1 . 11203 1 491 . 1 1 44 44 VAL HG12 H 1 1.051 0.030 . 1 . . . . 44 VAL HG1 . 11203 1 492 . 1 1 44 44 VAL HG13 H 1 1.051 0.030 . 1 . . . . 44 VAL HG1 . 11203 1 493 . 1 1 44 44 VAL HG21 H 1 0.974 0.030 . 1 . . . . 44 VAL HG2 . 11203 1 494 . 1 1 44 44 VAL HG22 H 1 0.974 0.030 . 1 . . . . 44 VAL HG2 . 11203 1 495 . 1 1 44 44 VAL HG23 H 1 0.974 0.030 . 1 . . . . 44 VAL HG2 . 11203 1 496 . 1 1 44 44 VAL C C 13 174.002 0.300 . 1 . . . . 44 VAL C . 11203 1 497 . 1 1 44 44 VAL CA C 13 59.360 0.300 . 1 . . . . 44 VAL CA . 11203 1 498 . 1 1 44 44 VAL CB C 13 31.414 0.300 . 1 . . . . 44 VAL CB . 11203 1 499 . 1 1 44 44 VAL CG1 C 13 22.695 0.300 . 2 . . . . 44 VAL CG1 . 11203 1 500 . 1 1 44 44 VAL CG2 C 13 20.191 0.300 . 2 . . . . 44 VAL CG2 . 11203 1 501 . 1 1 44 44 VAL N N 15 115.559 0.300 . 1 . . . . 44 VAL N . 11203 1 502 . 1 1 45 45 PRO HA H 1 4.439 0.030 . 1 . . . . 45 PRO HA . 11203 1 503 . 1 1 45 45 PRO HB2 H 1 2.464 0.030 . 2 . . . . 45 PRO HB2 . 11203 1 504 . 1 1 45 45 PRO HB3 H 1 1.784 0.030 . 2 . . . . 45 PRO HB3 . 11203 1 505 . 1 1 45 45 PRO HD2 H 1 3.926 0.030 . 2 . . . . 45 PRO HD2 . 11203 1 506 . 1 1 45 45 PRO HD3 H 1 3.691 0.030 . 2 . . . . 45 PRO HD3 . 11203 1 507 . 1 1 45 45 PRO HG2 H 1 2.083 0.030 . 2 . . . . 45 PRO HG2 . 11203 1 508 . 1 1 45 45 PRO HG3 H 1 2.028 0.030 . 2 . . . . 45 PRO HG3 . 11203 1 509 . 1 1 45 45 PRO C C 13 178.073 0.300 . 1 . . . . 45 PRO C . 11203 1 510 . 1 1 45 45 PRO CA C 13 63.605 0.300 . 1 . . . . 45 PRO CA . 11203 1 511 . 1 1 45 45 PRO CB C 13 32.286 0.300 . 1 . . . . 45 PRO CB . 11203 1 512 . 1 1 45 45 PRO CD C 13 50.850 0.300 . 1 . . . . 45 PRO CD . 11203 1 513 . 1 1 45 45 PRO CG C 13 28.092 0.300 . 1 . . . . 45 PRO CG . 11203 1 514 . 1 1 46 46 THR H H 1 8.545 0.030 . 1 . . . . 46 THR H . 11203 1 515 . 1 1 46 46 THR HA H 1 3.951 0.030 . 1 . . . . 46 THR HA . 11203 1 516 . 1 1 46 46 THR HB H 1 4.198 0.030 . 1 . . . . 46 THR HB . 11203 1 517 . 1 1 46 46 THR HG21 H 1 1.378 0.030 . 1 . . . . 46 THR HG2 . 11203 1 518 . 1 1 46 46 THR HG22 H 1 1.378 0.030 . 1 . . . . 46 THR HG2 . 11203 1 519 . 1 1 46 46 THR HG23 H 1 1.378 0.030 . 1 . . . . 46 THR HG2 . 11203 1 520 . 1 1 46 46 THR C C 13 176.969 0.300 . 1 . . . . 46 THR C . 11203 1 521 . 1 1 46 46 THR CA C 13 66.093 0.300 . 1 . . . . 46 THR CA . 11203 1 522 . 1 1 46 46 THR CB C 13 68.902 0.300 . 1 . . . . 46 THR CB . 11203 1 523 . 1 1 46 46 THR CG2 C 13 21.975 0.300 . 1 . . . . 46 THR CG2 . 11203 1 524 . 1 1 46 46 THR N N 15 118.687 0.300 . 1 . . . . 46 THR N . 11203 1 525 . 1 1 47 47 GLU H H 1 9.387 0.030 . 1 . . . . 47 GLU H . 11203 1 526 . 1 1 47 47 GLU HA H 1 4.198 0.030 . 1 . . . . 47 GLU HA . 11203 1 527 . 1 1 47 47 GLU HB2 H 1 2.068 0.030 . 1 . . . . 47 GLU HB2 . 11203 1 528 . 1 1 47 47 GLU HB3 H 1 2.068 0.030 . 1 . . . . 47 GLU HB3 . 11203 1 529 . 1 1 47 47 GLU HG2 H 1 2.304 0.030 . 1 . . . . 47 GLU HG2 . 11203 1 530 . 1 1 47 47 GLU HG3 H 1 2.304 0.030 . 1 . . . . 47 GLU HG3 . 11203 1 531 . 1 1 47 47 GLU C C 13 176.675 0.300 . 1 . . . . 47 GLU C . 11203 1 532 . 1 1 47 47 GLU CA C 13 58.316 0.300 . 1 . . . . 47 GLU CA . 11203 1 533 . 1 1 47 47 GLU CB C 13 28.352 0.300 . 1 . . . . 47 GLU CB . 11203 1 534 . 1 1 47 47 GLU CG C 13 35.803 0.300 . 1 . . . . 47 GLU CG . 11203 1 535 . 1 1 47 47 GLU N N 15 119.283 0.300 . 1 . . . . 47 GLU N . 11203 1 536 . 1 1 48 48 ASN H H 1 8.366 0.030 . 1 . . . . 48 ASN H . 11203 1 537 . 1 1 48 48 ASN HA H 1 4.585 0.030 . 1 . . . . 48 ASN HA . 11203 1 538 . 1 1 48 48 ASN HB2 H 1 3.527 0.030 . 2 . . . . 48 ASN HB2 . 11203 1 539 . 1 1 48 48 ASN HB3 H 1 3.056 0.030 . 2 . . . . 48 ASN HB3 . 11203 1 540 . 1 1 48 48 ASN HD21 H 1 7.298 0.030 . 2 . . . . 48 ASN HD21 . 11203 1 541 . 1 1 48 48 ASN HD22 H 1 7.194 0.030 . 2 . . . . 48 ASN HD22 . 11203 1 542 . 1 1 48 48 ASN C C 13 173.796 0.300 . 1 . . . . 48 ASN C . 11203 1 543 . 1 1 48 48 ASN CA C 13 53.521 0.300 . 1 . . . . 48 ASN CA . 11203 1 544 . 1 1 48 48 ASN CB C 13 37.883 0.300 . 1 . . . . 48 ASN CB . 11203 1 545 . 1 1 48 48 ASN N N 15 119.423 0.300 . 1 . . . . 48 ASN N . 11203 1 546 . 1 1 48 48 ASN ND2 N 15 110.025 0.300 . 1 . . . . 48 ASN ND2 . 11203 1 547 . 1 1 49 49 VAL H H 1 7.649 0.030 . 1 . . . . 49 VAL H . 11203 1 548 . 1 1 49 49 VAL HA H 1 4.469 0.030 . 1 . . . . 49 VAL HA . 11203 1 549 . 1 1 49 49 VAL HB H 1 2.241 0.030 . 1 . . . . 49 VAL HB . 11203 1 550 . 1 1 49 49 VAL HG11 H 1 0.646 0.030 . 1 . . . . 49 VAL HG1 . 11203 1 551 . 1 1 49 49 VAL HG12 H 1 0.646 0.030 . 1 . . . . 49 VAL HG1 . 11203 1 552 . 1 1 49 49 VAL HG13 H 1 0.646 0.030 . 1 . . . . 49 VAL HG1 . 11203 1 553 . 1 1 49 49 VAL HG21 H 1 0.848 0.030 . 1 . . . . 49 VAL HG2 . 11203 1 554 . 1 1 49 49 VAL HG22 H 1 0.848 0.030 . 1 . . . . 49 VAL HG2 . 11203 1 555 . 1 1 49 49 VAL HG23 H 1 0.848 0.030 . 1 . . . . 49 VAL HG2 . 11203 1 556 . 1 1 49 49 VAL C C 13 174.160 0.300 . 1 . . . . 49 VAL C . 11203 1 557 . 1 1 49 49 VAL CA C 13 62.343 0.300 . 1 . . . . 49 VAL CA . 11203 1 558 . 1 1 49 49 VAL CB C 13 31.337 0.300 . 1 . . . . 49 VAL CB . 11203 1 559 . 1 1 49 49 VAL CG1 C 13 21.504 0.300 . 2 . . . . 49 VAL CG1 . 11203 1 560 . 1 1 49 49 VAL CG2 C 13 20.848 0.300 . 2 . . . . 49 VAL CG2 . 11203 1 561 . 1 1 49 49 VAL N N 15 121.493 0.300 . 1 . . . . 49 VAL N . 11203 1 562 . 1 1 50 50 GLN H H 1 9.056 0.030 . 1 . . . . 50 GLN H . 11203 1 563 . 1 1 50 50 GLN HA H 1 4.658 0.030 . 1 . . . . 50 GLN HA . 11203 1 564 . 1 1 50 50 GLN HB2 H 1 2.009 0.030 . 2 . . . . 50 GLN HB2 . 11203 1 565 . 1 1 50 50 GLN HB3 H 1 1.953 0.030 . 2 . . . . 50 GLN HB3 . 11203 1 566 . 1 1 50 50 GLN HE21 H 1 7.582 0.030 . 2 . . . . 50 GLN HE21 . 11203 1 567 . 1 1 50 50 GLN HE22 H 1 6.838 0.030 . 2 . . . . 50 GLN HE22 . 11203 1 568 . 1 1 50 50 GLN HG2 H 1 2.252 0.030 . 1 . . . . 50 GLN HG2 . 11203 1 569 . 1 1 50 50 GLN HG3 H 1 2.252 0.030 . 1 . . . . 50 GLN HG3 . 11203 1 570 . 1 1 50 50 GLN C C 13 174.838 0.300 . 1 . . . . 50 GLN C . 11203 1 571 . 1 1 50 50 GLN CA C 13 54.302 0.300 . 1 . . . . 50 GLN CA . 11203 1 572 . 1 1 50 50 GLN CB C 13 31.422 0.300 . 1 . . . . 50 GLN CB . 11203 1 573 . 1 1 50 50 GLN CG C 13 33.126 0.300 . 1 . . . . 50 GLN CG . 11203 1 574 . 1 1 50 50 GLN N N 15 124.950 0.300 . 1 . . . . 50 GLN N . 11203 1 575 . 1 1 50 50 GLN NE2 N 15 111.104 0.300 . 1 . . . . 50 GLN NE2 . 11203 1 576 . 1 1 51 51 VAL H H 1 8.547 0.030 . 1 . . . . 51 VAL H . 11203 1 577 . 1 1 51 51 VAL HA H 1 5.154 0.030 . 1 . . . . 51 VAL HA . 11203 1 578 . 1 1 51 51 VAL HB H 1 1.519 0.030 . 1 . . . . 51 VAL HB . 11203 1 579 . 1 1 51 51 VAL HG11 H 1 0.304 0.030 . 1 . . . . 51 VAL HG1 . 11203 1 580 . 1 1 51 51 VAL HG12 H 1 0.304 0.030 . 1 . . . . 51 VAL HG1 . 11203 1 581 . 1 1 51 51 VAL HG13 H 1 0.304 0.030 . 1 . . . . 51 VAL HG1 . 11203 1 582 . 1 1 51 51 VAL HG21 H 1 0.557 0.030 . 1 . . . . 51 VAL HG2 . 11203 1 583 . 1 1 51 51 VAL HG22 H 1 0.557 0.030 . 1 . . . . 51 VAL HG2 . 11203 1 584 . 1 1 51 51 VAL HG23 H 1 0.557 0.030 . 1 . . . . 51 VAL HG2 . 11203 1 585 . 1 1 51 51 VAL C C 13 173.581 0.300 . 1 . . . . 51 VAL C . 11203 1 586 . 1 1 51 51 VAL CA C 13 59.703 0.300 . 1 . . . . 51 VAL CA . 11203 1 587 . 1 1 51 51 VAL CB C 13 34.986 0.300 . 1 . . . . 51 VAL CB . 11203 1 588 . 1 1 51 51 VAL CG1 C 13 21.788 0.300 . 2 . . . . 51 VAL CG1 . 11203 1 589 . 1 1 51 51 VAL CG2 C 13 22.600 0.300 . 2 . . . . 51 VAL CG2 . 11203 1 590 . 1 1 51 51 VAL N N 15 123.137 0.300 . 1 . . . . 51 VAL N . 11203 1 591 . 1 1 52 52 HIS H H 1 8.514 0.030 . 1 . . . . 52 HIS H . 11203 1 592 . 1 1 52 52 HIS HA H 1 4.904 0.030 . 1 . . . . 52 HIS HA . 11203 1 593 . 1 1 52 52 HIS HB2 H 1 3.227 0.030 . 2 . . . . 52 HIS HB2 . 11203 1 594 . 1 1 52 52 HIS HB3 H 1 3.080 0.030 . 2 . . . . 52 HIS HB3 . 11203 1 595 . 1 1 52 52 HIS HD2 H 1 7.182 0.030 . 1 . . . . 52 HIS HD2 . 11203 1 596 . 1 1 52 52 HIS HE1 H 1 8.107 0.030 . 1 . . . . 52 HIS HE1 . 11203 1 597 . 1 1 52 52 HIS C C 13 173.550 0.300 . 1 . . . . 52 HIS C . 11203 1 598 . 1 1 52 52 HIS CA C 13 54.450 0.300 . 1 . . . . 52 HIS CA . 11203 1 599 . 1 1 52 52 HIS CB C 13 31.879 0.300 . 1 . . . . 52 HIS CB . 11203 1 600 . 1 1 52 52 HIS CD2 C 13 120.180 0.300 . 1 . . . . 52 HIS CD2 . 11203 1 601 . 1 1 52 52 HIS CE1 C 13 136.843 0.300 . 1 . . . . 52 HIS CE1 . 11203 1 602 . 1 1 52 52 HIS N N 15 125.623 0.300 . 1 . . . . 52 HIS N . 11203 1 603 . 1 1 53 53 PHE H H 1 8.927 0.030 . 1 . . . . 53 PHE H . 11203 1 604 . 1 1 53 53 PHE HA H 1 5.381 0.030 . 1 . . . . 53 PHE HA . 11203 1 605 . 1 1 53 53 PHE HB2 H 1 3.359 0.030 . 2 . . . . 53 PHE HB2 . 11203 1 606 . 1 1 53 53 PHE HB3 H 1 2.806 0.030 . 2 . . . . 53 PHE HB3 . 11203 1 607 . 1 1 53 53 PHE HD1 H 1 7.322 0.030 . 1 . . . . 53 PHE HD1 . 11203 1 608 . 1 1 53 53 PHE HD2 H 1 7.322 0.030 . 1 . . . . 53 PHE HD2 . 11203 1 609 . 1 1 53 53 PHE HE1 H 1 6.994 0.030 . 1 . . . . 53 PHE HE1 . 11203 1 610 . 1 1 53 53 PHE HE2 H 1 6.994 0.030 . 1 . . . . 53 PHE HE2 . 11203 1 611 . 1 1 53 53 PHE HZ H 1 6.975 0.030 . 1 . . . . 53 PHE HZ . 11203 1 612 . 1 1 53 53 PHE C C 13 176.013 0.300 . 1 . . . . 53 PHE C . 11203 1 613 . 1 1 53 53 PHE CA C 13 57.916 0.300 . 1 . . . . 53 PHE CA . 11203 1 614 . 1 1 53 53 PHE CB C 13 43.661 0.300 . 1 . . . . 53 PHE CB . 11203 1 615 . 1 1 53 53 PHE CD1 C 13 132.530 0.300 . 1 . . . . 53 PHE CD1 . 11203 1 616 . 1 1 53 53 PHE CD2 C 13 132.530 0.300 . 1 . . . . 53 PHE CD2 . 11203 1 617 . 1 1 53 53 PHE CE1 C 13 130.940 0.300 . 1 . . . . 53 PHE CE1 . 11203 1 618 . 1 1 53 53 PHE CE2 C 13 130.940 0.300 . 1 . . . . 53 PHE CE2 . 11203 1 619 . 1 1 53 53 PHE CZ C 13 130.407 0.300 . 1 . . . . 53 PHE CZ . 11203 1 620 . 1 1 53 53 PHE N N 15 122.749 0.300 . 1 . . . . 53 PHE N . 11203 1 621 . 1 1 54 54 THR H H 1 8.934 0.030 . 1 . . . . 54 THR H . 11203 1 622 . 1 1 54 54 THR HA H 1 4.569 0.030 . 1 . . . . 54 THR HA . 11203 1 623 . 1 1 54 54 THR HB H 1 4.570 0.030 . 1 . . . . 54 THR HB . 11203 1 624 . 1 1 54 54 THR HG21 H 1 1.207 0.030 . 1 . . . . 54 THR HG2 . 11203 1 625 . 1 1 54 54 THR HG22 H 1 1.207 0.030 . 1 . . . . 54 THR HG2 . 11203 1 626 . 1 1 54 54 THR HG23 H 1 1.207 0.030 . 1 . . . . 54 THR HG2 . 11203 1 627 . 1 1 54 54 THR C C 13 173.329 0.300 . 1 . . . . 54 THR C . 11203 1 628 . 1 1 54 54 THR CA C 13 61.343 0.300 . 1 . . . . 54 THR CA . 11203 1 629 . 1 1 54 54 THR CB C 13 71.809 0.300 . 1 . . . . 54 THR CB . 11203 1 630 . 1 1 54 54 THR CG2 C 13 20.759 0.300 . 1 . . . . 54 THR CG2 . 11203 1 631 . 1 1 54 54 THR N N 15 111.963 0.300 . 1 . . . . 54 THR N . 11203 1 632 . 1 1 55 55 GLU H H 1 8.545 0.030 . 1 . . . . 55 GLU H . 11203 1 633 . 1 1 55 55 GLU HA H 1 4.410 0.030 . 1 . . . . 55 GLU HA . 11203 1 634 . 1 1 55 55 GLU HB2 H 1 2.231 0.030 . 1 . . . . 55 GLU HB2 . 11203 1 635 . 1 1 55 55 GLU HB3 H 1 2.231 0.030 . 1 . . . . 55 GLU HB3 . 11203 1 636 . 1 1 55 55 GLU HG2 H 1 2.608 0.030 . 1 . . . . 55 GLU HG2 . 11203 1 637 . 1 1 55 55 GLU HG3 H 1 2.608 0.030 . 1 . . . . 55 GLU HG3 . 11203 1 638 . 1 1 55 55 GLU C C 13 176.149 0.300 . 1 . . . . 55 GLU C . 11203 1 639 . 1 1 55 55 GLU CA C 13 59.317 0.300 . 1 . . . . 55 GLU CA . 11203 1 640 . 1 1 55 55 GLU CB C 13 30.439 0.300 . 1 . . . . 55 GLU CB . 11203 1 641 . 1 1 55 55 GLU CG C 13 37.768 0.300 . 1 . . . . 55 GLU CG . 11203 1 642 . 1 1 55 55 GLU N N 15 114.318 0.300 . 1 . . . . 55 GLU N . 11203 1 643 . 1 1 56 56 ARG H H 1 7.664 0.030 . 1 . . . . 56 ARG H . 11203 1 644 . 1 1 56 56 ARG HA H 1 4.867 0.030 . 1 . . . . 56 ARG HA . 11203 1 645 . 1 1 56 56 ARG HB2 H 1 2.259 0.030 . 2 . . . . 56 ARG HB2 . 11203 1 646 . 1 1 56 56 ARG HB3 H 1 1.641 0.030 . 2 . . . . 56 ARG HB3 . 11203 1 647 . 1 1 56 56 ARG HD2 H 1 3.104 0.030 . 1 . . . . 56 ARG HD2 . 11203 1 648 . 1 1 56 56 ARG HD3 H 1 3.104 0.030 . 1 . . . . 56 ARG HD3 . 11203 1 649 . 1 1 56 56 ARG HG2 H 1 1.461 0.030 . 2 . . . . 56 ARG HG2 . 11203 1 650 . 1 1 56 56 ARG HG3 H 1 1.727 0.030 . 2 . . . . 56 ARG HG3 . 11203 1 651 . 1 1 56 56 ARG C C 13 174.598 0.300 . 1 . . . . 56 ARG C . 11203 1 652 . 1 1 56 56 ARG CA C 13 53.114 0.300 . 1 . . . . 56 ARG CA . 11203 1 653 . 1 1 56 56 ARG CB C 13 33.189 0.300 . 1 . . . . 56 ARG CB . 11203 1 654 . 1 1 56 56 ARG CD C 13 43.052 0.300 . 1 . . . . 56 ARG CD . 11203 1 655 . 1 1 56 56 ARG CG C 13 27.213 0.300 . 1 . . . . 56 ARG CG . 11203 1 656 . 1 1 56 56 ARG N N 15 111.847 0.300 . 1 . . . . 56 ARG N . 11203 1 657 . 1 1 57 57 SER H H 1 7.779 0.030 . 1 . . . . 57 SER H . 11203 1 658 . 1 1 57 57 SER HA H 1 5.333 0.030 . 1 . . . . 57 SER HA . 11203 1 659 . 1 1 57 57 SER HB2 H 1 4.026 0.030 . 2 . . . . 57 SER HB2 . 11203 1 660 . 1 1 57 57 SER HB3 H 1 3.911 0.030 . 2 . . . . 57 SER HB3 . 11203 1 661 . 1 1 57 57 SER C C 13 172.268 0.300 . 1 . . . . 57 SER C . 11203 1 662 . 1 1 57 57 SER CA C 13 58.035 0.300 . 1 . . . . 57 SER CA . 11203 1 663 . 1 1 57 57 SER CB C 13 68.544 0.300 . 1 . . . . 57 SER CB . 11203 1 664 . 1 1 57 57 SER N N 15 115.052 0.300 . 1 . . . . 57 SER N . 11203 1 665 . 1 1 58 58 PHE H H 1 8.120 0.030 . 1 . . . . 58 PHE H . 11203 1 666 . 1 1 58 58 PHE HA H 1 5.376 0.030 . 1 . . . . 58 PHE HA . 11203 1 667 . 1 1 58 58 PHE HB2 H 1 2.999 0.030 . 2 . . . . 58 PHE HB2 . 11203 1 668 . 1 1 58 58 PHE HB3 H 1 2.534 0.030 . 2 . . . . 58 PHE HB3 . 11203 1 669 . 1 1 58 58 PHE HD1 H 1 6.843 0.030 . 1 . . . . 58 PHE HD1 . 11203 1 670 . 1 1 58 58 PHE HD2 H 1 6.843 0.030 . 1 . . . . 58 PHE HD2 . 11203 1 671 . 1 1 58 58 PHE HE1 H 1 6.863 0.030 . 1 . . . . 58 PHE HE1 . 11203 1 672 . 1 1 58 58 PHE HE2 H 1 6.863 0.030 . 1 . . . . 58 PHE HE2 . 11203 1 673 . 1 1 58 58 PHE HZ H 1 6.791 0.030 . 1 . . . . 58 PHE HZ . 11203 1 674 . 1 1 58 58 PHE C C 13 171.980 0.300 . 1 . . . . 58 PHE C . 11203 1 675 . 1 1 58 58 PHE CA C 13 57.170 0.300 . 1 . . . . 58 PHE CA . 11203 1 676 . 1 1 58 58 PHE CB C 13 43.572 0.300 . 1 . . . . 58 PHE CB . 11203 1 677 . 1 1 58 58 PHE CD1 C 13 131.889 0.300 . 1 . . . . 58 PHE CD1 . 11203 1 678 . 1 1 58 58 PHE CD2 C 13 131.889 0.300 . 1 . . . . 58 PHE CD2 . 11203 1 679 . 1 1 58 58 PHE CE1 C 13 130.320 0.300 . 1 . . . . 58 PHE CE1 . 11203 1 680 . 1 1 58 58 PHE CE2 C 13 130.320 0.300 . 1 . . . . 58 PHE CE2 . 11203 1 681 . 1 1 58 58 PHE CZ C 13 128.761 0.300 . 1 . . . . 58 PHE CZ . 11203 1 682 . 1 1 58 58 PHE N N 15 111.381 0.300 . 1 . . . . 58 PHE N . 11203 1 683 . 1 1 59 59 ASP H H 1 8.351 0.030 . 1 . . . . 59 ASP H . 11203 1 684 . 1 1 59 59 ASP HA H 1 5.075 0.030 . 1 . . . . 59 ASP HA . 11203 1 685 . 1 1 59 59 ASP HB2 H 1 2.588 0.030 . 2 . . . . 59 ASP HB2 . 11203 1 686 . 1 1 59 59 ASP HB3 H 1 2.538 0.030 . 2 . . . . 59 ASP HB3 . 11203 1 687 . 1 1 59 59 ASP C C 13 173.888 0.300 . 1 . . . . 59 ASP C . 11203 1 688 . 1 1 59 59 ASP CA C 13 52.941 0.300 . 1 . . . . 59 ASP CA . 11203 1 689 . 1 1 59 59 ASP CB C 13 44.166 0.300 . 1 . . . . 59 ASP CB . 11203 1 690 . 1 1 59 59 ASP N N 15 118.465 0.300 . 1 . . . . 59 ASP N . 11203 1 691 . 1 1 60 60 LEU H H 1 9.248 0.030 . 1 . . . . 60 LEU H . 11203 1 692 . 1 1 60 60 LEU HA H 1 5.251 0.030 . 1 . . . . 60 LEU HA . 11203 1 693 . 1 1 60 60 LEU HB2 H 1 2.037 0.030 . 2 . . . . 60 LEU HB2 . 11203 1 694 . 1 1 60 60 LEU HB3 H 1 1.303 0.030 . 2 . . . . 60 LEU HB3 . 11203 1 695 . 1 1 60 60 LEU HD11 H 1 0.716 0.030 . 1 . . . . 60 LEU HD1 . 11203 1 696 . 1 1 60 60 LEU HD12 H 1 0.716 0.030 . 1 . . . . 60 LEU HD1 . 11203 1 697 . 1 1 60 60 LEU HD13 H 1 0.716 0.030 . 1 . . . . 60 LEU HD1 . 11203 1 698 . 1 1 60 60 LEU HD21 H 1 0.782 0.030 . 1 . . . . 60 LEU HD2 . 11203 1 699 . 1 1 60 60 LEU HD22 H 1 0.782 0.030 . 1 . . . . 60 LEU HD2 . 11203 1 700 . 1 1 60 60 LEU HD23 H 1 0.782 0.030 . 1 . . . . 60 LEU HD2 . 11203 1 701 . 1 1 60 60 LEU HG H 1 1.389 0.030 . 1 . . . . 60 LEU HG . 11203 1 702 . 1 1 60 60 LEU C C 13 174.600 0.300 . 1 . . . . 60 LEU C . 11203 1 703 . 1 1 60 60 LEU CA C 13 53.352 0.300 . 1 . . . . 60 LEU CA . 11203 1 704 . 1 1 60 60 LEU CB C 13 45.667 0.300 . 1 . . . . 60 LEU CB . 11203 1 705 . 1 1 60 60 LEU CD1 C 13 24.494 0.300 . 2 . . . . 60 LEU CD1 . 11203 1 706 . 1 1 60 60 LEU CD2 C 13 26.875 0.300 . 2 . . . . 60 LEU CD2 . 11203 1 707 . 1 1 60 60 LEU CG C 13 27.980 0.300 . 1 . . . . 60 LEU CG . 11203 1 708 . 1 1 60 60 LEU N N 15 125.120 0.300 . 1 . . . . 60 LEU N . 11203 1 709 . 1 1 61 61 LEU H H 1 9.326 0.030 . 1 . . . . 61 LEU H . 11203 1 710 . 1 1 61 61 LEU HA H 1 5.297 0.030 . 1 . . . . 61 LEU HA . 11203 1 711 . 1 1 61 61 LEU HB2 H 1 1.762 0.030 . 2 . . . . 61 LEU HB2 . 11203 1 712 . 1 1 61 61 LEU HB3 H 1 1.535 0.030 . 2 . . . . 61 LEU HB3 . 11203 1 713 . 1 1 61 61 LEU HD11 H 1 0.858 0.030 . 1 . . . . 61 LEU HD1 . 11203 1 714 . 1 1 61 61 LEU HD12 H 1 0.858 0.030 . 1 . . . . 61 LEU HD1 . 11203 1 715 . 1 1 61 61 LEU HD13 H 1 0.858 0.030 . 1 . . . . 61 LEU HD1 . 11203 1 716 . 1 1 61 61 LEU HD21 H 1 0.893 0.030 . 1 . . . . 61 LEU HD2 . 11203 1 717 . 1 1 61 61 LEU HD22 H 1 0.893 0.030 . 1 . . . . 61 LEU HD2 . 11203 1 718 . 1 1 61 61 LEU HD23 H 1 0.893 0.030 . 1 . . . . 61 LEU HD2 . 11203 1 719 . 1 1 61 61 LEU HG H 1 1.336 0.030 . 1 . . . . 61 LEU HG . 11203 1 720 . 1 1 61 61 LEU C C 13 174.695 0.300 . 1 . . . . 61 LEU C . 11203 1 721 . 1 1 61 61 LEU CA C 13 54.145 0.300 . 1 . . . . 61 LEU CA . 11203 1 722 . 1 1 61 61 LEU CB C 13 45.756 0.300 . 1 . . . . 61 LEU CB . 11203 1 723 . 1 1 61 61 LEU CD1 C 13 26.075 0.300 . 2 . . . . 61 LEU CD1 . 11203 1 724 . 1 1 61 61 LEU CD2 C 13 22.709 0.300 . 2 . . . . 61 LEU CD2 . 11203 1 725 . 1 1 61 61 LEU CG C 13 27.964 0.300 . 1 . . . . 61 LEU CG . 11203 1 726 . 1 1 61 61 LEU N N 15 130.882 0.300 . 1 . . . . 61 LEU N . 11203 1 727 . 1 1 62 62 VAL H H 1 9.358 0.030 . 1 . . . . 62 VAL H . 11203 1 728 . 1 1 62 62 VAL HA H 1 5.001 0.030 . 1 . . . . 62 VAL HA . 11203 1 729 . 1 1 62 62 VAL HB H 1 2.157 0.030 . 1 . . . . 62 VAL HB . 11203 1 730 . 1 1 62 62 VAL HG11 H 1 0.939 0.030 . 1 . . . . 62 VAL HG1 . 11203 1 731 . 1 1 62 62 VAL HG12 H 1 0.939 0.030 . 1 . . . . 62 VAL HG1 . 11203 1 732 . 1 1 62 62 VAL HG13 H 1 0.939 0.030 . 1 . . . . 62 VAL HG1 . 11203 1 733 . 1 1 62 62 VAL HG21 H 1 0.875 0.030 . 1 . . . . 62 VAL HG2 . 11203 1 734 . 1 1 62 62 VAL HG22 H 1 0.875 0.030 . 1 . . . . 62 VAL HG2 . 11203 1 735 . 1 1 62 62 VAL HG23 H 1 0.875 0.030 . 1 . . . . 62 VAL HG2 . 11203 1 736 . 1 1 62 62 VAL C C 13 175.302 0.300 . 1 . . . . 62 VAL C . 11203 1 737 . 1 1 62 62 VAL CA C 13 61.004 0.300 . 1 . . . . 62 VAL CA . 11203 1 738 . 1 1 62 62 VAL CB C 13 33.832 0.300 . 1 . . . . 62 VAL CB . 11203 1 739 . 1 1 62 62 VAL CG1 C 13 21.934 0.300 . 2 . . . . 62 VAL CG1 . 11203 1 740 . 1 1 62 62 VAL CG2 C 13 20.447 0.300 . 2 . . . . 62 VAL CG2 . 11203 1 741 . 1 1 62 62 VAL N N 15 126.293 0.300 . 1 . . . . 62 VAL N . 11203 1 742 . 1 1 63 63 LYS H H 1 8.955 0.030 . 1 . . . . 63 LYS H . 11203 1 743 . 1 1 63 63 LYS HA H 1 4.572 0.030 . 1 . . . . 63 LYS HA . 11203 1 744 . 1 1 63 63 LYS HB2 H 1 1.687 0.030 . 2 . . . . 63 LYS HB2 . 11203 1 745 . 1 1 63 63 LYS HB3 H 1 1.534 0.030 . 2 . . . . 63 LYS HB3 . 11203 1 746 . 1 1 63 63 LYS HD2 H 1 1.620 0.030 . 1 . . . . 63 LYS HD2 . 11203 1 747 . 1 1 63 63 LYS HD3 H 1 1.620 0.030 . 1 . . . . 63 LYS HD3 . 11203 1 748 . 1 1 63 63 LYS HE2 H 1 2.869 0.030 . 1 . . . . 63 LYS HE2 . 11203 1 749 . 1 1 63 63 LYS HE3 H 1 2.869 0.030 . 1 . . . . 63 LYS HE3 . 11203 1 750 . 1 1 63 63 LYS HG2 H 1 1.420 0.030 . 2 . . . . 63 LYS HG2 . 11203 1 751 . 1 1 63 63 LYS HG3 H 1 1.295 0.030 . 2 . . . . 63 LYS HG3 . 11203 1 752 . 1 1 63 63 LYS C C 13 175.267 0.300 . 1 . . . . 63 LYS C . 11203 1 753 . 1 1 63 63 LYS CA C 13 55.621 0.300 . 1 . . . . 63 LYS CA . 11203 1 754 . 1 1 63 63 LYS CB C 13 34.554 0.300 . 1 . . . . 63 LYS CB . 11203 1 755 . 1 1 63 63 LYS CD C 13 29.607 0.300 . 1 . . . . 63 LYS CD . 11203 1 756 . 1 1 63 63 LYS CE C 13 41.842 0.300 . 1 . . . . 63 LYS CE . 11203 1 757 . 1 1 63 63 LYS CG C 13 25.100 0.300 . 1 . . . . 63 LYS CG . 11203 1 758 . 1 1 63 63 LYS N N 15 126.229 0.300 . 1 . . . . 63 LYS N . 11203 1 759 . 1 1 64 64 ASN H H 1 7.917 0.030 . 1 . . . . 64 ASN H . 11203 1 760 . 1 1 64 64 ASN HA H 1 3.949 0.030 . 1 . . . . 64 ASN HA . 11203 1 761 . 1 1 64 64 ASN HB2 H 1 2.967 0.030 . 2 . . . . 64 ASN HB2 . 11203 1 762 . 1 1 64 64 ASN HB3 H 1 2.534 0.030 . 2 . . . . 64 ASN HB3 . 11203 1 763 . 1 1 64 64 ASN HD21 H 1 7.493 0.030 . 2 . . . . 64 ASN HD21 . 11203 1 764 . 1 1 64 64 ASN HD22 H 1 6.821 0.030 . 2 . . . . 64 ASN HD22 . 11203 1 765 . 1 1 64 64 ASN C C 13 173.292 0.300 . 1 . . . . 64 ASN C . 11203 1 766 . 1 1 64 64 ASN CA C 13 53.996 0.300 . 1 . . . . 64 ASN CA . 11203 1 767 . 1 1 64 64 ASN CB C 13 37.120 0.300 . 1 . . . . 64 ASN CB . 11203 1 768 . 1 1 64 64 ASN N N 15 117.635 0.300 . 1 . . . . 64 ASN N . 11203 1 769 . 1 1 64 64 ASN ND2 N 15 111.776 0.300 . 1 . . . . 64 ASN ND2 . 11203 1 770 . 1 1 65 65 LEU H H 1 9.026 0.030 . 1 . . . . 65 LEU H . 11203 1 771 . 1 1 65 65 LEU HA H 1 4.579 0.030 . 1 . . . . 65 LEU HA . 11203 1 772 . 1 1 65 65 LEU HB2 H 1 2.047 0.030 . 2 . . . . 65 LEU HB2 . 11203 1 773 . 1 1 65 65 LEU HB3 H 1 1.060 0.030 . 2 . . . . 65 LEU HB3 . 11203 1 774 . 1 1 65 65 LEU HD11 H 1 0.681 0.030 . 1 . . . . 65 LEU HD1 . 11203 1 775 . 1 1 65 65 LEU HD12 H 1 0.681 0.030 . 1 . . . . 65 LEU HD1 . 11203 1 776 . 1 1 65 65 LEU HD13 H 1 0.681 0.030 . 1 . . . . 65 LEU HD1 . 11203 1 777 . 1 1 65 65 LEU HD21 H 1 0.566 0.030 . 1 . . . . 65 LEU HD2 . 11203 1 778 . 1 1 65 65 LEU HD22 H 1 0.566 0.030 . 1 . . . . 65 LEU HD2 . 11203 1 779 . 1 1 65 65 LEU HD23 H 1 0.566 0.030 . 1 . . . . 65 LEU HD2 . 11203 1 780 . 1 1 65 65 LEU HG H 1 1.534 0.030 . 1 . . . . 65 LEU HG . 11203 1 781 . 1 1 65 65 LEU C C 13 175.589 0.300 . 1 . . . . 65 LEU C . 11203 1 782 . 1 1 65 65 LEU CA C 13 53.595 0.300 . 1 . . . . 65 LEU CA . 11203 1 783 . 1 1 65 65 LEU CB C 13 42.036 0.300 . 1 . . . . 65 LEU CB . 11203 1 784 . 1 1 65 65 LEU CD1 C 13 23.492 0.300 . 2 . . . . 65 LEU CD1 . 11203 1 785 . 1 1 65 65 LEU CD2 C 13 26.150 0.300 . 2 . . . . 65 LEU CD2 . 11203 1 786 . 1 1 65 65 LEU CG C 13 27.491 0.300 . 1 . . . . 65 LEU CG . 11203 1 787 . 1 1 65 65 LEU N N 15 121.822 0.300 . 1 . . . . 65 LEU N . 11203 1 788 . 1 1 66 66 ASN H H 1 9.453 0.030 . 1 . . . . 66 ASN H . 11203 1 789 . 1 1 66 66 ASN HA H 1 4.344 0.030 . 1 . . . . 66 ASN HA . 11203 1 790 . 1 1 66 66 ASN HB2 H 1 3.033 0.030 . 2 . . . . 66 ASN HB2 . 11203 1 791 . 1 1 66 66 ASN HB3 H 1 2.796 0.030 . 2 . . . . 66 ASN HB3 . 11203 1 792 . 1 1 66 66 ASN HD21 H 1 7.549 0.030 . 2 . . . . 66 ASN HD21 . 11203 1 793 . 1 1 66 66 ASN HD22 H 1 6.948 0.030 . 2 . . . . 66 ASN HD22 . 11203 1 794 . 1 1 66 66 ASN C C 13 175.471 0.300 . 1 . . . . 66 ASN C . 11203 1 795 . 1 1 66 66 ASN CA C 13 54.301 0.300 . 1 . . . . 66 ASN CA . 11203 1 796 . 1 1 66 66 ASN CB C 13 37.794 0.300 . 1 . . . . 66 ASN CB . 11203 1 797 . 1 1 66 66 ASN N N 15 126.314 0.300 . 1 . . . . 66 ASN N . 11203 1 798 . 1 1 66 66 ASN ND2 N 15 113.496 0.300 . 1 . . . . 66 ASN ND2 . 11203 1 799 . 1 1 67 67 GLY H H 1 8.087 0.030 . 1 . . . . 67 GLY H . 11203 1 800 . 1 1 67 67 GLY HA2 H 1 4.147 0.030 . 2 . . . . 67 GLY HA2 . 11203 1 801 . 1 1 67 67 GLY HA3 H 1 3.691 0.030 . 2 . . . . 67 GLY HA3 . 11203 1 802 . 1 1 67 67 GLY C C 13 173.893 0.300 . 1 . . . . 67 GLY C . 11203 1 803 . 1 1 67 67 GLY CA C 13 45.621 0.300 . 1 . . . . 67 GLY CA . 11203 1 804 . 1 1 67 67 GLY N N 15 102.453 0.300 . 1 . . . . 67 GLY N . 11203 1 805 . 1 1 68 68 LYS H H 1 7.589 0.030 . 1 . . . . 68 LYS H . 11203 1 806 . 1 1 68 68 LYS HA H 1 4.709 0.030 . 1 . . . . 68 LYS HA . 11203 1 807 . 1 1 68 68 LYS HB2 H 1 1.627 0.030 . 2 . . . . 68 LYS HB2 . 11203 1 808 . 1 1 68 68 LYS HB3 H 1 1.403 0.030 . 2 . . . . 68 LYS HB3 . 11203 1 809 . 1 1 68 68 LYS HD2 H 1 1.644 0.030 . 2 . . . . 68 LYS HD2 . 11203 1 810 . 1 1 68 68 LYS HD3 H 1 1.582 0.030 . 2 . . . . 68 LYS HD3 . 11203 1 811 . 1 1 68 68 LYS HE2 H 1 2.964 0.030 . 1 . . . . 68 LYS HE2 . 11203 1 812 . 1 1 68 68 LYS HE3 H 1 2.964 0.030 . 1 . . . . 68 LYS HE3 . 11203 1 813 . 1 1 68 68 LYS HG2 H 1 1.330 0.030 . 2 . . . . 68 LYS HG2 . 11203 1 814 . 1 1 68 68 LYS HG3 H 1 1.282 0.030 . 2 . . . . 68 LYS HG3 . 11203 1 815 . 1 1 68 68 LYS C C 13 174.344 0.300 . 1 . . . . 68 LYS C . 11203 1 816 . 1 1 68 68 LYS CA C 13 54.834 0.300 . 1 . . . . 68 LYS CA . 11203 1 817 . 1 1 68 68 LYS CB C 13 36.332 0.300 . 1 . . . . 68 LYS CB . 11203 1 818 . 1 1 68 68 LYS CD C 13 29.236 0.300 . 1 . . . . 68 LYS CD . 11203 1 819 . 1 1 68 68 LYS CE C 13 42.350 0.300 . 1 . . . . 68 LYS CE . 11203 1 820 . 1 1 68 68 LYS CG C 13 25.112 0.300 . 1 . . . . 68 LYS CG . 11203 1 821 . 1 1 68 68 LYS N N 15 119.639 0.300 . 1 . . . . 68 LYS N . 11203 1 822 . 1 1 69 69 SER H H 1 8.113 0.030 . 1 . . . . 69 SER H . 11203 1 823 . 1 1 69 69 SER HA H 1 5.657 0.030 . 1 . . . . 69 SER HA . 11203 1 824 . 1 1 69 69 SER HB2 H 1 3.815 0.030 . 2 . . . . 69 SER HB2 . 11203 1 825 . 1 1 69 69 SER HB3 H 1 3.708 0.030 . 2 . . . . 69 SER HB3 . 11203 1 826 . 1 1 69 69 SER C C 13 172.375 0.300 . 1 . . . . 69 SER C . 11203 1 827 . 1 1 69 69 SER CA C 13 57.176 0.300 . 1 . . . . 69 SER CA . 11203 1 828 . 1 1 69 69 SER CB C 13 65.525 0.300 . 1 . . . . 69 SER CB . 11203 1 829 . 1 1 69 69 SER N N 15 114.540 0.300 . 1 . . . . 69 SER N . 11203 1 830 . 1 1 70 70 TYR H H 1 9.315 0.030 . 1 . . . . 70 TYR H . 11203 1 831 . 1 1 70 70 TYR HA H 1 5.567 0.030 . 1 . . . . 70 TYR HA . 11203 1 832 . 1 1 70 70 TYR HB2 H 1 2.870 0.030 . 2 . . . . 70 TYR HB2 . 11203 1 833 . 1 1 70 70 TYR HB3 H 1 2.602 0.030 . 2 . . . . 70 TYR HB3 . 11203 1 834 . 1 1 70 70 TYR HD1 H 1 6.897 0.030 . 1 . . . . 70 TYR HD1 . 11203 1 835 . 1 1 70 70 TYR HD2 H 1 6.897 0.030 . 1 . . . . 70 TYR HD2 . 11203 1 836 . 1 1 70 70 TYR HE1 H 1 6.826 0.030 . 1 . . . . 70 TYR HE1 . 11203 1 837 . 1 1 70 70 TYR HE2 H 1 6.826 0.030 . 1 . . . . 70 TYR HE2 . 11203 1 838 . 1 1 70 70 TYR C C 13 174.832 0.300 . 1 . . . . 70 TYR C . 11203 1 839 . 1 1 70 70 TYR CA C 13 56.878 0.300 . 1 . . . . 70 TYR CA . 11203 1 840 . 1 1 70 70 TYR CB C 13 42.745 0.300 . 1 . . . . 70 TYR CB . 11203 1 841 . 1 1 70 70 TYR CD1 C 13 133.080 0.300 . 1 . . . . 70 TYR CD1 . 11203 1 842 . 1 1 70 70 TYR CD2 C 13 133.080 0.300 . 1 . . . . 70 TYR CD2 . 11203 1 843 . 1 1 70 70 TYR CE1 C 13 117.866 0.300 . 1 . . . . 70 TYR CE1 . 11203 1 844 . 1 1 70 70 TYR CE2 C 13 117.866 0.300 . 1 . . . . 70 TYR CE2 . 11203 1 845 . 1 1 70 70 TYR N N 15 121.117 0.300 . 1 . . . . 70 TYR N . 11203 1 846 . 1 1 71 71 SER H H 1 8.960 0.030 . 1 . . . . 71 SER H . 11203 1 847 . 1 1 71 71 SER HA H 1 5.554 0.030 . 1 . . . . 71 SER HA . 11203 1 848 . 1 1 71 71 SER HB2 H 1 3.766 0.030 . 2 . . . . 71 SER HB2 . 11203 1 849 . 1 1 71 71 SER HB3 H 1 3.429 0.030 . 2 . . . . 71 SER HB3 . 11203 1 850 . 1 1 71 71 SER C C 13 173.286 0.300 . 1 . . . . 71 SER C . 11203 1 851 . 1 1 71 71 SER CA C 13 55.740 0.300 . 1 . . . . 71 SER CA . 11203 1 852 . 1 1 71 71 SER CB C 13 66.644 0.300 . 1 . . . . 71 SER CB . 11203 1 853 . 1 1 71 71 SER N N 15 114.748 0.300 . 1 . . . . 71 SER N . 11203 1 854 . 1 1 72 72 MET H H 1 8.669 0.030 . 1 . . . . 72 MET H . 11203 1 855 . 1 1 72 72 MET HA H 1 4.667 0.030 . 1 . . . . 72 MET HA . 11203 1 856 . 1 1 72 72 MET HB2 H 1 2.054 0.030 . 1 . . . . 72 MET HB2 . 11203 1 857 . 1 1 72 72 MET HB3 H 1 2.054 0.030 . 1 . . . . 72 MET HB3 . 11203 1 858 . 1 1 72 72 MET HE1 H 1 1.568 0.030 . 1 . . . . 72 MET HE . 11203 1 859 . 1 1 72 72 MET HE2 H 1 1.568 0.030 . 1 . . . . 72 MET HE . 11203 1 860 . 1 1 72 72 MET HE3 H 1 1.568 0.030 . 1 . . . . 72 MET HE . 11203 1 861 . 1 1 72 72 MET HG2 H 1 2.557 0.030 . 2 . . . . 72 MET HG2 . 11203 1 862 . 1 1 72 72 MET HG3 H 1 2.123 0.030 . 2 . . . . 72 MET HG3 . 11203 1 863 . 1 1 72 72 MET C C 13 172.935 0.300 . 1 . . . . 72 MET C . 11203 1 864 . 1 1 72 72 MET CA C 13 56.514 0.300 . 1 . . . . 72 MET CA . 11203 1 865 . 1 1 72 72 MET CB C 13 37.932 0.300 . 1 . . . . 72 MET CB . 11203 1 866 . 1 1 72 72 MET CE C 13 18.077 0.300 . 1 . . . . 72 MET CE . 11203 1 867 . 1 1 72 72 MET CG C 13 32.253 0.300 . 1 . . . . 72 MET CG . 11203 1 868 . 1 1 72 72 MET N N 15 123.621 0.300 . 1 . . . . 72 MET N . 11203 1 869 . 1 1 73 73 ILE H H 1 8.362 0.030 . 1 . . . . 73 ILE H . 11203 1 870 . 1 1 73 73 ILE HA H 1 4.527 0.030 . 1 . . . . 73 ILE HA . 11203 1 871 . 1 1 73 73 ILE HB H 1 1.577 0.030 . 1 . . . . 73 ILE HB . 11203 1 872 . 1 1 73 73 ILE HD11 H 1 0.773 0.030 . 1 . . . . 73 ILE HD1 . 11203 1 873 . 1 1 73 73 ILE HD12 H 1 0.773 0.030 . 1 . . . . 73 ILE HD1 . 11203 1 874 . 1 1 73 73 ILE HD13 H 1 0.773 0.030 . 1 . . . . 73 ILE HD1 . 11203 1 875 . 1 1 73 73 ILE HG12 H 1 1.462 0.030 . 2 . . . . 73 ILE HG12 . 11203 1 876 . 1 1 73 73 ILE HG13 H 1 0.870 0.030 . 2 . . . . 73 ILE HG13 . 11203 1 877 . 1 1 73 73 ILE HG21 H 1 0.728 0.030 . 1 . . . . 73 ILE HG2 . 11203 1 878 . 1 1 73 73 ILE HG22 H 1 0.728 0.030 . 1 . . . . 73 ILE HG2 . 11203 1 879 . 1 1 73 73 ILE HG23 H 1 0.728 0.030 . 1 . . . . 73 ILE HG2 . 11203 1 880 . 1 1 73 73 ILE C C 13 175.091 0.300 . 1 . . . . 73 ILE C . 11203 1 881 . 1 1 73 73 ILE CA C 13 60.383 0.300 . 1 . . . . 73 ILE CA . 11203 1 882 . 1 1 73 73 ILE CB C 13 41.064 0.300 . 1 . . . . 73 ILE CB . 11203 1 883 . 1 1 73 73 ILE CD1 C 13 14.186 0.300 . 1 . . . . 73 ILE CD1 . 11203 1 884 . 1 1 73 73 ILE CG1 C 13 27.858 0.300 . 1 . . . . 73 ILE CG1 . 11203 1 885 . 1 1 73 73 ILE CG2 C 13 16.849 0.300 . 1 . . . . 73 ILE CG2 . 11203 1 886 . 1 1 73 73 ILE N N 15 125.996 0.300 . 1 . . . . 73 ILE N . 11203 1 887 . 1 1 74 74 VAL H H 1 7.912 0.030 . 1 . . . . 74 VAL H . 11203 1 888 . 1 1 74 74 VAL HA H 1 3.949 0.030 . 1 . . . . 74 VAL HA . 11203 1 889 . 1 1 74 74 VAL HB H 1 0.703 0.030 . 1 . . . . 74 VAL HB . 11203 1 890 . 1 1 74 74 VAL HG11 H 1 0.532 0.030 . 1 . . . . 74 VAL HG1 . 11203 1 891 . 1 1 74 74 VAL HG12 H 1 0.532 0.030 . 1 . . . . 74 VAL HG1 . 11203 1 892 . 1 1 74 74 VAL HG13 H 1 0.532 0.030 . 1 . . . . 74 VAL HG1 . 11203 1 893 . 1 1 74 74 VAL HG21 H 1 0.327 0.030 . 1 . . . . 74 VAL HG2 . 11203 1 894 . 1 1 74 74 VAL HG22 H 1 0.327 0.030 . 1 . . . . 74 VAL HG2 . 11203 1 895 . 1 1 74 74 VAL HG23 H 1 0.327 0.030 . 1 . . . . 74 VAL HG2 . 11203 1 896 . 1 1 74 74 VAL C C 13 173.401 0.300 . 1 . . . . 74 VAL C . 11203 1 897 . 1 1 74 74 VAL CA C 13 61.890 0.300 . 1 . . . . 74 VAL CA . 11203 1 898 . 1 1 74 74 VAL CB C 13 32.276 0.300 . 1 . . . . 74 VAL CB . 11203 1 899 . 1 1 74 74 VAL CG1 C 13 21.544 0.300 . 2 . . . . 74 VAL CG1 . 11203 1 900 . 1 1 74 74 VAL CG2 C 13 22.340 0.300 . 2 . . . . 74 VAL CG2 . 11203 1 901 . 1 1 74 74 VAL N N 15 128.592 0.300 . 1 . . . . 74 VAL N . 11203 1 902 . 1 1 75 75 ASN H H 1 8.075 0.030 . 1 . . . . 75 ASN H . 11203 1 903 . 1 1 75 75 ASN HA H 1 4.890 0.030 . 1 . . . . 75 ASN HA . 11203 1 904 . 1 1 75 75 ASN HB2 H 1 2.608 0.030 . 1 . . . . 75 ASN HB2 . 11203 1 905 . 1 1 75 75 ASN HB3 H 1 2.608 0.030 . 1 . . . . 75 ASN HB3 . 11203 1 906 . 1 1 75 75 ASN HD21 H 1 7.430 0.030 . 2 . . . . 75 ASN HD21 . 11203 1 907 . 1 1 75 75 ASN HD22 H 1 6.677 0.030 . 2 . . . . 75 ASN HD22 . 11203 1 908 . 1 1 75 75 ASN C C 13 174.337 0.300 . 1 . . . . 75 ASN C . 11203 1 909 . 1 1 75 75 ASN CA C 13 51.102 0.300 . 1 . . . . 75 ASN CA . 11203 1 910 . 1 1 75 75 ASN CB C 13 41.185 0.300 . 1 . . . . 75 ASN CB . 11203 1 911 . 1 1 75 75 ASN N N 15 122.515 0.300 . 1 . . . . 75 ASN N . 11203 1 912 . 1 1 75 75 ASN ND2 N 15 111.698 0.300 . 1 . . . . 75 ASN ND2 . 11203 1 913 . 1 1 76 76 ASN H H 1 8.436 0.030 . 1 . . . . 76 ASN H . 11203 1 914 . 1 1 76 76 ASN HA H 1 4.330 0.030 . 1 . . . . 76 ASN HA . 11203 1 915 . 1 1 76 76 ASN HB2 H 1 2.861 0.030 . 2 . . . . 76 ASN HB2 . 11203 1 916 . 1 1 76 76 ASN HB3 H 1 2.762 0.030 . 2 . . . . 76 ASN HB3 . 11203 1 917 . 1 1 76 76 ASN HD21 H 1 7.439 0.030 . 2 . . . . 76 ASN HD21 . 11203 1 918 . 1 1 76 76 ASN HD22 H 1 6.841 0.030 . 2 . . . . 76 ASN HD22 . 11203 1 919 . 1 1 76 76 ASN C C 13 174.827 0.300 . 1 . . . . 76 ASN C . 11203 1 920 . 1 1 76 76 ASN CA C 13 53.833 0.300 . 1 . . . . 76 ASN CA . 11203 1 921 . 1 1 76 76 ASN CB C 13 37.314 0.300 . 1 . . . . 76 ASN CB . 11203 1 922 . 1 1 76 76 ASN N N 15 114.424 0.300 . 1 . . . . 76 ASN N . 11203 1 923 . 1 1 76 76 ASN ND2 N 15 113.371 0.300 . 1 . . . . 76 ASN ND2 . 11203 1 924 . 1 1 77 77 LEU H H 1 8.354 0.030 . 1 . . . . 77 LEU H . 11203 1 925 . 1 1 77 77 LEU HA H 1 4.343 0.030 . 1 . . . . 77 LEU HA . 11203 1 926 . 1 1 77 77 LEU HB2 H 1 1.932 0.030 . 2 . . . . 77 LEU HB2 . 11203 1 927 . 1 1 77 77 LEU HB3 H 1 1.564 0.030 . 2 . . . . 77 LEU HB3 . 11203 1 928 . 1 1 77 77 LEU HD11 H 1 1.078 0.030 . 1 . . . . 77 LEU HD1 . 11203 1 929 . 1 1 77 77 LEU HD12 H 1 1.078 0.030 . 1 . . . . 77 LEU HD1 . 11203 1 930 . 1 1 77 77 LEU HD13 H 1 1.078 0.030 . 1 . . . . 77 LEU HD1 . 11203 1 931 . 1 1 77 77 LEU HD21 H 1 1.001 0.030 . 1 . . . . 77 LEU HD2 . 11203 1 932 . 1 1 77 77 LEU HD22 H 1 1.001 0.030 . 1 . . . . 77 LEU HD2 . 11203 1 933 . 1 1 77 77 LEU HD23 H 1 1.001 0.030 . 1 . . . . 77 LEU HD2 . 11203 1 934 . 1 1 77 77 LEU HG H 1 1.574 0.030 . 1 . . . . 77 LEU HG . 11203 1 935 . 1 1 77 77 LEU C C 13 178.072 0.300 . 1 . . . . 77 LEU C . 11203 1 936 . 1 1 77 77 LEU CA C 13 56.093 0.300 . 1 . . . . 77 LEU CA . 11203 1 937 . 1 1 77 77 LEU CB C 13 42.495 0.300 . 1 . . . . 77 LEU CB . 11203 1 938 . 1 1 77 77 LEU CD1 C 13 27.183 0.300 . 2 . . . . 77 LEU CD1 . 11203 1 939 . 1 1 77 77 LEU CD2 C 13 23.340 0.300 . 2 . . . . 77 LEU CD2 . 11203 1 940 . 1 1 77 77 LEU CG C 13 27.757 0.300 . 1 . . . . 77 LEU CG . 11203 1 941 . 1 1 77 77 LEU N N 15 117.822 0.300 . 1 . . . . 77 LEU N . 11203 1 942 . 1 1 78 78 LEU H H 1 8.124 0.030 . 1 . . . . 78 LEU H . 11203 1 943 . 1 1 78 78 LEU HA H 1 3.383 0.030 . 1 . . . . 78 LEU HA . 11203 1 944 . 1 1 78 78 LEU HB2 H 1 0.931 0.030 . 2 . . . . 78 LEU HB2 . 11203 1 945 . 1 1 78 78 LEU HB3 H 1 0.737 0.030 . 2 . . . . 78 LEU HB3 . 11203 1 946 . 1 1 78 78 LEU HD11 H 1 0.788 0.030 . 1 . . . . 78 LEU HD1 . 11203 1 947 . 1 1 78 78 LEU HD12 H 1 0.788 0.030 . 1 . . . . 78 LEU HD1 . 11203 1 948 . 1 1 78 78 LEU HD13 H 1 0.788 0.030 . 1 . . . . 78 LEU HD1 . 11203 1 949 . 1 1 78 78 LEU HD21 H 1 1.043 0.030 . 1 . . . . 78 LEU HD2 . 11203 1 950 . 1 1 78 78 LEU HD22 H 1 1.043 0.030 . 1 . . . . 78 LEU HD2 . 11203 1 951 . 1 1 78 78 LEU HD23 H 1 1.043 0.030 . 1 . . . . 78 LEU HD2 . 11203 1 952 . 1 1 78 78 LEU HG H 1 1.212 0.030 . 1 . . . . 78 LEU HG . 11203 1 953 . 1 1 78 78 LEU C C 13 175.862 0.300 . 1 . . . . 78 LEU C . 11203 1 954 . 1 1 78 78 LEU CA C 13 58.815 0.300 . 1 . . . . 78 LEU CA . 11203 1 955 . 1 1 78 78 LEU CB C 13 43.003 0.300 . 1 . . . . 78 LEU CB . 11203 1 956 . 1 1 78 78 LEU CD1 C 13 24.011 0.300 . 2 . . . . 78 LEU CD1 . 11203 1 957 . 1 1 78 78 LEU CD2 C 13 26.359 0.300 . 2 . . . . 78 LEU CD2 . 11203 1 958 . 1 1 78 78 LEU CG C 13 26.374 0.300 . 1 . . . . 78 LEU CG . 11203 1 959 . 1 1 78 78 LEU N N 15 122.036 0.300 . 1 . . . . 78 LEU N . 11203 1 960 . 1 1 79 79 LYS H H 1 5.704 0.030 . 1 . . . . 79 LYS H . 11203 1 961 . 1 1 79 79 LYS HA H 1 4.389 0.030 . 1 . . . . 79 LYS HA . 11203 1 962 . 1 1 79 79 LYS HB2 H 1 1.741 0.030 . 2 . . . . 79 LYS HB2 . 11203 1 963 . 1 1 79 79 LYS HB3 H 1 0.812 0.030 . 2 . . . . 79 LYS HB3 . 11203 1 964 . 1 1 79 79 LYS HD2 H 1 1.459 0.030 . 2 . . . . 79 LYS HD2 . 11203 1 965 . 1 1 79 79 LYS HD3 H 1 1.114 0.030 . 2 . . . . 79 LYS HD3 . 11203 1 966 . 1 1 79 79 LYS HE2 H 1 2.805 0.030 . 2 . . . . 79 LYS HE2 . 11203 1 967 . 1 1 79 79 LYS HE3 H 1 2.584 0.030 . 2 . . . . 79 LYS HE3 . 11203 1 968 . 1 1 79 79 LYS HG2 H 1 0.640 0.030 . 2 . . . . 79 LYS HG2 . 11203 1 969 . 1 1 79 79 LYS HG3 H 1 0.330 0.030 . 2 . . . . 79 LYS HG3 . 11203 1 970 . 1 1 79 79 LYS C C 13 171.371 0.300 . 1 . . . . 79 LYS C . 11203 1 971 . 1 1 79 79 LYS CA C 13 51.338 0.300 . 1 . . . . 79 LYS CA . 11203 1 972 . 1 1 79 79 LYS CB C 13 34.001 0.300 . 1 . . . . 79 LYS CB . 11203 1 973 . 1 1 79 79 LYS CD C 13 28.581 0.300 . 1 . . . . 79 LYS CD . 11203 1 974 . 1 1 79 79 LYS CE C 13 42.650 0.300 . 1 . . . . 79 LYS CE . 11203 1 975 . 1 1 79 79 LYS CG C 13 24.720 0.300 . 1 . . . . 79 LYS CG . 11203 1 976 . 1 1 79 79 LYS N N 15 111.642 0.300 . 1 . . . . 79 LYS N . 11203 1 977 . 1 1 80 80 PRO HA H 1 4.839 0.030 . 1 . . . . 80 PRO HA . 11203 1 978 . 1 1 80 80 PRO HB2 H 1 2.275 0.030 . 2 . . . . 80 PRO HB2 . 11203 1 979 . 1 1 80 80 PRO HB3 H 1 1.759 0.030 . 2 . . . . 80 PRO HB3 . 11203 1 980 . 1 1 80 80 PRO HD2 H 1 3.462 0.030 . 2 . . . . 80 PRO HD2 . 11203 1 981 . 1 1 80 80 PRO HD3 H 1 3.670 0.030 . 2 . . . . 80 PRO HD3 . 11203 1 982 . 1 1 80 80 PRO HG2 H 1 1.900 0.030 . 2 . . . . 80 PRO HG2 . 11203 1 983 . 1 1 80 80 PRO HG3 H 1 2.001 0.030 . 2 . . . . 80 PRO HG3 . 11203 1 984 . 1 1 80 80 PRO C C 13 177.200 0.300 . 1 . . . . 80 PRO C . 11203 1 985 . 1 1 80 80 PRO CA C 13 62.315 0.300 . 1 . . . . 80 PRO CA . 11203 1 986 . 1 1 80 80 PRO CB C 13 32.924 0.300 . 1 . . . . 80 PRO CB . 11203 1 987 . 1 1 80 80 PRO CD C 13 49.841 0.300 . 1 . . . . 80 PRO CD . 11203 1 988 . 1 1 80 80 PRO CG C 13 28.137 0.300 . 1 . . . . 80 PRO CG . 11203 1 989 . 1 1 81 81 ILE H H 1 9.205 0.030 . 1 . . . . 81 ILE H . 11203 1 990 . 1 1 81 81 ILE HA H 1 4.996 0.030 . 1 . . . . 81 ILE HA . 11203 1 991 . 1 1 81 81 ILE HB H 1 1.776 0.030 . 1 . . . . 81 ILE HB . 11203 1 992 . 1 1 81 81 ILE HD11 H 1 1.050 0.030 . 1 . . . . 81 ILE HD1 . 11203 1 993 . 1 1 81 81 ILE HD12 H 1 1.050 0.030 . 1 . . . . 81 ILE HD1 . 11203 1 994 . 1 1 81 81 ILE HD13 H 1 1.050 0.030 . 1 . . . . 81 ILE HD1 . 11203 1 995 . 1 1 81 81 ILE HG12 H 1 1.286 0.030 . 2 . . . . 81 ILE HG12 . 11203 1 996 . 1 1 81 81 ILE HG13 H 1 1.209 0.030 . 2 . . . . 81 ILE HG13 . 11203 1 997 . 1 1 81 81 ILE HG21 H 1 1.015 0.030 . 1 . . . . 81 ILE HG2 . 11203 1 998 . 1 1 81 81 ILE HG22 H 1 1.015 0.030 . 1 . . . . 81 ILE HG2 . 11203 1 999 . 1 1 81 81 ILE HG23 H 1 1.015 0.030 . 1 . . . . 81 ILE HG2 . 11203 1 1000 . 1 1 81 81 ILE C C 13 175.584 0.300 . 1 . . . . 81 ILE C . 11203 1 1001 . 1 1 81 81 ILE CA C 13 59.277 0.300 . 1 . . . . 81 ILE CA . 11203 1 1002 . 1 1 81 81 ILE CB C 13 41.412 0.300 . 1 . . . . 81 ILE CB . 11203 1 1003 . 1 1 81 81 ILE CD1 C 13 14.972 0.300 . 1 . . . . 81 ILE CD1 . 11203 1 1004 . 1 1 81 81 ILE CG1 C 13 25.901 0.300 . 1 . . . . 81 ILE CG1 . 11203 1 1005 . 1 1 81 81 ILE CG2 C 13 18.505 0.300 . 1 . . . . 81 ILE CG2 . 11203 1 1006 . 1 1 81 81 ILE N N 15 116.752 0.300 . 1 . . . . 81 ILE N . 11203 1 1007 . 1 1 82 82 SER H H 1 8.710 0.030 . 1 . . . . 82 SER H . 11203 1 1008 . 1 1 82 82 SER HA H 1 4.655 0.030 . 1 . . . . 82 SER HA . 11203 1 1009 . 1 1 82 82 SER HB2 H 1 3.528 0.030 . 2 . . . . 82 SER HB2 . 11203 1 1010 . 1 1 82 82 SER HB3 H 1 3.462 0.030 . 2 . . . . 82 SER HB3 . 11203 1 1011 . 1 1 82 82 SER C C 13 175.969 0.300 . 1 . . . . 82 SER C . 11203 1 1012 . 1 1 82 82 SER CA C 13 55.290 0.300 . 1 . . . . 82 SER CA . 11203 1 1013 . 1 1 82 82 SER CB C 13 63.359 0.300 . 1 . . . . 82 SER CB . 11203 1 1014 . 1 1 82 82 SER N N 15 113.322 0.300 . 1 . . . . 82 SER N . 11203 1 1015 . 1 1 83 83 VAL H H 1 9.040 0.030 . 1 . . . . 83 VAL H . 11203 1 1016 . 1 1 83 83 VAL HA H 1 3.108 0.030 . 1 . . . . 83 VAL HA . 11203 1 1017 . 1 1 83 83 VAL HB H 1 2.053 0.030 . 1 . . . . 83 VAL HB . 11203 1 1018 . 1 1 83 83 VAL HG11 H 1 0.979 0.030 . 1 . . . . 83 VAL HG1 . 11203 1 1019 . 1 1 83 83 VAL HG12 H 1 0.979 0.030 . 1 . . . . 83 VAL HG1 . 11203 1 1020 . 1 1 83 83 VAL HG13 H 1 0.979 0.030 . 1 . . . . 83 VAL HG1 . 11203 1 1021 . 1 1 83 83 VAL HG21 H 1 0.927 0.030 . 1 . . . . 83 VAL HG2 . 11203 1 1022 . 1 1 83 83 VAL HG22 H 1 0.927 0.030 . 1 . . . . 83 VAL HG2 . 11203 1 1023 . 1 1 83 83 VAL HG23 H 1 0.927 0.030 . 1 . . . . 83 VAL HG2 . 11203 1 1024 . 1 1 83 83 VAL C C 13 178.637 0.300 . 1 . . . . 83 VAL C . 11203 1 1025 . 1 1 83 83 VAL CA C 13 67.537 0.300 . 1 . . . . 83 VAL CA . 11203 1 1026 . 1 1 83 83 VAL CB C 13 31.745 0.300 . 1 . . . . 83 VAL CB . 11203 1 1027 . 1 1 83 83 VAL CG1 C 13 20.967 0.300 . 2 . . . . 83 VAL CG1 . 11203 1 1028 . 1 1 83 83 VAL CG2 C 13 22.215 0.300 . 2 . . . . 83 VAL CG2 . 11203 1 1029 . 1 1 83 83 VAL N N 15 133.064 0.300 . 1 . . . . 83 VAL N . 11203 1 1030 . 1 1 84 84 GLU H H 1 8.990 0.030 . 1 . . . . 84 GLU H . 11203 1 1031 . 1 1 84 84 GLU HA H 1 4.132 0.030 . 1 . . . . 84 GLU HA . 11203 1 1032 . 1 1 84 84 GLU HB2 H 1 1.974 0.030 . 1 . . . . 84 GLU HB2 . 11203 1 1033 . 1 1 84 84 GLU HB3 H 1 1.974 0.030 . 1 . . . . 84 GLU HB3 . 11203 1 1034 . 1 1 84 84 GLU HG2 H 1 2.340 0.030 . 2 . . . . 84 GLU HG2 . 11203 1 1035 . 1 1 84 84 GLU HG3 H 1 2.293 0.030 . 2 . . . . 84 GLU HG3 . 11203 1 1036 . 1 1 84 84 GLU C C 13 177.296 0.300 . 1 . . . . 84 GLU C . 11203 1 1037 . 1 1 84 84 GLU CA C 13 58.742 0.300 . 1 . . . . 84 GLU CA . 11203 1 1038 . 1 1 84 84 GLU CB C 13 28.727 0.300 . 1 . . . . 84 GLU CB . 11203 1 1039 . 1 1 84 84 GLU CG C 13 36.349 0.300 . 1 . . . . 84 GLU CG . 11203 1 1040 . 1 1 84 84 GLU N N 15 118.115 0.300 . 1 . . . . 84 GLU N . 11203 1 1041 . 1 1 85 85 GLY H H 1 7.683 0.030 . 1 . . . . 85 GLY H . 11203 1 1042 . 1 1 85 85 GLY HA2 H 1 4.299 0.030 . 2 . . . . 85 GLY HA2 . 11203 1 1043 . 1 1 85 85 GLY HA3 H 1 3.526 0.030 . 2 . . . . 85 GLY HA3 . 11203 1 1044 . 1 1 85 85 GLY C C 13 174.622 0.300 . 1 . . . . 85 GLY C . 11203 1 1045 . 1 1 85 85 GLY CA C 13 44.926 0.300 . 1 . . . . 85 GLY CA . 11203 1 1046 . 1 1 85 85 GLY N N 15 106.000 0.300 . 1 . . . . 85 GLY N . 11203 1 1047 . 1 1 86 86 SER H H 1 7.214 0.030 . 1 . . . . 86 SER H . 11203 1 1048 . 1 1 86 86 SER HA H 1 4.792 0.030 . 1 . . . . 86 SER HA . 11203 1 1049 . 1 1 86 86 SER HB2 H 1 2.882 0.030 . 2 . . . . 86 SER HB2 . 11203 1 1050 . 1 1 86 86 SER HB3 H 1 2.586 0.030 . 2 . . . . 86 SER HB3 . 11203 1 1051 . 1 1 86 86 SER C C 13 172.732 0.300 . 1 . . . . 86 SER C . 11203 1 1052 . 1 1 86 86 SER CA C 13 59.941 0.300 . 1 . . . . 86 SER CA . 11203 1 1053 . 1 1 86 86 SER CB C 13 62.020 0.300 . 1 . . . . 86 SER CB . 11203 1 1054 . 1 1 86 86 SER N N 15 120.503 0.300 . 1 . . . . 86 SER N . 11203 1 1055 . 1 1 87 87 SER H H 1 9.263 0.030 . 1 . . . . 87 SER H . 11203 1 1056 . 1 1 87 87 SER HA H 1 4.818 0.030 . 1 . . . . 87 SER HA . 11203 1 1057 . 1 1 87 87 SER HB2 H 1 3.975 0.030 . 2 . . . . 87 SER HB2 . 11203 1 1058 . 1 1 87 87 SER HB3 H 1 3.840 0.030 . 2 . . . . 87 SER HB3 . 11203 1 1059 . 1 1 87 87 SER C C 13 171.685 0.300 . 1 . . . . 87 SER C . 11203 1 1060 . 1 1 87 87 SER CA C 13 58.356 0.300 . 1 . . . . 87 SER CA . 11203 1 1061 . 1 1 87 87 SER CB C 13 65.063 0.300 . 1 . . . . 87 SER CB . 11203 1 1062 . 1 1 87 87 SER N N 15 117.154 0.300 . 1 . . . . 87 SER N . 11203 1 1063 . 1 1 88 88 LYS H H 1 8.402 0.030 . 1 . . . . 88 LYS H . 11203 1 1064 . 1 1 88 88 LYS HA H 1 5.551 0.030 . 1 . . . . 88 LYS HA . 11203 1 1065 . 1 1 88 88 LYS HB2 H 1 1.686 0.030 . 1 . . . . 88 LYS HB2 . 11203 1 1066 . 1 1 88 88 LYS HB3 H 1 1.686 0.030 . 1 . . . . 88 LYS HB3 . 11203 1 1067 . 1 1 88 88 LYS HD2 H 1 1.453 0.030 . 2 . . . . 88 LYS HD2 . 11203 1 1068 . 1 1 88 88 LYS HD3 H 1 1.410 0.030 . 2 . . . . 88 LYS HD3 . 11203 1 1069 . 1 1 88 88 LYS HE2 H 1 2.937 0.030 . 2 . . . . 88 LYS HE2 . 11203 1 1070 . 1 1 88 88 LYS HE3 H 1 2.888 0.030 . 2 . . . . 88 LYS HE3 . 11203 1 1071 . 1 1 88 88 LYS HG2 H 1 1.335 0.030 . 1 . . . . 88 LYS HG2 . 11203 1 1072 . 1 1 88 88 LYS HG3 H 1 1.335 0.030 . 1 . . . . 88 LYS HG3 . 11203 1 1073 . 1 1 88 88 LYS C C 13 174.630 0.300 . 1 . . . . 88 LYS C . 11203 1 1074 . 1 1 88 88 LYS CA C 13 53.555 0.300 . 1 . . . . 88 LYS CA . 11203 1 1075 . 1 1 88 88 LYS CB C 13 36.005 0.300 . 1 . . . . 88 LYS CB . 11203 1 1076 . 1 1 88 88 LYS CD C 13 29.837 0.300 . 1 . . . . 88 LYS CD . 11203 1 1077 . 1 1 88 88 LYS CE C 13 42.825 0.300 . 1 . . . . 88 LYS CE . 11203 1 1078 . 1 1 88 88 LYS CG C 13 23.900 0.300 . 1 . . . . 88 LYS CG . 11203 1 1079 . 1 1 88 88 LYS N N 15 115.093 0.300 . 1 . . . . 88 LYS N . 11203 1 1080 . 1 1 89 89 LYS H H 1 9.431 0.030 . 1 . . . . 89 LYS H . 11203 1 1081 . 1 1 89 89 LYS HA H 1 4.616 0.030 . 1 . . . . 89 LYS HA . 11203 1 1082 . 1 1 89 89 LYS HB2 H 1 1.740 0.030 . 2 . . . . 89 LYS HB2 . 11203 1 1083 . 1 1 89 89 LYS HB3 H 1 1.584 0.030 . 2 . . . . 89 LYS HB3 . 11203 1 1084 . 1 1 89 89 LYS HD2 H 1 1.645 0.030 . 2 . . . . 89 LYS HD2 . 11203 1 1085 . 1 1 89 89 LYS HD3 H 1 1.585 0.030 . 2 . . . . 89 LYS HD3 . 11203 1 1086 . 1 1 89 89 LYS HE2 H 1 2.850 0.030 . 2 . . . . 89 LYS HE2 . 11203 1 1087 . 1 1 89 89 LYS HG2 H 1 1.300 0.030 . 1 . . . . 89 LYS HG2 . 11203 1 1088 . 1 1 89 89 LYS HG3 H 1 1.300 0.030 . 1 . . . . 89 LYS HG3 . 11203 1 1089 . 1 1 89 89 LYS C C 13 173.868 0.300 . 1 . . . . 89 LYS C . 11203 1 1090 . 1 1 89 89 LYS CA C 13 55.287 0.300 . 1 . . . . 89 LYS CA . 11203 1 1091 . 1 1 89 89 LYS CB C 13 36.711 0.300 . 1 . . . . 89 LYS CB . 11203 1 1092 . 1 1 89 89 LYS CD C 13 29.178 0.300 . 1 . . . . 89 LYS CD . 11203 1 1093 . 1 1 89 89 LYS CE C 13 42.111 0.300 . 1 . . . . 89 LYS CE . 11203 1 1094 . 1 1 89 89 LYS CG C 13 25.108 0.300 . 1 . . . . 89 LYS CG . 11203 1 1095 . 1 1 89 89 LYS N N 15 121.521 0.300 . 1 . . . . 89 LYS N . 11203 1 1096 . 1 1 90 90 VAL H H 1 8.677 0.030 . 1 . . . . 90 VAL H . 11203 1 1097 . 1 1 90 90 VAL HA H 1 4.740 0.030 . 1 . . . . 90 VAL HA . 11203 1 1098 . 1 1 90 90 VAL HB H 1 2.048 0.030 . 1 . . . . 90 VAL HB . 11203 1 1099 . 1 1 90 90 VAL HG11 H 1 1.055 0.030 . 1 . . . . 90 VAL HG1 . 11203 1 1100 . 1 1 90 90 VAL HG12 H 1 1.055 0.030 . 1 . . . . 90 VAL HG1 . 11203 1 1101 . 1 1 90 90 VAL HG13 H 1 1.055 0.030 . 1 . . . . 90 VAL HG1 . 11203 1 1102 . 1 1 90 90 VAL HG21 H 1 0.973 0.030 . 1 . . . . 90 VAL HG2 . 11203 1 1103 . 1 1 90 90 VAL HG22 H 1 0.973 0.030 . 1 . . . . 90 VAL HG2 . 11203 1 1104 . 1 1 90 90 VAL HG23 H 1 0.973 0.030 . 1 . . . . 90 VAL HG2 . 11203 1 1105 . 1 1 90 90 VAL C C 13 175.671 0.300 . 1 . . . . 90 VAL C . 11203 1 1106 . 1 1 90 90 VAL CA C 13 62.089 0.300 . 1 . . . . 90 VAL CA . 11203 1 1107 . 1 1 90 90 VAL CB C 13 33.369 0.300 . 1 . . . . 90 VAL CB . 11203 1 1108 . 1 1 90 90 VAL CG1 C 13 22.338 0.300 . 2 . . . . 90 VAL CG1 . 11203 1 1109 . 1 1 90 90 VAL CG2 C 13 21.881 0.300 . 2 . . . . 90 VAL CG2 . 11203 1 1110 . 1 1 90 90 VAL N N 15 123.264 0.300 . 1 . . . . 90 VAL N . 11203 1 1111 . 1 1 91 91 LYS H H 1 9.048 0.030 . 1 . . . . 91 LYS H . 11203 1 1112 . 1 1 91 91 LYS HA H 1 4.713 0.030 . 1 . . . . 91 LYS HA . 11203 1 1113 . 1 1 91 91 LYS HB2 H 1 2.020 0.030 . 2 . . . . 91 LYS HB2 . 11203 1 1114 . 1 1 91 91 LYS HB3 H 1 1.474 0.030 . 2 . . . . 91 LYS HB3 . 11203 1 1115 . 1 1 91 91 LYS HD2 H 1 1.630 0.030 . 2 . . . . 91 LYS HD2 . 11203 1 1116 . 1 1 91 91 LYS HD3 H 1 1.584 0.030 . 2 . . . . 91 LYS HD3 . 11203 1 1117 . 1 1 91 91 LYS HE2 H 1 2.894 0.030 . 2 . . . . 91 LYS HE2 . 11203 1 1118 . 1 1 91 91 LYS HE3 H 1 2.853 0.030 . 2 . . . . 91 LYS HE3 . 11203 1 1119 . 1 1 91 91 LYS HG2 H 1 1.317 0.030 . 2 . . . . 91 LYS HG2 . 11203 1 1120 . 1 1 91 91 LYS HG3 H 1 1.220 0.030 . 2 . . . . 91 LYS HG3 . 11203 1 1121 . 1 1 91 91 LYS C C 13 175.288 0.300 . 1 . . . . 91 LYS C . 11203 1 1122 . 1 1 91 91 LYS CA C 13 54.087 0.300 . 1 . . . . 91 LYS CA . 11203 1 1123 . 1 1 91 91 LYS CB C 13 35.288 0.300 . 1 . . . . 91 LYS CB . 11203 1 1124 . 1 1 91 91 LYS CD C 13 29.294 0.300 . 1 . . . . 91 LYS CD . 11203 1 1125 . 1 1 91 91 LYS CE C 13 41.842 0.300 . 1 . . . . 91 LYS CE . 11203 1 1126 . 1 1 91 91 LYS CG C 13 24.706 0.300 . 1 . . . . 91 LYS CG . 11203 1 1127 . 1 1 91 91 LYS N N 15 128.040 0.300 . 1 . . . . 91 LYS N . 11203 1 1128 . 1 1 92 92 THR H H 1 7.936 0.030 . 1 . . . . 92 THR H . 11203 1 1129 . 1 1 92 92 THR HA H 1 2.789 0.030 . 1 . . . . 92 THR HA . 11203 1 1130 . 1 1 92 92 THR HB H 1 3.706 0.030 . 1 . . . . 92 THR HB . 11203 1 1131 . 1 1 92 92 THR HG21 H 1 0.680 0.030 . 1 . . . . 92 THR HG2 . 11203 1 1132 . 1 1 92 92 THR HG22 H 1 0.680 0.030 . 1 . . . . 92 THR HG2 . 11203 1 1133 . 1 1 92 92 THR HG23 H 1 0.680 0.030 . 1 . . . . 92 THR HG2 . 11203 1 1134 . 1 1 92 92 THR C C 13 176.430 0.300 . 1 . . . . 92 THR C . 11203 1 1135 . 1 1 92 92 THR CA C 13 65.308 0.300 . 1 . . . . 92 THR CA . 11203 1 1136 . 1 1 92 92 THR CB C 13 68.084 0.300 . 1 . . . . 92 THR CB . 11203 1 1137 . 1 1 92 92 THR CG2 C 13 21.552 0.300 . 1 . . . . 92 THR CG2 . 11203 1 1138 . 1 1 92 92 THR N N 15 116.096 0.300 . 1 . . . . 92 THR N . 11203 1 1139 . 1 1 93 93 ASP H H 1 9.815 0.030 . 1 . . . . 93 ASP H . 11203 1 1140 . 1 1 93 93 ASP HA H 1 4.807 0.030 . 1 . . . . 93 ASP HA . 11203 1 1141 . 1 1 93 93 ASP HB2 H 1 3.070 0.030 . 2 . . . . 93 ASP HB2 . 11203 1 1142 . 1 1 93 93 ASP HB3 H 1 2.891 0.030 . 2 . . . . 93 ASP HB3 . 11203 1 1143 . 1 1 93 93 ASP C C 13 174.262 0.300 . 1 . . . . 93 ASP C . 11203 1 1144 . 1 1 93 93 ASP CA C 13 57.231 0.300 . 1 . . . . 93 ASP CA . 11203 1 1145 . 1 1 93 93 ASP CB C 13 41.012 0.300 . 1 . . . . 93 ASP CB . 11203 1 1146 . 1 1 93 93 ASP N N 15 128.322 0.300 . 1 . . . . 93 ASP N . 11203 1 1147 . 1 1 94 94 THR H H 1 8.047 0.030 . 1 . . . . 94 THR H . 11203 1 1148 . 1 1 94 94 THR HA H 1 5.412 0.030 . 1 . . . . 94 THR HA . 11203 1 1149 . 1 1 94 94 THR HB H 1 3.467 0.030 . 1 . . . . 94 THR HB . 11203 1 1150 . 1 1 94 94 THR HG21 H 1 1.082 0.030 . 1 . . . . 94 THR HG2 . 11203 1 1151 . 1 1 94 94 THR HG22 H 1 1.082 0.030 . 1 . . . . 94 THR HG2 . 11203 1 1152 . 1 1 94 94 THR HG23 H 1 1.082 0.030 . 1 . . . . 94 THR HG2 . 11203 1 1153 . 1 1 94 94 THR C C 13 172.464 0.300 . 1 . . . . 94 THR C . 11203 1 1154 . 1 1 94 94 THR CA C 13 62.451 0.300 . 1 . . . . 94 THR CA . 11203 1 1155 . 1 1 94 94 THR CB C 13 73.814 0.300 . 1 . . . . 94 THR CB . 11203 1 1156 . 1 1 94 94 THR CG2 C 13 20.097 0.300 . 1 . . . . 94 THR CG2 . 11203 1 1157 . 1 1 94 94 THR N N 15 115.207 0.300 . 1 . . . . 94 THR N . 11203 1 1158 . 1 1 95 95 VAL H H 1 9.278 0.030 . 1 . . . . 95 VAL H . 11203 1 1159 . 1 1 95 95 VAL HA H 1 4.414 0.030 . 1 . . . . 95 VAL HA . 11203 1 1160 . 1 1 95 95 VAL HB H 1 1.901 0.030 . 1 . . . . 95 VAL HB . 11203 1 1161 . 1 1 95 95 VAL HG11 H 1 0.715 0.030 . 1 . . . . 95 VAL HG1 . 11203 1 1162 . 1 1 95 95 VAL HG12 H 1 0.715 0.030 . 1 . . . . 95 VAL HG1 . 11203 1 1163 . 1 1 95 95 VAL HG13 H 1 0.715 0.030 . 1 . . . . 95 VAL HG1 . 11203 1 1164 . 1 1 95 95 VAL HG21 H 1 0.916 0.030 . 1 . . . . 95 VAL HG2 . 11203 1 1165 . 1 1 95 95 VAL HG22 H 1 0.916 0.030 . 1 . . . . 95 VAL HG2 . 11203 1 1166 . 1 1 95 95 VAL HG23 H 1 0.916 0.030 . 1 . . . . 95 VAL HG2 . 11203 1 1167 . 1 1 95 95 VAL C C 13 172.918 0.300 . 1 . . . . 95 VAL C . 11203 1 1168 . 1 1 95 95 VAL CA C 13 62.102 0.300 . 1 . . . . 95 VAL CA . 11203 1 1169 . 1 1 95 95 VAL CB C 13 33.681 0.300 . 1 . . . . 95 VAL CB . 11203 1 1170 . 1 1 95 95 VAL CG1 C 13 21.388 0.300 . 2 . . . . 95 VAL CG1 . 11203 1 1171 . 1 1 95 95 VAL CG2 C 13 23.105 0.300 . 2 . . . . 95 VAL CG2 . 11203 1 1172 . 1 1 95 95 VAL N N 15 125.465 0.300 . 1 . . . . 95 VAL N . 11203 1 1173 . 1 1 96 96 LEU H H 1 9.029 0.030 . 1 . . . . 96 LEU H . 11203 1 1174 . 1 1 96 96 LEU HA H 1 5.184 0.030 . 1 . . . . 96 LEU HA . 11203 1 1175 . 1 1 96 96 LEU HB2 H 1 1.459 0.030 . 2 . . . . 96 LEU HB2 . 11203 1 1176 . 1 1 96 96 LEU HB3 H 1 1.206 0.030 . 2 . . . . 96 LEU HB3 . 11203 1 1177 . 1 1 96 96 LEU HD11 H 1 0.663 0.030 . 1 . . . . 96 LEU HD1 . 11203 1 1178 . 1 1 96 96 LEU HD12 H 1 0.663 0.030 . 1 . . . . 96 LEU HD1 . 11203 1 1179 . 1 1 96 96 LEU HD13 H 1 0.663 0.030 . 1 . . . . 96 LEU HD1 . 11203 1 1180 . 1 1 96 96 LEU HD21 H 1 0.428 0.030 . 1 . . . . 96 LEU HD2 . 11203 1 1181 . 1 1 96 96 LEU HD22 H 1 0.428 0.030 . 1 . . . . 96 LEU HD2 . 11203 1 1182 . 1 1 96 96 LEU HD23 H 1 0.428 0.030 . 1 . . . . 96 LEU HD2 . 11203 1 1183 . 1 1 96 96 LEU HG H 1 1.234 0.030 . 1 . . . . 96 LEU HG . 11203 1 1184 . 1 1 96 96 LEU C C 13 174.960 0.300 . 1 . . . . 96 LEU C . 11203 1 1185 . 1 1 96 96 LEU CA C 13 53.087 0.300 . 1 . . . . 96 LEU CA . 11203 1 1186 . 1 1 96 96 LEU CB C 13 43.968 0.300 . 1 . . . . 96 LEU CB . 11203 1 1187 . 1 1 96 96 LEU CD1 C 13 26.338 0.300 . 2 . . . . 96 LEU CD1 . 11203 1 1188 . 1 1 96 96 LEU CD2 C 13 23.940 0.300 . 2 . . . . 96 LEU CD2 . 11203 1 1189 . 1 1 96 96 LEU CG C 13 27.926 0.300 . 1 . . . . 96 LEU CG . 11203 1 1190 . 1 1 96 96 LEU N N 15 129.282 0.300 . 1 . . . . 96 LEU N . 11203 1 1191 . 1 1 97 97 ILE H H 1 9.268 0.030 . 1 . . . . 97 ILE H . 11203 1 1192 . 1 1 97 97 ILE HA H 1 4.191 0.030 . 1 . . . . 97 ILE HA . 11203 1 1193 . 1 1 97 97 ILE HB H 1 1.535 0.030 . 1 . . . . 97 ILE HB . 11203 1 1194 . 1 1 97 97 ILE HD11 H 1 0.390 0.030 . 1 . . . . 97 ILE HD1 . 11203 1 1195 . 1 1 97 97 ILE HD12 H 1 0.390 0.030 . 1 . . . . 97 ILE HD1 . 11203 1 1196 . 1 1 97 97 ILE HD13 H 1 0.390 0.030 . 1 . . . . 97 ILE HD1 . 11203 1 1197 . 1 1 97 97 ILE HG12 H 1 0.991 0.030 . 2 . . . . 97 ILE HG12 . 11203 1 1198 . 1 1 97 97 ILE HG13 H 1 0.871 0.030 . 2 . . . . 97 ILE HG13 . 11203 1 1199 . 1 1 97 97 ILE HG21 H 1 0.333 0.030 . 1 . . . . 97 ILE HG2 . 11203 1 1200 . 1 1 97 97 ILE HG22 H 1 0.333 0.030 . 1 . . . . 97 ILE HG2 . 11203 1 1201 . 1 1 97 97 ILE HG23 H 1 0.333 0.030 . 1 . . . . 97 ILE HG2 . 11203 1 1202 . 1 1 97 97 ILE C C 13 173.951 0.300 . 1 . . . . 97 ILE C . 11203 1 1203 . 1 1 97 97 ILE CA C 13 60.076 0.300 . 1 . . . . 97 ILE CA . 11203 1 1204 . 1 1 97 97 ILE CB C 13 37.692 0.300 . 1 . . . . 97 ILE CB . 11203 1 1205 . 1 1 97 97 ILE CD1 C 13 13.012 0.300 . 1 . . . . 97 ILE CD1 . 11203 1 1206 . 1 1 97 97 ILE CG1 C 13 26.778 0.300 . 1 . . . . 97 ILE CG1 . 11203 1 1207 . 1 1 97 97 ILE CG2 C 13 17.791 0.300 . 1 . . . . 97 ILE CG2 . 11203 1 1208 . 1 1 97 97 ILE N N 15 125.639 0.300 . 1 . . . . 97 ILE N . 11203 1 1209 . 1 1 98 98 LEU H H 1 8.803 0.030 . 1 . . . . 98 LEU H . 11203 1 1210 . 1 1 98 98 LEU HA H 1 4.614 0.030 . 1 . . . . 98 LEU HA . 11203 1 1211 . 1 1 98 98 LEU HB2 H 1 1.607 0.030 . 2 . . . . 98 LEU HB2 . 11203 1 1212 . 1 1 98 98 LEU HB3 H 1 0.914 0.030 . 2 . . . . 98 LEU HB3 . 11203 1 1213 . 1 1 98 98 LEU HD11 H 1 0.399 0.030 . 1 . . . . 98 LEU HD1 . 11203 1 1214 . 1 1 98 98 LEU HD12 H 1 0.399 0.030 . 1 . . . . 98 LEU HD1 . 11203 1 1215 . 1 1 98 98 LEU HD13 H 1 0.399 0.030 . 1 . . . . 98 LEU HD1 . 11203 1 1216 . 1 1 98 98 LEU HD21 H 1 0.269 0.030 . 1 . . . . 98 LEU HD2 . 11203 1 1217 . 1 1 98 98 LEU HD22 H 1 0.269 0.030 . 1 . . . . 98 LEU HD2 . 11203 1 1218 . 1 1 98 98 LEU HD23 H 1 0.269 0.030 . 1 . . . . 98 LEU HD2 . 11203 1 1219 . 1 1 98 98 LEU HG H 1 1.088 0.030 . 1 . . . . 98 LEU HG . 11203 1 1220 . 1 1 98 98 LEU C C 13 175.246 0.300 . 1 . . . . 98 LEU C . 11203 1 1221 . 1 1 98 98 LEU CA C 13 53.555 0.300 . 1 . . . . 98 LEU CA . 11203 1 1222 . 1 1 98 98 LEU CB C 13 41.669 0.300 . 1 . . . . 98 LEU CB . 11203 1 1223 . 1 1 98 98 LEU CD1 C 13 25.073 0.300 . 2 . . . . 98 LEU CD1 . 11203 1 1224 . 1 1 98 98 LEU CD2 C 13 24.468 0.300 . 2 . . . . 98 LEU CD2 . 11203 1 1225 . 1 1 98 98 LEU CG C 13 27.180 0.300 . 1 . . . . 98 LEU CG . 11203 1 1226 . 1 1 98 98 LEU N N 15 128.540 0.300 . 1 . . . . 98 LEU N . 11203 1 1227 . 1 1 99 99 CYS H H 1 9.041 0.030 . 1 . . . . 99 CYS H . 11203 1 1228 . 1 1 99 99 CYS HA H 1 4.439 0.030 . 1 . . . . 99 CYS HA . 11203 1 1229 . 1 1 99 99 CYS HB2 H 1 3.036 0.030 . 2 . . . . 99 CYS HB2 . 11203 1 1230 . 1 1 99 99 CYS HB3 H 1 2.519 0.030 . 2 . . . . 99 CYS HB3 . 11203 1 1231 . 1 1 99 99 CYS C C 13 174.355 0.300 . 1 . . . . 99 CYS C . 11203 1 1232 . 1 1 99 99 CYS CA C 13 57.012 0.300 . 1 . . . . 99 CYS CA . 11203 1 1233 . 1 1 99 99 CYS CB C 13 27.846 0.300 . 1 . . . . 99 CYS CB . 11203 1 1234 . 1 1 99 99 CYS N N 15 120.534 0.300 . 1 . . . . 99 CYS N . 11203 1 1235 . 1 1 100 100 ARG H H 1 8.818 0.030 . 1 . . . . 100 ARG H . 11203 1 1236 . 1 1 100 100 ARG HA H 1 3.856 0.030 . 1 . . . . 100 ARG HA . 11203 1 1237 . 1 1 100 100 ARG HB2 H 1 1.866 0.030 . 2 . . . . 100 ARG HB2 . 11203 1 1238 . 1 1 100 100 ARG HB3 H 1 1.344 0.030 . 2 . . . . 100 ARG HB3 . 11203 1 1239 . 1 1 100 100 ARG HD2 H 1 2.733 0.030 . 2 . . . . 100 ARG HD2 . 11203 1 1240 . 1 1 100 100 ARG HD3 H 1 2.585 0.030 . 2 . . . . 100 ARG HD3 . 11203 1 1241 . 1 1 100 100 ARG HG2 H 1 1.377 0.030 . 2 . . . . 100 ARG HG2 . 11203 1 1242 . 1 1 100 100 ARG HG3 H 1 1.152 0.030 . 2 . . . . 100 ARG HG3 . 11203 1 1243 . 1 1 100 100 ARG C C 13 175.081 0.300 . 1 . . . . 100 ARG C . 11203 1 1244 . 1 1 100 100 ARG CA C 13 54.781 0.300 . 1 . . . . 100 ARG CA . 11203 1 1245 . 1 1 100 100 ARG CB C 13 29.448 0.300 . 1 . . . . 100 ARG CB . 11203 1 1246 . 1 1 100 100 ARG CD C 13 42.848 0.300 . 1 . . . . 100 ARG CD . 11203 1 1247 . 1 1 100 100 ARG CG C 13 26.620 0.300 . 1 . . . . 100 ARG CG . 11203 1 1248 . 1 1 100 100 ARG N N 15 128.916 0.300 . 1 . . . . 100 ARG N . 11203 1 1249 . 1 1 101 101 LYS H H 1 8.484 0.030 . 1 . . . . 101 LYS H . 11203 1 1250 . 1 1 101 101 LYS HA H 1 3.753 0.030 . 1 . . . . 101 LYS HA . 11203 1 1251 . 1 1 101 101 LYS HB2 H 1 2.019 0.030 . 2 . . . . 101 LYS HB2 . 11203 1 1252 . 1 1 101 101 LYS HB3 H 1 1.274 0.030 . 2 . . . . 101 LYS HB3 . 11203 1 1253 . 1 1 101 101 LYS HD2 H 1 1.770 0.030 . 2 . . . . 101 LYS HD2 . 11203 1 1254 . 1 1 101 101 LYS HD3 H 1 1.456 0.030 . 2 . . . . 101 LYS HD3 . 11203 1 1255 . 1 1 101 101 LYS HE2 H 1 2.464 0.030 . 2 . . . . 101 LYS HE2 . 11203 1 1256 . 1 1 101 101 LYS HE3 H 1 1.972 0.030 . 2 . . . . 101 LYS HE3 . 11203 1 1257 . 1 1 101 101 LYS HG2 H 1 1.082 0.030 . 2 . . . . 101 LYS HG2 . 11203 1 1258 . 1 1 101 101 LYS HG3 H 1 0.933 0.030 . 2 . . . . 101 LYS HG3 . 11203 1 1259 . 1 1 101 101 LYS C C 13 176.287 0.300 . 1 . . . . 101 LYS C . 11203 1 1260 . 1 1 101 101 LYS CA C 13 58.649 0.300 . 1 . . . . 101 LYS CA . 11203 1 1261 . 1 1 101 101 LYS CB C 13 33.723 0.300 . 1 . . . . 101 LYS CB . 11203 1 1262 . 1 1 101 101 LYS CD C 13 30.295 0.300 . 1 . . . . 101 LYS CD . 11203 1 1263 . 1 1 101 101 LYS CE C 13 42.420 0.300 . 1 . . . . 101 LYS CE . 11203 1 1264 . 1 1 101 101 LYS CG C 13 27.209 0.300 . 1 . . . . 101 LYS CG . 11203 1 1265 . 1 1 101 101 LYS N N 15 130.084 0.300 . 1 . . . . 101 LYS N . 11203 1 1266 . 1 1 102 102 LYS H H 1 7.990 0.030 . 1 . . . . 102 LYS H . 11203 1 1267 . 1 1 102 102 LYS HA H 1 3.885 0.030 . 1 . . . . 102 LYS HA . 11203 1 1268 . 1 1 102 102 LYS HB2 H 1 1.761 0.030 . 2 . . . . 102 LYS HB2 . 11203 1 1269 . 1 1 102 102 LYS HB3 H 1 1.312 0.030 . 2 . . . . 102 LYS HB3 . 11203 1 1270 . 1 1 102 102 LYS HD2 H 1 1.673 0.030 . 2 . . . . 102 LYS HD2 . 11203 1 1271 . 1 1 102 102 LYS HD3 H 1 1.561 0.030 . 2 . . . . 102 LYS HD3 . 11203 1 1272 . 1 1 102 102 LYS HE2 H 1 2.967 0.030 . 2 . . . . 102 LYS HE2 . 11203 1 1273 . 1 1 102 102 LYS HG2 H 1 1.344 0.030 . 1 . . . . 102 LYS HG2 . 11203 1 1274 . 1 1 102 102 LYS HG3 H 1 1.344 0.030 . 1 . . . . 102 LYS HG3 . 11203 1 1275 . 1 1 102 102 LYS C C 13 176.724 0.300 . 1 . . . . 102 LYS C . 11203 1 1276 . 1 1 102 102 LYS CA C 13 59.742 0.300 . 1 . . . . 102 LYS CA . 11203 1 1277 . 1 1 102 102 LYS CB C 13 32.906 0.300 . 1 . . . . 102 LYS CB . 11203 1 1278 . 1 1 102 102 LYS CD C 13 29.699 0.300 . 1 . . . . 102 LYS CD . 11203 1 1279 . 1 1 102 102 LYS CE C 13 42.189 0.300 . 1 . . . . 102 LYS CE . 11203 1 1280 . 1 1 102 102 LYS CG C 13 25.605 0.300 . 1 . . . . 102 LYS CG . 11203 1 1281 . 1 1 102 102 LYS N N 15 124.065 0.300 . 1 . . . . 102 LYS N . 11203 1 1282 . 1 1 103 103 VAL H H 1 7.928 0.030 . 1 . . . . 103 VAL H . 11203 1 1283 . 1 1 103 103 VAL HA H 1 4.115 0.030 . 1 . . . . 103 VAL HA . 11203 1 1284 . 1 1 103 103 VAL HB H 1 1.919 0.030 . 1 . . . . 103 VAL HB . 11203 1 1285 . 1 1 103 103 VAL HG11 H 1 0.948 0.030 . 1 . . . . 103 VAL HG1 . 11203 1 1286 . 1 1 103 103 VAL HG12 H 1 0.948 0.030 . 1 . . . . 103 VAL HG1 . 11203 1 1287 . 1 1 103 103 VAL HG13 H 1 0.948 0.030 . 1 . . . . 103 VAL HG1 . 11203 1 1288 . 1 1 103 103 VAL HG21 H 1 0.888 0.030 . 1 . . . . 103 VAL HG2 . 11203 1 1289 . 1 1 103 103 VAL HG22 H 1 0.888 0.030 . 1 . . . . 103 VAL HG2 . 11203 1 1290 . 1 1 103 103 VAL HG23 H 1 0.888 0.030 . 1 . . . . 103 VAL HG2 . 11203 1 1291 . 1 1 103 103 VAL C C 13 175.790 0.300 . 1 . . . . 103 VAL C . 11203 1 1292 . 1 1 103 103 VAL CA C 13 61.682 0.300 . 1 . . . . 103 VAL CA . 11203 1 1293 . 1 1 103 103 VAL CB C 13 31.545 0.300 . 1 . . . . 103 VAL CB . 11203 1 1294 . 1 1 103 103 VAL CG1 C 13 21.296 0.300 . 2 . . . . 103 VAL CG1 . 11203 1 1295 . 1 1 103 103 VAL CG2 C 13 21.256 0.300 . 2 . . . . 103 VAL CG2 . 11203 1 1296 . 1 1 103 103 VAL N N 15 118.029 0.300 . 1 . . . . 103 VAL N . 11203 1 1297 . 1 1 104 104 GLU H H 1 8.567 0.030 . 1 . . . . 104 GLU H . 11203 1 1298 . 1 1 104 104 GLU HA H 1 4.109 0.030 . 1 . . . . 104 GLU HA . 11203 1 1299 . 1 1 104 104 GLU HB2 H 1 1.965 0.030 . 2 . . . . 104 GLU HB2 . 11203 1 1300 . 1 1 104 104 GLU HB3 H 1 1.842 0.030 . 2 . . . . 104 GLU HB3 . 11203 1 1301 . 1 1 104 104 GLU HG2 H 1 2.295 0.030 . 2 . . . . 104 GLU HG2 . 11203 1 1302 . 1 1 104 104 GLU HG3 H 1 2.217 0.030 . 2 . . . . 104 GLU HG3 . 11203 1 1303 . 1 1 104 104 GLU C C 13 176.515 0.300 . 1 . . . . 104 GLU C . 11203 1 1304 . 1 1 104 104 GLU CA C 13 56.622 0.300 . 1 . . . . 104 GLU CA . 11203 1 1305 . 1 1 104 104 GLU CB C 13 30.059 0.300 . 1 . . . . 104 GLU CB . 11203 1 1306 . 1 1 104 104 GLU CG C 13 36.602 0.300 . 1 . . . . 104 GLU CG . 11203 1 1307 . 1 1 104 104 GLU N N 15 126.083 0.300 . 1 . . . . 104 GLU N . 11203 1 1308 . 1 1 105 105 ASN H H 1 9.268 0.030 . 1 . . . . 105 ASN H . 11203 1 1309 . 1 1 105 105 ASN HA H 1 4.284 0.030 . 1 . . . . 105 ASN HA . 11203 1 1310 . 1 1 105 105 ASN HB2 H 1 3.075 0.030 . 2 . . . . 105 ASN HB2 . 11203 1 1311 . 1 1 105 105 ASN HB3 H 1 3.016 0.030 . 2 . . . . 105 ASN HB3 . 11203 1 1312 . 1 1 105 105 ASN HD21 H 1 7.446 0.030 . 2 . . . . 105 ASN HD21 . 11203 1 1313 . 1 1 105 105 ASN HD22 H 1 6.814 0.030 . 2 . . . . 105 ASN HD22 . 11203 1 1314 . 1 1 105 105 ASN C C 13 174.517 0.300 . 1 . . . . 105 ASN C . 11203 1 1315 . 1 1 105 105 ASN CA C 13 55.078 0.300 . 1 . . . . 105 ASN CA . 11203 1 1316 . 1 1 105 105 ASN CB C 13 36.642 0.300 . 1 . . . . 105 ASN CB . 11203 1 1317 . 1 1 105 105 ASN N N 15 112.958 0.300 . 1 . . . . 105 ASN N . 11203 1 1318 . 1 1 105 105 ASN ND2 N 15 112.449 0.300 . 1 . . . . 105 ASN ND2 . 11203 1 1319 . 1 1 106 106 THR H H 1 7.069 0.030 . 1 . . . . 106 THR H . 11203 1 1320 . 1 1 106 106 THR HA H 1 4.432 0.030 . 1 . . . . 106 THR HA . 11203 1 1321 . 1 1 106 106 THR HB H 1 4.118 0.030 . 1 . . . . 106 THR HB . 11203 1 1322 . 1 1 106 106 THR HG21 H 1 1.212 0.030 . 1 . . . . 106 THR HG2 . 11203 1 1323 . 1 1 106 106 THR HG22 H 1 1.212 0.030 . 1 . . . . 106 THR HG2 . 11203 1 1324 . 1 1 106 106 THR HG23 H 1 1.212 0.030 . 1 . . . . 106 THR HG2 . 11203 1 1325 . 1 1 106 106 THR C C 13 173.706 0.300 . 1 . . . . 106 THR C . 11203 1 1326 . 1 1 106 106 THR CA C 13 61.298 0.300 . 1 . . . . 106 THR CA . 11203 1 1327 . 1 1 106 106 THR CB C 13 70.822 0.300 . 1 . . . . 106 THR CB . 11203 1 1328 . 1 1 106 106 THR CG2 C 13 21.231 0.300 . 1 . . . . 106 THR CG2 . 11203 1 1329 . 1 1 106 106 THR N N 15 112.325 0.300 . 1 . . . . 106 THR N . 11203 1 1330 . 1 1 107 107 ARG H H 1 9.177 0.030 . 1 . . . . 107 ARG H . 11203 1 1331 . 1 1 107 107 ARG HA H 1 4.263 0.030 . 1 . . . . 107 ARG HA . 11203 1 1332 . 1 1 107 107 ARG HB2 H 1 1.819 0.030 . 2 . . . . 107 ARG HB2 . 11203 1 1333 . 1 1 107 107 ARG HB3 H 1 1.726 0.030 . 2 . . . . 107 ARG HB3 . 11203 1 1334 . 1 1 107 107 ARG HD2 H 1 3.144 0.030 . 1 . . . . 107 ARG HD2 . 11203 1 1335 . 1 1 107 107 ARG HD3 H 1 3.144 0.030 . 1 . . . . 107 ARG HD3 . 11203 1 1336 . 1 1 107 107 ARG HE H 1 7.647 0.030 . 1 . . . . 107 ARG HE . 11203 1 1337 . 1 1 107 107 ARG HG2 H 1 1.514 0.030 . 2 . . . . 107 ARG HG2 . 11203 1 1338 . 1 1 107 107 ARG HG3 H 1 1.355 0.030 . 2 . . . . 107 ARG HG3 . 11203 1 1339 . 1 1 107 107 ARG C C 13 176.449 0.300 . 1 . . . . 107 ARG C . 11203 1 1340 . 1 1 107 107 ARG CA C 13 56.311 0.300 . 1 . . . . 107 ARG CA . 11203 1 1341 . 1 1 107 107 ARG CB C 13 30.709 0.300 . 1 . . . . 107 ARG CB . 11203 1 1342 . 1 1 107 107 ARG CD C 13 43.114 0.300 . 1 . . . . 107 ARG CD . 11203 1 1343 . 1 1 107 107 ARG CG C 13 27.761 0.300 . 1 . . . . 107 ARG CG . 11203 1 1344 . 1 1 108 108 TRP H H 1 10.196 0.030 . 1 . . . . 108 TRP H . 11203 1 1345 . 1 1 108 108 TRP HA H 1 4.828 0.030 . 1 . . . . 108 TRP HA . 11203 1 1346 . 1 1 108 108 TRP HB2 H 1 3.259 0.030 . 2 . . . . 108 TRP HB2 . 11203 1 1347 . 1 1 108 108 TRP HB3 H 1 3.710 0.030 . 2 . . . . 108 TRP HB3 . 11203 1 1348 . 1 1 108 108 TRP HD1 H 1 7.181 0.030 . 1 . . . . 108 TRP HD1 . 11203 1 1349 . 1 1 108 108 TRP HE1 H 1 10.683 0.030 . 1 . . . . 108 TRP HE1 . 11203 1 1350 . 1 1 108 108 TRP HE3 H 1 7.892 0.030 . 1 . . . . 108 TRP HE3 . 11203 1 1351 . 1 1 108 108 TRP HH2 H 1 7.206 0.030 . 1 . . . . 108 TRP HH2 . 11203 1 1352 . 1 1 108 108 TRP HZ2 H 1 6.941 0.030 . 1 . . . . 108 TRP HZ2 . 11203 1 1353 . 1 1 108 108 TRP HZ3 H 1 7.447 0.030 . 1 . . . . 108 TRP HZ3 . 11203 1 1354 . 1 1 108 108 TRP C C 13 176.974 0.300 . 1 . . . . 108 TRP C . 11203 1 1355 . 1 1 108 108 TRP CA C 13 56.644 0.300 . 1 . . . . 108 TRP CA . 11203 1 1356 . 1 1 108 108 TRP CB C 13 28.819 0.300 . 1 . . . . 108 TRP CB . 11203 1 1357 . 1 1 108 108 TRP CD1 C 13 122.173 0.300 . 1 . . . . 108 TRP CD1 . 11203 1 1358 . 1 1 108 108 TRP CE3 C 13 122.782 0.300 . 1 . . . . 108 TRP CE3 . 11203 1 1359 . 1 1 108 108 TRP CH2 C 13 125.665 0.300 . 1 . . . . 108 TRP CH2 . 11203 1 1360 . 1 1 108 108 TRP CZ2 C 13 114.446 0.300 . 1 . . . . 108 TRP CZ2 . 11203 1 1361 . 1 1 108 108 TRP CZ3 C 13 121.779 0.300 . 1 . . . . 108 TRP CZ3 . 11203 1 1362 . 1 1 108 108 TRP N N 15 130.754 0.300 . 1 . . . . 108 TRP N . 11203 1 1363 . 1 1 108 108 TRP NE1 N 15 127.578 0.300 . 1 . . . . 108 TRP NE1 . 11203 1 1364 . 1 1 109 109 ASP H H 1 9.223 0.030 . 1 . . . . 109 ASP H . 11203 1 1365 . 1 1 109 109 ASP HA H 1 4.458 0.030 . 1 . . . . 109 ASP HA . 11203 1 1366 . 1 1 109 109 ASP HB2 H 1 2.369 0.030 . 1 . . . . 109 ASP HB2 . 11203 1 1367 . 1 1 109 109 ASP HB3 H 1 2.369 0.030 . 1 . . . . 109 ASP HB3 . 11203 1 1368 . 1 1 109 109 ASP C C 13 174.391 0.300 . 1 . . . . 109 ASP C . 11203 1 1369 . 1 1 109 109 ASP CA C 13 55.873 0.300 . 1 . . . . 109 ASP CA . 11203 1 1370 . 1 1 109 109 ASP CB C 13 40.937 0.300 . 1 . . . . 109 ASP CB . 11203 1 1371 . 1 1 109 109 ASP N N 15 122.891 0.300 . 1 . . . . 109 ASP N . 11203 1 1372 . 1 1 110 110 TYR H H 1 7.584 0.030 . 1 . . . . 110 TYR H . 11203 1 1373 . 1 1 110 110 TYR HA H 1 4.901 0.030 . 1 . . . . 110 TYR HA . 11203 1 1374 . 1 1 110 110 TYR HB2 H 1 3.403 0.030 . 2 . . . . 110 TYR HB2 . 11203 1 1375 . 1 1 110 110 TYR HB3 H 1 2.507 0.030 . 2 . . . . 110 TYR HB3 . 11203 1 1376 . 1 1 110 110 TYR HD1 H 1 7.123 0.030 . 1 . . . . 110 TYR HD1 . 11203 1 1377 . 1 1 110 110 TYR HD2 H 1 7.123 0.030 . 1 . . . . 110 TYR HD2 . 11203 1 1378 . 1 1 110 110 TYR HE1 H 1 6.882 0.030 . 1 . . . . 110 TYR HE1 . 11203 1 1379 . 1 1 110 110 TYR HE2 H 1 6.882 0.030 . 1 . . . . 110 TYR HE2 . 11203 1 1380 . 1 1 110 110 TYR C C 13 172.941 0.300 . 1 . . . . 110 TYR C . 11203 1 1381 . 1 1 110 110 TYR CA C 13 55.888 0.300 . 1 . . . . 110 TYR CA . 11203 1 1382 . 1 1 110 110 TYR CB C 13 43.347 0.300 . 1 . . . . 110 TYR CB . 11203 1 1383 . 1 1 110 110 TYR CD1 C 13 133.750 0.300 . 1 . . . . 110 TYR CD1 . 11203 1 1384 . 1 1 110 110 TYR CD2 C 13 133.750 0.300 . 1 . . . . 110 TYR CD2 . 11203 1 1385 . 1 1 110 110 TYR CE1 C 13 118.341 0.300 . 1 . . . . 110 TYR CE1 . 11203 1 1386 . 1 1 110 110 TYR CE2 C 13 118.341 0.300 . 1 . . . . 110 TYR CE2 . 11203 1 1387 . 1 1 110 110 TYR N N 15 114.589 0.300 . 1 . . . . 110 TYR N . 11203 1 1388 . 1 1 111 111 LEU H H 1 8.537 0.030 . 1 . . . . 111 LEU H . 11203 1 1389 . 1 1 111 111 LEU HA H 1 3.903 0.030 . 1 . . . . 111 LEU HA . 11203 1 1390 . 1 1 111 111 LEU HB2 H 1 1.577 0.030 . 2 . . . . 111 LEU HB2 . 11203 1 1391 . 1 1 111 111 LEU HB3 H 1 -0.182 0.030 . 2 . . . . 111 LEU HB3 . 11203 1 1392 . 1 1 111 111 LEU HD11 H 1 0.454 0.030 . 1 . . . . 111 LEU HD1 . 11203 1 1393 . 1 1 111 111 LEU HD12 H 1 0.454 0.030 . 1 . . . . 111 LEU HD1 . 11203 1 1394 . 1 1 111 111 LEU HD13 H 1 0.454 0.030 . 1 . . . . 111 LEU HD1 . 11203 1 1395 . 1 1 111 111 LEU HD21 H 1 0.597 0.030 . 1 . . . . 111 LEU HD2 . 11203 1 1396 . 1 1 111 111 LEU HD22 H 1 0.597 0.030 . 1 . . . . 111 LEU HD2 . 11203 1 1397 . 1 1 111 111 LEU HD23 H 1 0.597 0.030 . 1 . . . . 111 LEU HD2 . 11203 1 1398 . 1 1 111 111 LEU HG H 1 1.340 0.030 . 1 . . . . 111 LEU HG . 11203 1 1399 . 1 1 111 111 LEU C C 13 177.528 0.300 . 1 . . . . 111 LEU C . 11203 1 1400 . 1 1 111 111 LEU CA C 13 57.155 0.300 . 1 . . . . 111 LEU CA . 11203 1 1401 . 1 1 111 111 LEU CB C 13 41.566 0.300 . 1 . . . . 111 LEU CB . 11203 1 1402 . 1 1 111 111 LEU CD1 C 13 23.568 0.300 . 2 . . . . 111 LEU CD1 . 11203 1 1403 . 1 1 111 111 LEU CD2 C 13 26.033 0.300 . 2 . . . . 111 LEU CD2 . 11203 1 1404 . 1 1 111 111 LEU CG C 13 26.500 0.300 . 1 . . . . 111 LEU CG . 11203 1 1405 . 1 1 111 111 LEU N N 15 119.528 0.300 . 1 . . . . 111 LEU N . 11203 1 1406 . 1 1 112 112 THR H H 1 7.105 0.030 . 1 . . . . 112 THR H . 11203 1 1407 . 1 1 112 112 THR HA H 1 4.918 0.030 . 1 . . . . 112 THR HA . 11203 1 1408 . 1 1 112 112 THR HB H 1 4.366 0.030 . 1 . . . . 112 THR HB . 11203 1 1409 . 1 1 112 112 THR HG21 H 1 1.019 0.030 . 1 . . . . 112 THR HG2 . 11203 1 1410 . 1 1 112 112 THR HG22 H 1 1.019 0.030 . 1 . . . . 112 THR HG2 . 11203 1 1411 . 1 1 112 112 THR HG23 H 1 1.019 0.030 . 1 . . . . 112 THR HG2 . 11203 1 1412 . 1 1 112 112 THR C C 13 174.486 0.300 . 1 . . . . 112 THR C . 11203 1 1413 . 1 1 112 112 THR CA C 13 58.228 0.300 . 1 . . . . 112 THR CA . 11203 1 1414 . 1 1 112 112 THR CB C 13 73.174 0.300 . 1 . . . . 112 THR CB . 11203 1 1415 . 1 1 112 112 THR CG2 C 13 21.929 0.300 . 1 . . . . 112 THR CG2 . 11203 1 1416 . 1 1 112 112 THR N N 15 100.889 0.300 . 1 . . . . 112 THR N . 11203 1 1417 . 1 1 113 113 GLN H H 1 8.561 0.030 . 1 . . . . 113 GLN H . 11203 1 1418 . 1 1 113 113 GLN HA H 1 3.920 0.030 . 1 . . . . 113 GLN HA . 11203 1 1419 . 1 1 113 113 GLN HB2 H 1 1.956 0.030 . 1 . . . . 113 GLN HB2 . 11203 1 1420 . 1 1 113 113 GLN HB3 H 1 1.956 0.030 . 1 . . . . 113 GLN HB3 . 11203 1 1421 . 1 1 113 113 GLN HE21 H 1 7.570 0.030 . 2 . . . . 113 GLN HE21 . 11203 1 1422 . 1 1 113 113 GLN HE22 H 1 6.797 0.030 . 2 . . . . 113 GLN HE22 . 11203 1 1423 . 1 1 113 113 GLN HG2 H 1 2.292 0.030 . 1 . . . . 113 GLN HG2 . 11203 1 1424 . 1 1 113 113 GLN HG3 H 1 2.292 0.030 . 1 . . . . 113 GLN HG3 . 11203 1 1425 . 1 1 113 113 GLN C C 13 177.024 0.300 . 1 . . . . 113 GLN C . 11203 1 1426 . 1 1 113 113 GLN CA C 13 57.570 0.300 . 1 . . . . 113 GLN CA . 11203 1 1427 . 1 1 113 113 GLN CB C 13 29.157 0.300 . 1 . . . . 113 GLN CB . 11203 1 1428 . 1 1 113 113 GLN CG C 13 33.437 0.300 . 1 . . . . 113 GLN CG . 11203 1 1429 . 1 1 113 113 GLN N N 15 118.700 0.300 . 1 . . . . 113 GLN N . 11203 1 1430 . 1 1 113 113 GLN NE2 N 15 111.729 0.300 . 1 . . . . 113 GLN NE2 . 11203 1 1431 . 1 1 114 114 VAL H H 1 7.332 0.030 . 1 . . . . 114 VAL H . 11203 1 1432 . 1 1 114 114 VAL HA H 1 3.811 0.030 . 1 . . . . 114 VAL HA . 11203 1 1433 . 1 1 114 114 VAL HB H 1 1.952 0.030 . 1 . . . . 114 VAL HB . 11203 1 1434 . 1 1 114 114 VAL HG11 H 1 0.947 0.030 . 1 . . . . 114 VAL HG1 . 11203 1 1435 . 1 1 114 114 VAL HG12 H 1 0.947 0.030 . 1 . . . . 114 VAL HG1 . 11203 1 1436 . 1 1 114 114 VAL HG13 H 1 0.947 0.030 . 1 . . . . 114 VAL HG1 . 11203 1 1437 . 1 1 114 114 VAL HG21 H 1 0.908 0.030 . 1 . . . . 114 VAL HG2 . 11203 1 1438 . 1 1 114 114 VAL HG22 H 1 0.908 0.030 . 1 . . . . 114 VAL HG2 . 11203 1 1439 . 1 1 114 114 VAL HG23 H 1 0.908 0.030 . 1 . . . . 114 VAL HG2 . 11203 1 1440 . 1 1 114 114 VAL C C 13 177.341 0.300 . 1 . . . . 114 VAL C . 11203 1 1441 . 1 1 114 114 VAL CA C 13 64.587 0.300 . 1 . . . . 114 VAL CA . 11203 1 1442 . 1 1 114 114 VAL CB C 13 32.347 0.300 . 1 . . . . 114 VAL CB . 11203 1 1443 . 1 1 114 114 VAL CG1 C 13 22.038 0.300 . 2 . . . . 114 VAL CG1 . 11203 1 1444 . 1 1 114 114 VAL CG2 C 13 21.025 0.300 . 2 . . . . 114 VAL CG2 . 11203 1 1445 . 1 1 114 114 VAL N N 15 118.009 0.300 . 1 . . . . 114 VAL N . 11203 1 1446 . 1 1 115 115 GLU H H 1 7.864 0.030 . 1 . . . . 115 GLU H . 11203 1 1447 . 1 1 115 115 GLU HA H 1 4.007 0.030 . 1 . . . . 115 GLU HA . 11203 1 1448 . 1 1 115 115 GLU HB2 H 1 2.125 0.030 . 1 . . . . 115 GLU HB2 . 11203 1 1449 . 1 1 115 115 GLU HB3 H 1 2.125 0.030 . 1 . . . . 115 GLU HB3 . 11203 1 1450 . 1 1 115 115 GLU HG2 H 1 2.423 0.030 . 2 . . . . 115 GLU HG2 . 11203 1 1451 . 1 1 115 115 GLU HG3 H 1 2.321 0.030 . 2 . . . . 115 GLU HG3 . 11203 1 1452 . 1 1 115 115 GLU C C 13 177.534 0.300 . 1 . . . . 115 GLU C . 11203 1 1453 . 1 1 115 115 GLU CA C 13 58.621 0.300 . 1 . . . . 115 GLU CA . 11203 1 1454 . 1 1 115 115 GLU CB C 13 30.512 0.300 . 1 . . . . 115 GLU CB . 11203 1 1455 . 1 1 115 115 GLU CG C 13 36.833 0.300 . 1 . . . . 115 GLU CG . 11203 1 1456 . 1 1 115 115 GLU N N 15 122.380 0.300 . 1 . . . . 115 GLU N . 11203 1 1457 . 1 1 116 116 LYS H H 1 7.289 0.030 . 1 . . . . 116 LYS H . 11203 1 1458 . 1 1 116 116 LYS HA H 1 2.863 0.030 . 1 . . . . 116 LYS HA . 11203 1 1459 . 1 1 116 116 LYS HB2 H 1 1.756 0.030 . 2 . . . . 116 LYS HB2 . 11203 1 1460 . 1 1 116 116 LYS HB3 H 1 1.331 0.030 . 2 . . . . 116 LYS HB3 . 11203 1 1461 . 1 1 116 116 LYS HD2 H 1 1.680 0.030 . 2 . . . . 116 LYS HD2 . 11203 1 1462 . 1 1 116 116 LYS HD3 H 1 1.599 0.030 . 2 . . . . 116 LYS HD3 . 11203 1 1463 . 1 1 116 116 LYS HE2 H 1 3.048 0.030 . 2 . . . . 116 LYS HE2 . 11203 1 1464 . 1 1 116 116 LYS HE3 H 1 2.993 0.030 . 2 . . . . 116 LYS HE3 . 11203 1 1465 . 1 1 116 116 LYS HG2 H 1 1.215 0.030 . 2 . . . . 116 LYS HG2 . 11203 1 1466 . 1 1 116 116 LYS HG3 H 1 1.104 0.030 . 2 . . . . 116 LYS HG3 . 11203 1 1467 . 1 1 116 116 LYS C C 13 177.194 0.300 . 1 . . . . 116 LYS C . 11203 1 1468 . 1 1 116 116 LYS CA C 13 58.388 0.300 . 1 . . . . 116 LYS CA . 11203 1 1469 . 1 1 116 116 LYS CB C 13 32.931 0.300 . 1 . . . . 116 LYS CB . 11203 1 1470 . 1 1 116 116 LYS CD C 13 29.988 0.300 . 1 . . . . 116 LYS CD . 11203 1 1471 . 1 1 116 116 LYS CE C 13 42.324 0.300 . 1 . . . . 116 LYS CE . 11203 1 1472 . 1 1 116 116 LYS CG C 13 24.384 0.300 . 1 . . . . 116 LYS CG . 11203 1 1473 . 1 1 116 116 LYS N N 15 119.755 0.300 . 1 . . . . 116 LYS N . 11203 1 1474 . 1 1 117 117 GLU H H 1 7.999 0.030 . 1 . . . . 117 GLU H . 11203 1 1475 . 1 1 117 117 GLU HA H 1 4.005 0.030 . 1 . . . . 117 GLU HA . 11203 1 1476 . 1 1 117 117 GLU HB2 H 1 2.000 0.030 . 1 . . . . 117 GLU HB2 . 11203 1 1477 . 1 1 117 117 GLU HB3 H 1 2.000 0.030 . 1 . . . . 117 GLU HB3 . 11203 1 1478 . 1 1 117 117 GLU HG2 H 1 2.380 0.030 . 2 . . . . 117 GLU HG2 . 11203 1 1479 . 1 1 117 117 GLU HG3 H 1 2.214 0.030 . 2 . . . . 117 GLU HG3 . 11203 1 1480 . 1 1 117 117 GLU C C 13 178.273 0.300 . 1 . . . . 117 GLU C . 11203 1 1481 . 1 1 117 117 GLU CA C 13 58.228 0.300 . 1 . . . . 117 GLU CA . 11203 1 1482 . 1 1 117 117 GLU CB C 13 29.715 0.300 . 1 . . . . 117 GLU CB . 11203 1 1483 . 1 1 117 117 GLU CG C 13 36.638 0.300 . 1 . . . . 117 GLU CG . 11203 1 1484 . 1 1 117 117 GLU N N 15 117.822 0.300 . 1 . . . . 117 GLU N . 11203 1 1485 . 1 1 118 118 CYS H H 1 8.109 0.030 . 1 . . . . 118 CYS H . 11203 1 1486 . 1 1 118 118 CYS HA H 1 4.263 0.030 . 1 . . . . 118 CYS HA . 11203 1 1487 . 1 1 118 118 CYS HB2 H 1 2.997 0.030 . 2 . . . . 118 CYS HB2 . 11203 1 1488 . 1 1 118 118 CYS HB3 H 1 2.945 0.030 . 2 . . . . 118 CYS HB3 . 11203 1 1489 . 1 1 118 118 CYS C C 13 176.353 0.300 . 1 . . . . 118 CYS C . 11203 1 1490 . 1 1 118 118 CYS CA C 13 61.211 0.300 . 1 . . . . 118 CYS CA . 11203 1 1491 . 1 1 118 118 CYS CB C 13 27.239 0.300 . 1 . . . . 118 CYS CB . 11203 1 1492 . 1 1 118 118 CYS N N 15 117.914 0.300 . 1 . . . . 118 CYS N . 11203 1 1493 . 1 1 119 119 LYS H H 1 8.086 0.030 . 1 . . . . 119 LYS H . 11203 1 1494 . 1 1 119 119 LYS HA H 1 4.255 0.030 . 1 . . . . 119 LYS HA . 11203 1 1495 . 1 1 119 119 LYS HB2 H 1 1.959 0.030 . 2 . . . . 119 LYS HB2 . 11203 1 1496 . 1 1 119 119 LYS HB3 H 1 1.848 0.030 . 2 . . . . 119 LYS HB3 . 11203 1 1497 . 1 1 119 119 LYS HD2 H 1 1.821 0.030 . 1 . . . . 119 LYS HD2 . 11203 1 1498 . 1 1 119 119 LYS HE2 H 1 3.102 0.030 . 2 . . . . 119 LYS HE2 . 11203 1 1499 . 1 1 119 119 LYS HG2 H 1 1.588 0.030 . 1 . . . . 119 LYS HG2 . 11203 1 1500 . 1 1 119 119 LYS HG3 H 1 1.588 0.030 . 1 . . . . 119 LYS HG3 . 11203 1 1501 . 1 1 119 119 LYS C C 13 177.995 0.300 . 1 . . . . 119 LYS C . 11203 1 1502 . 1 1 119 119 LYS CA C 13 57.582 0.300 . 1 . . . . 119 LYS CA . 11203 1 1503 . 1 1 119 119 LYS CB C 13 32.676 0.300 . 1 . . . . 119 LYS CB . 11203 1 1504 . 1 1 119 119 LYS CD C 13 29.121 0.300 . 1 . . . . 119 LYS CD . 11203 1 1505 . 1 1 119 119 LYS CE C 13 42.474 0.300 . 1 . . . . 119 LYS CE . 11203 1 1506 . 1 1 119 119 LYS CG C 13 25.399 0.300 . 1 . . . . 119 LYS CG . 11203 1 1507 . 1 1 119 119 LYS N N 15 120.904 0.300 . 1 . . . . 119 LYS N . 11203 1 1508 . 1 1 120 120 GLU H H 1 8.214 0.030 . 1 . . . . 120 GLU H . 11203 1 1509 . 1 1 120 120 GLU HA H 1 4.249 0.030 . 1 . . . . 120 GLU HA . 11203 1 1510 . 1 1 120 120 GLU HB2 H 1 2.055 0.030 . 2 . . . . 120 GLU HB2 . 11203 1 1511 . 1 1 120 120 GLU HB3 H 1 1.964 0.030 . 2 . . . . 120 GLU HB3 . 11203 1 1512 . 1 1 120 120 GLU HG2 H 1 2.436 0.030 . 2 . . . . 120 GLU HG2 . 11203 1 1513 . 1 1 120 120 GLU HG3 H 1 2.262 0.030 . 2 . . . . 120 GLU HG3 . 11203 1 1514 . 1 1 120 120 GLU C C 13 176.902 0.300 . 1 . . . . 120 GLU C . 11203 1 1515 . 1 1 120 120 GLU CA C 13 57.294 0.300 . 1 . . . . 120 GLU CA . 11203 1 1516 . 1 1 120 120 GLU CB C 13 29.745 0.300 . 1 . . . . 120 GLU CB . 11203 1 1517 . 1 1 120 120 GLU CG C 13 36.638 0.300 . 1 . . . . 120 GLU CG . 11203 1 1518 . 1 1 120 120 GLU N N 15 119.387 0.300 . 1 . . . . 120 GLU N . 11203 1 1519 . 1 1 121 121 LYS H H 1 7.956 0.030 . 1 . . . . 121 LYS H . 11203 1 1520 . 1 1 121 121 LYS HA H 1 4.343 0.030 . 1 . . . . 121 LYS HA . 11203 1 1521 . 1 1 121 121 LYS HB2 H 1 1.905 0.030 . 2 . . . . 121 LYS HB2 . 11203 1 1522 . 1 1 121 121 LYS HB3 H 1 1.859 0.030 . 2 . . . . 121 LYS HB3 . 11203 1 1523 . 1 1 121 121 LYS HD2 H 1 1.692 0.030 . 2 . . . . 121 LYS HD2 . 11203 1 1524 . 1 1 121 121 LYS HD3 H 1 1.953 0.030 . 2 . . . . 121 LYS HD3 . 11203 1 1525 . 1 1 121 121 LYS HE2 H 1 3.019 0.030 . 1 . . . . 121 LYS HE2 . 11203 1 1526 . 1 1 121 121 LYS HE3 H 1 3.019 0.030 . 1 . . . . 121 LYS HE3 . 11203 1 1527 . 1 1 121 121 LYS HG2 H 1 1.494 0.030 . 2 . . . . 121 LYS HG2 . 11203 1 1528 . 1 1 121 121 LYS HG3 H 1 1.465 0.030 . 2 . . . . 121 LYS HG3 . 11203 1 1529 . 1 1 121 121 LYS C C 13 176.715 0.300 . 1 . . . . 121 LYS C . 11203 1 1530 . 1 1 121 121 LYS CA C 13 56.703 0.300 . 1 . . . . 121 LYS CA . 11203 1 1531 . 1 1 121 121 LYS CB C 13 32.697 0.300 . 1 . . . . 121 LYS CB . 11203 1 1532 . 1 1 121 121 LYS CD C 13 29.236 0.300 . 1 . . . . 121 LYS CD . 11203 1 1533 . 1 1 121 121 LYS CE C 13 42.247 0.300 . 1 . . . . 121 LYS CE . 11203 1 1534 . 1 1 121 121 LYS CG C 13 24.880 0.300 . 1 . . . . 121 LYS CG . 11203 1 1535 . 1 1 121 121 LYS N N 15 120.558 0.300 . 1 . . . . 121 LYS N . 11203 1 1536 . 1 1 122 122 SER H H 1 8.179 0.030 . 1 . . . . 122 SER H . 11203 1 1537 . 1 1 122 122 SER HA H 1 4.518 0.030 . 1 . . . . 122 SER HA . 11203 1 1538 . 1 1 122 122 SER HB2 H 1 3.922 0.030 . 1 . . . . 122 SER HB2 . 11203 1 1539 . 1 1 122 122 SER HB3 H 1 3.922 0.030 . 1 . . . . 122 SER HB3 . 11203 1 1540 . 1 1 122 122 SER C C 13 174.639 0.300 . 1 . . . . 122 SER C . 11203 1 1541 . 1 1 122 122 SER CA C 13 58.577 0.300 . 1 . . . . 122 SER CA . 11203 1 1542 . 1 1 122 122 SER CB C 13 64.124 0.300 . 1 . . . . 122 SER CB . 11203 1 1543 . 1 1 122 122 SER N N 15 116.193 0.300 . 1 . . . . 122 SER N . 11203 1 1544 . 1 1 123 123 GLY H H 1 8.215 0.030 . 1 . . . . 123 GLY H . 11203 1 1545 . 1 1 123 123 GLY HA2 H 1 4.183 0.030 . 2 . . . . 123 GLY HA2 . 11203 1 1546 . 1 1 123 123 GLY HA3 H 1 4.119 0.030 . 2 . . . . 123 GLY HA3 . 11203 1 1547 . 1 1 123 123 GLY C C 13 171.807 0.300 . 1 . . . . 123 GLY C . 11203 1 1548 . 1 1 123 123 GLY CA C 13 44.765 0.300 . 1 . . . . 123 GLY CA . 11203 1 1549 . 1 1 123 123 GLY N N 15 110.570 0.300 . 1 . . . . 123 GLY N . 11203 1 1550 . 1 1 124 124 PRO HA H 1 4.488 0.030 . 1 . . . . 124 PRO HA . 11203 1 1551 . 1 1 124 124 PRO HB2 H 1 2.302 0.030 . 2 . . . . 124 PRO HB2 . 11203 1 1552 . 1 1 124 124 PRO HB3 H 1 1.987 0.030 . 2 . . . . 124 PRO HB3 . 11203 1 1553 . 1 1 124 124 PRO HD2 H 1 3.646 0.030 . 1 . . . . 124 PRO HD2 . 11203 1 1554 . 1 1 124 124 PRO HD3 H 1 3.646 0.030 . 1 . . . . 124 PRO HD3 . 11203 1 1555 . 1 1 124 124 PRO HG2 H 1 2.028 0.030 . 1 . . . . 124 PRO HG2 . 11203 1 1556 . 1 1 124 124 PRO HG3 H 1 2.028 0.030 . 1 . . . . 124 PRO HG3 . 11203 1 1557 . 1 1 124 124 PRO C C 13 177.451 0.300 . 1 . . . . 124 PRO C . 11203 1 1558 . 1 1 124 124 PRO CA C 13 63.320 0.300 . 1 . . . . 124 PRO CA . 11203 1 1559 . 1 1 124 124 PRO CB C 13 32.228 0.300 . 1 . . . . 124 PRO CB . 11203 1 1560 . 1 1 124 124 PRO CD C 13 49.850 0.300 . 1 . . . . 124 PRO CD . 11203 1 1561 . 1 1 124 124 PRO CG C 13 27.172 0.300 . 1 . . . . 124 PRO CG . 11203 1 1562 . 1 1 125 125 SER H H 1 8.532 0.030 . 1 . . . . 125 SER H . 11203 1 1563 . 1 1 125 125 SER HA H 1 4.517 0.030 . 1 . . . . 125 SER HA . 11203 1 1564 . 1 1 125 125 SER HB2 H 1 3.915 0.030 . 1 . . . . 125 SER HB2 . 11203 1 1565 . 1 1 125 125 SER HB3 H 1 3.915 0.030 . 1 . . . . 125 SER HB3 . 11203 1 1566 . 1 1 125 125 SER C C 13 174.717 0.300 . 1 . . . . 125 SER C . 11203 1 1567 . 1 1 125 125 SER CA C 13 58.420 0.300 . 1 . . . . 125 SER CA . 11203 1 1568 . 1 1 125 125 SER CB C 13 63.894 0.300 . 1 . . . . 125 SER CB . 11203 1 1569 . 1 1 125 125 SER N N 15 116.361 0.300 . 1 . . . . 125 SER N . 11203 1 1570 . 1 1 126 126 SER HA H 1 4.513 0.030 . 1 . . . . 126 SER HA . 11203 1 1571 . 1 1 126 126 SER HB2 H 1 3.925 0.030 . 1 . . . . 126 SER HB2 . 11203 1 1572 . 1 1 126 126 SER HB3 H 1 3.925 0.030 . 1 . . . . 126 SER HB3 . 11203 1 1573 . 1 1 126 126 SER C C 13 173.955 0.300 . 1 . . . . 126 SER C . 11203 1 1574 . 1 1 126 126 SER CA C 13 58.424 0.300 . 1 . . . . 126 SER CA . 11203 1 1575 . 1 1 126 126 SER CB C 13 64.139 0.300 . 1 . . . . 126 SER CB . 11203 1 1576 . 1 1 127 127 GLY H H 1 8.060 0.030 . 1 . . . . 127 GLY H . 11203 1 1577 . 1 1 127 127 GLY HA2 H 1 3.797 0.030 . 2 . . . . 127 GLY HA2 . 11203 1 1578 . 1 1 127 127 GLY HA3 H 1 3.758 0.030 . 2 . . . . 127 GLY HA3 . 11203 1 1579 . 1 1 127 127 GLY C C 13 179.044 0.300 . 1 . . . . 127 GLY C . 11203 1 1580 . 1 1 127 127 GLY CA C 13 46.258 0.300 . 1 . . . . 127 GLY CA . 11203 1 1581 . 1 1 127 127 GLY N N 15 116.898 0.300 . 1 . . . . 127 GLY N . 11203 1 stop_ save_