data_10032 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10032 _Entry.Title ; Solution structure of the first mbt domain from human KIAA1798 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-11-01 _Entry.Accession_date 2006-11-01 _Entry.Last_release_date 2008-08-13 _Entry.Original_release_date 2008-08-13 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 T. Tomizawa . . . 10032 2 T. Kigawa . . . 10032 3 S. Koshiba . . . 10032 4 M. Inoue . . . 10032 5 S. Yokoyama . . . 10032 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10032 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10032 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 541 10032 '15N chemical shifts' 119 10032 '1H chemical shifts' 814 10032 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 . . 2008-08-13 2006-11-01 original author . 10032 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WJS 'BMRB Entry Tracking System' 10032 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10032 _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 first mbt domain from human KIAA1798 protein' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 T. Tomizawa . . . 10032 1 2 T. Kigawa . . . 10032 1 3 S. Koshiba . . . 10032 1 4 M. Inoue . . . 10032 1 5 S. Yokoyama . . . 10032 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10032 _Assembly.ID 1 _Assembly.Name 'KIAA1798 protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10032 1 stop_ 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 'KIAA1798 protein' 1 $entity_1 . . yes native no no . . . 10032 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 1WJS . . . . . . 10032 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10032 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'mbt domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGPYNKNGFKVGMKL EGVDPEHQSVYCVLTVAEVC GYRIKLHFDGYSDCYDFWVN ADALDIHPVGWCEKTGHKLH PPKGYKEEEFNWQTYLKTCK AQAAPKSLFENQNITVIPSG FSGPSSG ; _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 1 _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 1WJS . "Solution Structure Of The First Mbt Domain From Human Kiaa1798 Protein" . . . . . 100.00 127 100.00 100.00 6.40e-89 . . . . 10032 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'mbt domain' . 10032 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 . 10032 1 2 . SER . 10032 1 3 . SER . 10032 1 4 . GLY . 10032 1 5 . SER . 10032 1 6 . SER . 10032 1 7 . GLY . 10032 1 8 . PRO . 10032 1 9 . TYR . 10032 1 10 . ASN . 10032 1 11 . LYS . 10032 1 12 . ASN . 10032 1 13 . GLY . 10032 1 14 . PHE . 10032 1 15 . LYS . 10032 1 16 . VAL . 10032 1 17 . GLY . 10032 1 18 . MET . 10032 1 19 . LYS . 10032 1 20 . LEU . 10032 1 21 . GLU . 10032 1 22 . GLY . 10032 1 23 . VAL . 10032 1 24 . ASP . 10032 1 25 . PRO . 10032 1 26 . GLU . 10032 1 27 . HIS . 10032 1 28 . GLN . 10032 1 29 . SER . 10032 1 30 . VAL . 10032 1 31 . TYR . 10032 1 32 . CYS . 10032 1 33 . VAL . 10032 1 34 . LEU . 10032 1 35 . THR . 10032 1 36 . VAL . 10032 1 37 . ALA . 10032 1 38 . GLU . 10032 1 39 . VAL . 10032 1 40 . CYS . 10032 1 41 . GLY . 10032 1 42 . TYR . 10032 1 43 . ARG . 10032 1 44 . ILE . 10032 1 45 . LYS . 10032 1 46 . LEU . 10032 1 47 . HIS . 10032 1 48 . PHE . 10032 1 49 . ASP . 10032 1 50 . GLY . 10032 1 51 . TYR . 10032 1 52 . SER . 10032 1 53 . ASP . 10032 1 54 . CYS . 10032 1 55 . TYR . 10032 1 56 . ASP . 10032 1 57 . PHE . 10032 1 58 . TRP . 10032 1 59 . VAL . 10032 1 60 . ASN . 10032 1 61 . ALA . 10032 1 62 . ASP . 10032 1 63 . ALA . 10032 1 64 . LEU . 10032 1 65 . ASP . 10032 1 66 . ILE . 10032 1 67 . HIS . 10032 1 68 . PRO . 10032 1 69 . VAL . 10032 1 70 . GLY . 10032 1 71 . TRP . 10032 1 72 . CYS . 10032 1 73 . GLU . 10032 1 74 . LYS . 10032 1 75 . THR . 10032 1 76 . GLY . 10032 1 77 . HIS . 10032 1 78 . LYS . 10032 1 79 . LEU . 10032 1 80 . HIS . 10032 1 81 . PRO . 10032 1 82 . PRO . 10032 1 83 . LYS . 10032 1 84 . GLY . 10032 1 85 . TYR . 10032 1 86 . LYS . 10032 1 87 . GLU . 10032 1 88 . GLU . 10032 1 89 . GLU . 10032 1 90 . PHE . 10032 1 91 . ASN . 10032 1 92 . TRP . 10032 1 93 . GLN . 10032 1 94 . THR . 10032 1 95 . TYR . 10032 1 96 . LEU . 10032 1 97 . LYS . 10032 1 98 . THR . 10032 1 99 . CYS . 10032 1 100 . LYS . 10032 1 101 . ALA . 10032 1 102 . GLN . 10032 1 103 . ALA . 10032 1 104 . ALA . 10032 1 105 . PRO . 10032 1 106 . LYS . 10032 1 107 . SER . 10032 1 108 . LEU . 10032 1 109 . PHE . 10032 1 110 . GLU . 10032 1 111 . ASN . 10032 1 112 . GLN . 10032 1 113 . ASN . 10032 1 114 . ILE . 10032 1 115 . THR . 10032 1 116 . VAL . 10032 1 117 . ILE . 10032 1 118 . PRO . 10032 1 119 . SER . 10032 1 120 . GLY . 10032 1 121 . PHE . 10032 1 122 . SER . 10032 1 123 . GLY . 10032 1 124 . PRO . 10032 1 125 . SER . 10032 1 126 . SER . 10032 1 127 . GLY . 10032 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 10032 1 . SER 2 2 10032 1 . SER 3 3 10032 1 . GLY 4 4 10032 1 . SER 5 5 10032 1 . SER 6 6 10032 1 . GLY 7 7 10032 1 . PRO 8 8 10032 1 . TYR 9 9 10032 1 . ASN 10 10 10032 1 . LYS 11 11 10032 1 . ASN 12 12 10032 1 . GLY 13 13 10032 1 . PHE 14 14 10032 1 . LYS 15 15 10032 1 . VAL 16 16 10032 1 . GLY 17 17 10032 1 . MET 18 18 10032 1 . LYS 19 19 10032 1 . LEU 20 20 10032 1 . GLU 21 21 10032 1 . GLY 22 22 10032 1 . VAL 23 23 10032 1 . ASP 24 24 10032 1 . PRO 25 25 10032 1 . GLU 26 26 10032 1 . HIS 27 27 10032 1 . GLN 28 28 10032 1 . SER 29 29 10032 1 . VAL 30 30 10032 1 . TYR 31 31 10032 1 . CYS 32 32 10032 1 . VAL 33 33 10032 1 . LEU 34 34 10032 1 . THR 35 35 10032 1 . VAL 36 36 10032 1 . ALA 37 37 10032 1 . GLU 38 38 10032 1 . VAL 39 39 10032 1 . CYS 40 40 10032 1 . GLY 41 41 10032 1 . TYR 42 42 10032 1 . ARG 43 43 10032 1 . ILE 44 44 10032 1 . LYS 45 45 10032 1 . LEU 46 46 10032 1 . HIS 47 47 10032 1 . PHE 48 48 10032 1 . ASP 49 49 10032 1 . GLY 50 50 10032 1 . TYR 51 51 10032 1 . SER 52 52 10032 1 . ASP 53 53 10032 1 . CYS 54 54 10032 1 . TYR 55 55 10032 1 . ASP 56 56 10032 1 . PHE 57 57 10032 1 . TRP 58 58 10032 1 . VAL 59 59 10032 1 . ASN 60 60 10032 1 . ALA 61 61 10032 1 . ASP 62 62 10032 1 . ALA 63 63 10032 1 . LEU 64 64 10032 1 . ASP 65 65 10032 1 . ILE 66 66 10032 1 . HIS 67 67 10032 1 . PRO 68 68 10032 1 . VAL 69 69 10032 1 . GLY 70 70 10032 1 . TRP 71 71 10032 1 . CYS 72 72 10032 1 . GLU 73 73 10032 1 . LYS 74 74 10032 1 . THR 75 75 10032 1 . GLY 76 76 10032 1 . HIS 77 77 10032 1 . LYS 78 78 10032 1 . LEU 79 79 10032 1 . HIS 80 80 10032 1 . PRO 81 81 10032 1 . PRO 82 82 10032 1 . LYS 83 83 10032 1 . GLY 84 84 10032 1 . TYR 85 85 10032 1 . LYS 86 86 10032 1 . GLU 87 87 10032 1 . GLU 88 88 10032 1 . GLU 89 89 10032 1 . PHE 90 90 10032 1 . ASN 91 91 10032 1 . TRP 92 92 10032 1 . GLN 93 93 10032 1 . THR 94 94 10032 1 . TYR 95 95 10032 1 . LEU 96 96 10032 1 . LYS 97 97 10032 1 . THR 98 98 10032 1 . CYS 99 99 10032 1 . LYS 100 100 10032 1 . ALA 101 101 10032 1 . GLN 102 102 10032 1 . ALA 103 103 10032 1 . ALA 104 104 10032 1 . PRO 105 105 10032 1 . LYS 106 106 10032 1 . SER 107 107 10032 1 . LEU 108 108 10032 1 . PHE 109 109 10032 1 . GLU 110 110 10032 1 . ASN 111 111 10032 1 . GLN 112 112 10032 1 . ASN 113 113 10032 1 . ILE 114 114 10032 1 . THR 115 115 10032 1 . VAL 116 116 10032 1 . ILE 117 117 10032 1 . PRO 118 118 10032 1 . SER 119 119 10032 1 . GLY 120 120 10032 1 . PHE 121 121 10032 1 . SER 122 122 10032 1 . GLY 123 123 10032 1 . PRO 124 124 10032 1 . SER 125 125 10032 1 . SER 126 126 10032 1 . GLY 127 127 10032 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 10032 _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 . . . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10032 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 10032 _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' . . . . . . . . . . . . . . . . . . . plasmid . . P040119-27 . . . . . . 10032 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10032 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'mbt domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.03 . . mM . . . . 10032 1 2 d-Tris-HCl . . . . . . buffer 20 . . mM . . . . 10032 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10032 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10032 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10032 1 6 H2O . . . . . . solvent 90 . . % . . . . 10032 1 7 D2O . . . . . . solvent 10 . . % . . . . 10032 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 10032 _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 10032 1 pH 7.0 0.05 pH 10032 1 pressure 1 0.001 atm 10032 1 temperature 296 0.1 K 10032 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10032 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10032 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10032 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10032 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10032 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10032 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10032 _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.' . . 10032 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10032 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10032 _Software.ID 4 _Software.Name Kujira _Software.Version 0.901 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10032 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10032 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10032 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10032 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10032 5 'structure solution' 10032 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 10032 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10032 _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 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10032 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10032 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10032 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10032 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . 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 10032 _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 . . . . . . . . . 10032 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10032 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10032 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 10032 _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 13C-separated NOESY' 1 $sample_1 isotropic 10032 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10032 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 7 7 GLY HA2 H 1 4.087 0.030 . 2 . . . . 7 GLY HA2 . 10032 1 2 . 1 1 7 7 GLY CA C 13 44.846 0.300 . 1 . . . . 7 GLY CA . 10032 1 3 . 1 1 8 8 PRO HA H 1 4.349 0.030 . 1 . . . . 8 PRO HA . 10032 1 4 . 1 1 8 8 PRO HB2 H 1 2.097 0.030 . 2 . . . . 8 PRO HB2 . 10032 1 5 . 1 1 8 8 PRO HB3 H 1 1.718 0.030 . 2 . . . . 8 PRO HB3 . 10032 1 6 . 1 1 8 8 PRO HG2 H 1 1.724 0.030 . 2 . . . . 8 PRO HG2 . 10032 1 7 . 1 1 8 8 PRO HG3 H 1 1.850 0.030 . 2 . . . . 8 PRO HG3 . 10032 1 8 . 1 1 8 8 PRO HD2 H 1 3.501 0.030 . 1 . . . . 8 PRO HD2 . 10032 1 9 . 1 1 8 8 PRO HD3 H 1 3.501 0.030 . 1 . . . . 8 PRO HD3 . 10032 1 10 . 1 1 8 8 PRO C C 13 176.706 0.300 . 1 . . . . 8 PRO C . 10032 1 11 . 1 1 8 8 PRO CA C 13 63.357 0.300 . 1 . . . . 8 PRO CA . 10032 1 12 . 1 1 8 8 PRO CB C 13 31.931 0.300 . 1 . . . . 8 PRO CB . 10032 1 13 . 1 1 8 8 PRO CG C 13 26.888 0.300 . 1 . . . . 8 PRO CG . 10032 1 14 . 1 1 8 8 PRO CD C 13 49.701 0.300 . 1 . . . . 8 PRO CD . 10032 1 15 . 1 1 9 9 TYR H H 1 8.100 0.030 . 1 . . . . 9 TYR H . 10032 1 16 . 1 1 9 9 TYR HA H 1 4.522 0.030 . 1 . . . . 9 TYR HA . 10032 1 17 . 1 1 9 9 TYR HB2 H 1 2.921 0.030 . 2 . . . . 9 TYR HB2 . 10032 1 18 . 1 1 9 9 TYR HB3 H 1 3.006 0.030 . 2 . . . . 9 TYR HB3 . 10032 1 19 . 1 1 9 9 TYR HD1 H 1 7.068 0.030 . 1 . . . . 9 TYR HD1 . 10032 1 20 . 1 1 9 9 TYR HD2 H 1 7.068 0.030 . 1 . . . . 9 TYR HD2 . 10032 1 21 . 1 1 9 9 TYR HE1 H 1 6.806 0.030 . 1 . . . . 9 TYR HE1 . 10032 1 22 . 1 1 9 9 TYR HE2 H 1 6.806 0.030 . 1 . . . . 9 TYR HE2 . 10032 1 23 . 1 1 9 9 TYR C C 13 175.377 0.300 . 1 . . . . 9 TYR C . 10032 1 24 . 1 1 9 9 TYR CA C 13 57.621 0.300 . 1 . . . . 9 TYR CA . 10032 1 25 . 1 1 9 9 TYR CB C 13 38.511 0.300 . 1 . . . . 9 TYR CB . 10032 1 26 . 1 1 9 9 TYR CD1 C 13 133.117 0.300 . 1 . . . . 9 TYR CD1 . 10032 1 27 . 1 1 9 9 TYR CD2 C 13 133.117 0.300 . 1 . . . . 9 TYR CD2 . 10032 1 28 . 1 1 9 9 TYR CE1 C 13 118.282 0.300 . 1 . . . . 9 TYR CE1 . 10032 1 29 . 1 1 9 9 TYR CE2 C 13 118.282 0.300 . 1 . . . . 9 TYR CE2 . 10032 1 30 . 1 1 9 9 TYR N N 15 119.841 0.300 . 1 . . . . 9 TYR N . 10032 1 31 . 1 1 10 10 ASN HA H 1 4.571 0.030 . 1 . . . . 10 ASN HA . 10032 1 32 . 1 1 10 10 ASN HB2 H 1 2.656 0.030 . 2 . . . . 10 ASN HB2 . 10032 1 33 . 1 1 10 10 ASN HB3 H 1 2.585 0.030 . 2 . . . . 10 ASN HB3 . 10032 1 34 . 1 1 10 10 ASN HD21 H 1 7.440 0.030 . 2 . . . . 10 ASN HD21 . 10032 1 35 . 1 1 10 10 ASN HD22 H 1 6.836 0.030 . 2 . . . . 10 ASN HD22 . 10032 1 36 . 1 1 10 10 ASN CA C 13 53.057 0.300 . 1 . . . . 10 ASN CA . 10032 1 37 . 1 1 10 10 ASN CB C 13 38.837 0.300 . 1 . . . . 10 ASN CB . 10032 1 38 . 1 1 10 10 ASN ND2 N 15 112.189 0.300 . 1 . . . . 10 ASN ND2 . 10032 1 39 . 1 1 11 11 LYS HA H 1 5.301 0.030 . 1 . . . . 11 LYS HA . 10032 1 40 . 1 1 12 12 ASN H H 1 7.790 0.030 . 1 . . . . 12 ASN H . 10032 1 41 . 1 1 12 12 ASN HA H 1 4.763 0.030 . 1 . . . . 12 ASN HA . 10032 1 42 . 1 1 12 12 ASN HB2 H 1 3.139 0.030 . 2 . . . . 12 ASN HB2 . 10032 1 43 . 1 1 12 12 ASN HB3 H 1 2.709 0.030 . 2 . . . . 12 ASN HB3 . 10032 1 44 . 1 1 12 12 ASN C C 13 175.606 0.300 . 1 . . . . 12 ASN C . 10032 1 45 . 1 1 12 12 ASN CA C 13 52.224 0.300 . 1 . . . . 12 ASN CA . 10032 1 46 . 1 1 12 12 ASN CB C 13 38.654 0.300 . 1 . . . . 12 ASN CB . 10032 1 47 . 1 1 12 12 ASN N N 15 106.771 0.300 . 1 . . . . 12 ASN N . 10032 1 48 . 1 1 13 13 GLY H H 1 8.766 0.030 . 1 . . . . 13 GLY H . 10032 1 49 . 1 1 13 13 GLY HA2 H 1 4.186 0.030 . 2 . . . . 13 GLY HA2 . 10032 1 50 . 1 1 13 13 GLY HA3 H 1 3.471 0.030 . 2 . . . . 13 GLY HA3 . 10032 1 51 . 1 1 13 13 GLY C C 13 174.299 0.300 . 1 . . . . 13 GLY C . 10032 1 52 . 1 1 13 13 GLY CA C 13 45.091 0.300 . 1 . . . . 13 GLY CA . 10032 1 53 . 1 1 13 13 GLY N N 15 112.488 0.300 . 1 . . . . 13 GLY N . 10032 1 54 . 1 1 14 14 PHE H H 1 8.122 0.030 . 1 . . . . 14 PHE H . 10032 1 55 . 1 1 14 14 PHE HA H 1 4.072 0.030 . 1 . . . . 14 PHE HA . 10032 1 56 . 1 1 14 14 PHE HB2 H 1 3.058 0.030 . 2 . . . . 14 PHE HB2 . 10032 1 57 . 1 1 14 14 PHE HB3 H 1 2.616 0.030 . 2 . . . . 14 PHE HB3 . 10032 1 58 . 1 1 14 14 PHE HD1 H 1 7.196 0.030 . 1 . . . . 14 PHE HD1 . 10032 1 59 . 1 1 14 14 PHE HD2 H 1 7.196 0.030 . 1 . . . . 14 PHE HD2 . 10032 1 60 . 1 1 14 14 PHE HE1 H 1 7.006 0.030 . 1 . . . . 14 PHE HE1 . 10032 1 61 . 1 1 14 14 PHE HE2 H 1 7.006 0.030 . 1 . . . . 14 PHE HE2 . 10032 1 62 . 1 1 14 14 PHE HZ H 1 6.139 0.030 . 1 . . . . 14 PHE HZ . 10032 1 63 . 1 1 14 14 PHE C C 13 174.570 0.300 . 1 . . . . 14 PHE C . 10032 1 64 . 1 1 14 14 PHE CA C 13 60.376 0.300 . 1 . . . . 14 PHE CA . 10032 1 65 . 1 1 14 14 PHE CB C 13 40.200 0.300 . 1 . . . . 14 PHE CB . 10032 1 66 . 1 1 14 14 PHE CD1 C 13 131.594 0.300 . 1 . . . . 14 PHE CD1 . 10032 1 67 . 1 1 14 14 PHE CD2 C 13 131.594 0.300 . 1 . . . . 14 PHE CD2 . 10032 1 68 . 1 1 14 14 PHE CE1 C 13 131.274 0.300 . 1 . . . . 14 PHE CE1 . 10032 1 69 . 1 1 14 14 PHE CE2 C 13 131.274 0.300 . 1 . . . . 14 PHE CE2 . 10032 1 70 . 1 1 14 14 PHE CZ C 13 130.201 0.300 . 1 . . . . 14 PHE CZ . 10032 1 71 . 1 1 14 14 PHE N N 15 118.885 0.300 . 1 . . . . 14 PHE N . 10032 1 72 . 1 1 15 15 LYS H H 1 8.032 0.030 . 1 . . . . 15 LYS H . 10032 1 73 . 1 1 15 15 LYS HA H 1 4.745 0.030 . 1 . . . . 15 LYS HA . 10032 1 74 . 1 1 15 15 LYS HB2 H 1 1.921 0.030 . 2 . . . . 15 LYS HB2 . 10032 1 75 . 1 1 15 15 LYS HB3 H 1 1.570 0.030 . 2 . . . . 15 LYS HB3 . 10032 1 76 . 1 1 15 15 LYS HG2 H 1 1.500 0.030 . 2 . . . . 15 LYS HG2 . 10032 1 77 . 1 1 15 15 LYS HG3 H 1 1.416 0.030 . 2 . . . . 15 LYS HG3 . 10032 1 78 . 1 1 15 15 LYS HD2 H 1 1.760 0.030 . 2 . . . . 15 LYS HD2 . 10032 1 79 . 1 1 15 15 LYS HD3 H 1 1.656 0.030 . 2 . . . . 15 LYS HD3 . 10032 1 80 . 1 1 15 15 LYS HE2 H 1 2.926 0.030 . 2 . . . . 15 LYS HE2 . 10032 1 81 . 1 1 15 15 LYS HE3 H 1 2.989 0.030 . 2 . . . . 15 LYS HE3 . 10032 1 82 . 1 1 15 15 LYS C C 13 175.931 0.300 . 1 . . . . 15 LYS C . 10032 1 83 . 1 1 15 15 LYS CA C 13 53.240 0.300 . 1 . . . . 15 LYS CA . 10032 1 84 . 1 1 15 15 LYS CB C 13 36.125 0.300 . 1 . . . . 15 LYS CB . 10032 1 85 . 1 1 15 15 LYS CG C 13 24.549 0.300 . 1 . . . . 15 LYS CG . 10032 1 86 . 1 1 15 15 LYS CD C 13 28.786 0.300 . 1 . . . . 15 LYS CD . 10032 1 87 . 1 1 15 15 LYS CE C 13 42.512 0.300 . 1 . . . . 15 LYS CE . 10032 1 88 . 1 1 15 15 LYS N N 15 117.484 0.300 . 1 . . . . 15 LYS N . 10032 1 89 . 1 1 16 16 VAL H H 1 8.495 0.030 . 1 . . . . 16 VAL H . 10032 1 90 . 1 1 16 16 VAL HA H 1 3.316 0.030 . 1 . . . . 16 VAL HA . 10032 1 91 . 1 1 16 16 VAL HB H 1 1.905 0.030 . 1 . . . . 16 VAL HB . 10032 1 92 . 1 1 16 16 VAL HG11 H 1 0.932 0.030 . 1 . . . . 16 VAL HG1 . 10032 1 93 . 1 1 16 16 VAL HG12 H 1 0.932 0.030 . 1 . . . . 16 VAL HG1 . 10032 1 94 . 1 1 16 16 VAL HG13 H 1 0.932 0.030 . 1 . . . . 16 VAL HG1 . 10032 1 95 . 1 1 16 16 VAL HG21 H 1 0.970 0.030 . 1 . . . . 16 VAL HG2 . 10032 1 96 . 1 1 16 16 VAL HG22 H 1 0.970 0.030 . 1 . . . . 16 VAL HG2 . 10032 1 97 . 1 1 16 16 VAL HG23 H 1 0.970 0.030 . 1 . . . . 16 VAL HG2 . 10032 1 98 . 1 1 16 16 VAL C C 13 177.427 0.300 . 1 . . . . 16 VAL C . 10032 1 99 . 1 1 16 16 VAL CA C 13 64.999 0.300 . 1 . . . . 16 VAL CA . 10032 1 100 . 1 1 16 16 VAL CB C 13 31.559 0.300 . 1 . . . . 16 VAL CB . 10032 1 101 . 1 1 16 16 VAL CG1 C 13 21.116 0.300 . 2 . . . . 16 VAL CG1 . 10032 1 102 . 1 1 16 16 VAL CG2 C 13 23.073 0.300 . 2 . . . . 16 VAL CG2 . 10032 1 103 . 1 1 16 16 VAL N N 15 121.123 0.300 . 1 . . . . 16 VAL N . 10032 1 104 . 1 1 17 17 GLY H H 1 9.419 0.030 . 1 . . . . 17 GLY H . 10032 1 105 . 1 1 17 17 GLY HA2 H 1 3.563 0.030 . 2 . . . . 17 GLY HA2 . 10032 1 106 . 1 1 17 17 GLY HA3 H 1 4.589 0.030 . 2 . . . . 17 GLY HA3 . 10032 1 107 . 1 1 17 17 GLY C C 13 175.925 0.300 . 1 . . . . 17 GLY C . 10032 1 108 . 1 1 17 17 GLY CA C 13 44.430 0.300 . 1 . . . . 17 GLY CA . 10032 1 109 . 1 1 17 17 GLY N N 15 115.306 0.300 . 1 . . . . 17 GLY N . 10032 1 110 . 1 1 18 18 MET H H 1 7.876 0.030 . 1 . . . . 18 MET H . 10032 1 111 . 1 1 18 18 MET HA H 1 4.793 0.030 . 1 . . . . 18 MET HA . 10032 1 112 . 1 1 18 18 MET HB2 H 1 2.152 0.030 . 2 . . . . 18 MET HB2 . 10032 1 113 . 1 1 18 18 MET HB3 H 1 1.995 0.030 . 2 . . . . 18 MET HB3 . 10032 1 114 . 1 1 18 18 MET HG2 H 1 3.073 0.030 . 2 . . . . 18 MET HG2 . 10032 1 115 . 1 1 18 18 MET HG3 H 1 2.372 0.030 . 2 . . . . 18 MET HG3 . 10032 1 116 . 1 1 18 18 MET HE1 H 1 2.158 0.030 . 1 . . . . 18 MET HE . 10032 1 117 . 1 1 18 18 MET HE2 H 1 2.158 0.030 . 1 . . . . 18 MET HE . 10032 1 118 . 1 1 18 18 MET HE3 H 1 2.158 0.030 . 1 . . . . 18 MET HE . 10032 1 119 . 1 1 18 18 MET C C 13 176.030 0.300 . 1 . . . . 18 MET C . 10032 1 120 . 1 1 18 18 MET CA C 13 57.672 0.300 . 1 . . . . 18 MET CA . 10032 1 121 . 1 1 18 18 MET CB C 13 34.314 0.300 . 1 . . . . 18 MET CB . 10032 1 122 . 1 1 18 18 MET CG C 13 34.485 0.300 . 1 . . . . 18 MET CG . 10032 1 123 . 1 1 18 18 MET CE C 13 17.861 0.300 . 1 . . . . 18 MET CE . 10032 1 124 . 1 1 18 18 MET N N 15 120.652 0.300 . 1 . . . . 18 MET N . 10032 1 125 . 1 1 19 19 LYS H H 1 8.232 0.030 . 1 . . . . 19 LYS H . 10032 1 126 . 1 1 19 19 LYS HA H 1 5.918 0.030 . 1 . . . . 19 LYS HA . 10032 1 127 . 1 1 19 19 LYS HB2 H 1 2.439 0.030 . 2 . . . . 19 LYS HB2 . 10032 1 128 . 1 1 19 19 LYS HB3 H 1 1.796 0.030 . 2 . . . . 19 LYS HB3 . 10032 1 129 . 1 1 19 19 LYS HG2 H 1 1.564 0.030 . 2 . . . . 19 LYS HG2 . 10032 1 130 . 1 1 19 19 LYS HG3 H 1 2.077 0.030 . 2 . . . . 19 LYS HG3 . 10032 1 131 . 1 1 19 19 LYS HD2 H 1 2.207 0.030 . 2 . . . . 19 LYS HD2 . 10032 1 132 . 1 1 19 19 LYS HD3 H 1 1.838 0.030 . 2 . . . . 19 LYS HD3 . 10032 1 133 . 1 1 19 19 LYS HE2 H 1 2.836 0.030 . 2 . . . . 19 LYS HE2 . 10032 1 134 . 1 1 19 19 LYS HE3 H 1 3.155 0.030 . 2 . . . . 19 LYS HE3 . 10032 1 135 . 1 1 19 19 LYS C C 13 176.733 0.300 . 1 . . . . 19 LYS C . 10032 1 136 . 1 1 19 19 LYS CA C 13 55.142 0.300 . 1 . . . . 19 LYS CA . 10032 1 137 . 1 1 19 19 LYS CB C 13 36.603 0.300 . 1 . . . . 19 LYS CB . 10032 1 138 . 1 1 19 19 LYS CG C 13 26.230 0.300 . 1 . . . . 19 LYS CG . 10032 1 139 . 1 1 19 19 LYS CD C 13 30.370 0.300 . 1 . . . . 19 LYS CD . 10032 1 140 . 1 1 19 19 LYS CE C 13 41.887 0.300 . 1 . . . . 19 LYS CE . 10032 1 141 . 1 1 19 19 LYS N N 15 116.533 0.300 . 1 . . . . 19 LYS N . 10032 1 142 . 1 1 20 20 LEU H H 1 9.568 0.030 . 1 . . . . 20 LEU H . 10032 1 143 . 1 1 20 20 LEU HA H 1 4.592 0.030 . 1 . . . . 20 LEU HA . 10032 1 144 . 1 1 20 20 LEU HB2 H 1 2.160 0.030 . 2 . . . . 20 LEU HB2 . 10032 1 145 . 1 1 20 20 LEU HB3 H 1 2.571 0.030 . 2 . . . . 20 LEU HB3 . 10032 1 146 . 1 1 20 20 LEU HG H 1 1.502 0.030 . 1 . . . . 20 LEU HG . 10032 1 147 . 1 1 20 20 LEU HD11 H 1 0.912 0.030 . 1 . . . . 20 LEU HD1 . 10032 1 148 . 1 1 20 20 LEU HD12 H 1 0.912 0.030 . 1 . . . . 20 LEU HD1 . 10032 1 149 . 1 1 20 20 LEU HD13 H 1 0.912 0.030 . 1 . . . . 20 LEU HD1 . 10032 1 150 . 1 1 20 20 LEU HD21 H 1 0.746 0.030 . 1 . . . . 20 LEU HD2 . 10032 1 151 . 1 1 20 20 LEU HD22 H 1 0.746 0.030 . 1 . . . . 20 LEU HD2 . 10032 1 152 . 1 1 20 20 LEU HD23 H 1 0.746 0.030 . 1 . . . . 20 LEU HD2 . 10032 1 153 . 1 1 20 20 LEU C C 13 172.187 0.300 . 1 . . . . 20 LEU C . 10032 1 154 . 1 1 20 20 LEU CA C 13 56.840 0.300 . 1 . . . . 20 LEU CA . 10032 1 155 . 1 1 20 20 LEU CB C 13 41.617 0.300 . 1 . . . . 20 LEU CB . 10032 1 156 . 1 1 20 20 LEU CG C 13 26.886 0.300 . 1 . . . . 20 LEU CG . 10032 1 157 . 1 1 20 20 LEU CD1 C 13 28.088 0.300 . 2 . . . . 20 LEU CD1 . 10032 1 158 . 1 1 20 20 LEU CD2 C 13 27.620 0.300 . 2 . . . . 20 LEU CD2 . 10032 1 159 . 1 1 20 20 LEU N N 15 120.517 0.300 . 1 . . . . 20 LEU N . 10032 1 160 . 1 1 21 21 GLU H H 1 8.692 0.030 . 1 . . . . 21 GLU H . 10032 1 161 . 1 1 21 21 GLU HA H 1 5.709 0.030 . 1 . . . . 21 GLU HA . 10032 1 162 . 1 1 21 21 GLU HB2 H 1 1.964 0.030 . 2 . . . . 21 GLU HB2 . 10032 1 163 . 1 1 21 21 GLU HB3 H 1 1.897 0.030 . 2 . . . . 21 GLU HB3 . 10032 1 164 . 1 1 21 21 GLU HG2 H 1 2.579 0.030 . 2 . . . . 21 GLU HG2 . 10032 1 165 . 1 1 21 21 GLU HG3 H 1 2.766 0.030 . 2 . . . . 21 GLU HG3 . 10032 1 166 . 1 1 21 21 GLU C C 13 176.821 0.300 . 1 . . . . 21 GLU C . 10032 1 167 . 1 1 21 21 GLU CA C 13 54.021 0.300 . 1 . . . . 21 GLU CA . 10032 1 168 . 1 1 21 21 GLU CB C 13 33.466 0.300 . 1 . . . . 21 GLU CB . 10032 1 169 . 1 1 21 21 GLU CG C 13 38.170 0.300 . 1 . . . . 21 GLU CG . 10032 1 170 . 1 1 21 21 GLU N N 15 116.243 0.300 . 1 . . . . 21 GLU N . 10032 1 171 . 1 1 22 22 GLY H H 1 8.584 0.030 . 1 . . . . 22 GLY H . 10032 1 172 . 1 1 22 22 GLY HA2 H 1 4.773 0.030 . 2 . . . . 22 GLY HA2 . 10032 1 173 . 1 1 22 22 GLY HA3 H 1 3.959 0.030 . 2 . . . . 22 GLY HA3 . 10032 1 174 . 1 1 22 22 GLY C C 13 171.068 0.300 . 1 . . . . 22 GLY C . 10032 1 175 . 1 1 22 22 GLY CA C 13 46.832 0.300 . 1 . . . . 22 GLY CA . 10032 1 176 . 1 1 22 22 GLY N N 15 104.681 0.300 . 1 . . . . 22 GLY N . 10032 1 177 . 1 1 23 23 VAL H H 1 7.504 0.030 . 1 . . . . 23 VAL H . 10032 1 178 . 1 1 23 23 VAL HA H 1 4.175 0.030 . 1 . . . . 23 VAL HA . 10032 1 179 . 1 1 23 23 VAL HB H 1 1.652 0.030 . 1 . . . . 23 VAL HB . 10032 1 180 . 1 1 23 23 VAL HG11 H 1 0.575 0.030 . 1 . . . . 23 VAL HG1 . 10032 1 181 . 1 1 23 23 VAL HG12 H 1 0.575 0.030 . 1 . . . . 23 VAL HG1 . 10032 1 182 . 1 1 23 23 VAL HG13 H 1 0.575 0.030 . 1 . . . . 23 VAL HG1 . 10032 1 183 . 1 1 23 23 VAL HG21 H 1 0.576 0.030 . 1 . . . . 23 VAL HG2 . 10032 1 184 . 1 1 23 23 VAL HG22 H 1 0.576 0.030 . 1 . . . . 23 VAL HG2 . 10032 1 185 . 1 1 23 23 VAL HG23 H 1 0.576 0.030 . 1 . . . . 23 VAL HG2 . 10032 1 186 . 1 1 23 23 VAL C C 13 174.085 0.300 . 1 . . . . 23 VAL C . 10032 1 187 . 1 1 23 23 VAL CA C 13 60.632 0.300 . 1 . . . . 23 VAL CA . 10032 1 188 . 1 1 23 23 VAL CB C 13 33.598 0.300 . 1 . . . . 23 VAL CB . 10032 1 189 . 1 1 23 23 VAL CG1 C 13 21.239 0.300 . 2 . . . . 23 VAL CG1 . 10032 1 190 . 1 1 23 23 VAL CG2 C 13 22.335 0.300 . 2 . . . . 23 VAL CG2 . 10032 1 191 . 1 1 23 23 VAL N N 15 119.609 0.300 . 1 . . . . 23 VAL N . 10032 1 192 . 1 1 24 24 ASP H H 1 7.979 0.030 . 1 . . . . 24 ASP H . 10032 1 193 . 1 1 24 24 ASP HA H 1 4.498 0.030 . 1 . . . . 24 ASP HA . 10032 1 194 . 1 1 24 24 ASP HB2 H 1 3.077 0.030 . 2 . . . . 24 ASP HB2 . 10032 1 195 . 1 1 24 24 ASP HB3 H 1 2.538 0.030 . 2 . . . . 24 ASP HB3 . 10032 1 196 . 1 1 24 24 ASP CA C 13 50.802 0.300 . 1 . . . . 24 ASP CA . 10032 1 197 . 1 1 24 24 ASP CB C 13 42.050 0.300 . 1 . . . . 24 ASP CB . 10032 1 198 . 1 1 24 24 ASP N N 15 123.896 0.300 . 1 . . . . 24 ASP N . 10032 1 199 . 1 1 25 25 PRO HA H 1 4.053 0.030 . 1 . . . . 25 PRO HA . 10032 1 200 . 1 1 25 25 PRO HB2 H 1 2.071 0.030 . 2 . . . . 25 PRO HB2 . 10032 1 201 . 1 1 25 25 PRO HB3 H 1 1.692 0.030 . 2 . . . . 25 PRO HB3 . 10032 1 202 . 1 1 25 25 PRO HG2 H 1 1.296 0.030 . 2 . . . . 25 PRO HG2 . 10032 1 203 . 1 1 25 25 PRO HG3 H 1 1.186 0.030 . 2 . . . . 25 PRO HG3 . 10032 1 204 . 1 1 25 25 PRO HD2 H 1 3.378 0.030 . 2 . . . . 25 PRO HD2 . 10032 1 205 . 1 1 25 25 PRO HD3 H 1 3.433 0.030 . 2 . . . . 25 PRO HD3 . 10032 1 206 . 1 1 25 25 PRO C C 13 178.001 0.300 . 1 . . . . 25 PRO C . 10032 1 207 . 1 1 25 25 PRO CA C 13 64.393 0.300 . 1 . . . . 25 PRO CA . 10032 1 208 . 1 1 25 25 PRO CB C 13 32.289 0.300 . 1 . . . . 25 PRO CB . 10032 1 209 . 1 1 25 25 PRO CG C 13 27.280 0.300 . 1 . . . . 25 PRO CG . 10032 1 210 . 1 1 25 25 PRO CD C 13 50.724 0.300 . 1 . . . . 25 PRO CD . 10032 1 211 . 1 1 26 26 GLU H H 1 8.071 0.030 . 1 . . . . 26 GLU H . 10032 1 212 . 1 1 26 26 GLU HA H 1 4.091 0.030 . 1 . . . . 26 GLU HA . 10032 1 213 . 1 1 26 26 GLU HB2 H 1 1.645 0.030 . 2 . . . . 26 GLU HB2 . 10032 1 214 . 1 1 26 26 GLU HB3 H 1 1.540 0.030 . 2 . . . . 26 GLU HB3 . 10032 1 215 . 1 1 26 26 GLU HG2 H 1 1.932 0.030 . 2 . . . . 26 GLU HG2 . 10032 1 216 . 1 1 26 26 GLU HG3 H 1 2.155 0.030 . 2 . . . . 26 GLU HG3 . 10032 1 217 . 1 1 26 26 GLU C C 13 176.150 0.300 . 1 . . . . 26 GLU C . 10032 1 218 . 1 1 26 26 GLU CA C 13 55.912 0.300 . 1 . . . . 26 GLU CA . 10032 1 219 . 1 1 26 26 GLU CB C 13 30.653 0.300 . 1 . . . . 26 GLU CB . 10032 1 220 . 1 1 26 26 GLU CG C 13 36.428 0.300 . 1 . . . . 26 GLU CG . 10032 1 221 . 1 1 26 26 GLU N N 15 114.001 0.300 . 1 . . . . 26 GLU N . 10032 1 222 . 1 1 27 27 HIS H H 1 7.560 0.030 . 1 . . . . 27 HIS H . 10032 1 223 . 1 1 27 27 HIS HA H 1 4.723 0.030 . 1 . . . . 27 HIS HA . 10032 1 224 . 1 1 27 27 HIS HB2 H 1 2.986 0.030 . 2 . . . . 27 HIS HB2 . 10032 1 225 . 1 1 27 27 HIS HB3 H 1 2.724 0.030 . 2 . . . . 27 HIS HB3 . 10032 1 226 . 1 1 27 27 HIS HD2 H 1 7.141 0.030 . 1 . . . . 27 HIS HD2 . 10032 1 227 . 1 1 27 27 HIS HE1 H 1 8.213 0.030 . 1 . . . . 27 HIS HE1 . 10032 1 228 . 1 1 27 27 HIS C C 13 173.046 0.300 . 1 . . . . 27 HIS C . 10032 1 229 . 1 1 27 27 HIS CA C 13 54.536 0.300 . 1 . . . . 27 HIS CA . 10032 1 230 . 1 1 27 27 HIS CB C 13 29.794 0.300 . 1 . . . . 27 HIS CB . 10032 1 231 . 1 1 27 27 HIS CD2 C 13 120.463 0.300 . 1 . . . . 27 HIS CD2 . 10032 1 232 . 1 1 27 27 HIS CE1 C 13 135.926 0.300 . 1 . . . . 27 HIS CE1 . 10032 1 233 . 1 1 27 27 HIS N N 15 118.187 0.300 . 1 . . . . 27 HIS N . 10032 1 234 . 1 1 28 28 GLN H H 1 8.272 0.030 . 1 . . . . 28 GLN H . 10032 1 235 . 1 1 28 28 GLN HA H 1 4.026 0.030 . 1 . . . . 28 GLN HA . 10032 1 236 . 1 1 28 28 GLN HB2 H 1 2.108 0.030 . 2 . . . . 28 GLN HB2 . 10032 1 237 . 1 1 28 28 GLN HB3 H 1 1.943 0.030 . 2 . . . . 28 GLN HB3 . 10032 1 238 . 1 1 28 28 GLN HG2 H 1 2.357 0.030 . 1 . . . . 28 GLN HG2 . 10032 1 239 . 1 1 28 28 GLN HG3 H 1 2.357 0.030 . 1 . . . . 28 GLN HG3 . 10032 1 240 . 1 1 28 28 GLN HE21 H 1 7.496 0.030 . 2 . . . . 28 GLN HE21 . 10032 1 241 . 1 1 28 28 GLN HE22 H 1 6.816 0.030 . 2 . . . . 28 GLN HE22 . 10032 1 242 . 1 1 28 28 GLN C C 13 175.735 0.300 . 1 . . . . 28 GLN C . 10032 1 243 . 1 1 28 28 GLN CA C 13 57.888 0.300 . 1 . . . . 28 GLN CA . 10032 1 244 . 1 1 28 28 GLN CB C 13 28.495 0.300 . 1 . . . . 28 GLN CB . 10032 1 245 . 1 1 28 28 GLN CG C 13 34.063 0.300 . 1 . . . . 28 GLN CG . 10032 1 246 . 1 1 28 28 GLN N N 15 119.357 0.300 . 1 . . . . 28 GLN N . 10032 1 247 . 1 1 28 28 GLN NE2 N 15 112.321 0.300 . 1 . . . . 28 GLN NE2 . 10032 1 248 . 1 1 29 29 SER H H 1 8.161 0.030 . 1 . . . . 29 SER H . 10032 1 249 . 1 1 29 29 SER HA H 1 4.236 0.030 . 1 . . . . 29 SER HA . 10032 1 250 . 1 1 29 29 SER HB2 H 1 4.129 0.030 . 2 . . . . 29 SER HB2 . 10032 1 251 . 1 1 29 29 SER HB3 H 1 4.065 0.030 . 2 . . . . 29 SER HB3 . 10032 1 252 . 1 1 29 29 SER C C 13 173.087 0.300 . 1 . . . . 29 SER C . 10032 1 253 . 1 1 29 29 SER CA C 13 58.869 0.300 . 1 . . . . 29 SER CA . 10032 1 254 . 1 1 29 29 SER CB C 13 63.317 0.300 . 1 . . . . 29 SER CB . 10032 1 255 . 1 1 29 29 SER N N 15 112.541 0.300 . 1 . . . . 29 SER N . 10032 1 256 . 1 1 30 30 VAL H H 1 7.705 0.030 . 1 . . . . 30 VAL H . 10032 1 257 . 1 1 30 30 VAL HA H 1 4.270 0.030 . 1 . . . . 30 VAL HA . 10032 1 258 . 1 1 30 30 VAL HB H 1 2.087 0.030 . 1 . . . . 30 VAL HB . 10032 1 259 . 1 1 30 30 VAL HG11 H 1 0.470 0.030 . 1 . . . . 30 VAL HG1 . 10032 1 260 . 1 1 30 30 VAL HG12 H 1 0.470 0.030 . 1 . . . . 30 VAL HG1 . 10032 1 261 . 1 1 30 30 VAL HG13 H 1 0.470 0.030 . 1 . . . . 30 VAL HG1 . 10032 1 262 . 1 1 30 30 VAL HG21 H 1 0.658 0.030 . 1 . . . . 30 VAL HG2 . 10032 1 263 . 1 1 30 30 VAL HG22 H 1 0.658 0.030 . 1 . . . . 30 VAL HG2 . 10032 1 264 . 1 1 30 30 VAL HG23 H 1 0.658 0.030 . 1 . . . . 30 VAL HG2 . 10032 1 265 . 1 1 30 30 VAL C C 13 173.591 0.300 . 1 . . . . 30 VAL C . 10032 1 266 . 1 1 30 30 VAL CA C 13 61.896 0.300 . 1 . . . . 30 VAL CA . 10032 1 267 . 1 1 30 30 VAL CB C 13 32.582 0.300 . 1 . . . . 30 VAL CB . 10032 1 268 . 1 1 30 30 VAL CG1 C 13 20.742 0.300 . 2 . . . . 30 VAL CG1 . 10032 1 269 . 1 1 30 30 VAL CG2 C 13 21.070 0.300 . 2 . . . . 30 VAL CG2 . 10032 1 270 . 1 1 30 30 VAL N N 15 122.688 0.300 . 1 . . . . 30 VAL N . 10032 1 271 . 1 1 31 31 TYR H H 1 8.718 0.030 . 1 . . . . 31 TYR H . 10032 1 272 . 1 1 31 31 TYR HA H 1 4.739 0.030 . 1 . . . . 31 TYR HA . 10032 1 273 . 1 1 31 31 TYR HB2 H 1 3.433 0.030 . 2 . . . . 31 TYR HB2 . 10032 1 274 . 1 1 31 31 TYR HB3 H 1 2.577 0.030 . 2 . . . . 31 TYR HB3 . 10032 1 275 . 1 1 31 31 TYR HD1 H 1 6.918 0.030 . 1 . . . . 31 TYR HD1 . 10032 1 276 . 1 1 31 31 TYR HD2 H 1 6.918 0.030 . 1 . . . . 31 TYR HD2 . 10032 1 277 . 1 1 31 31 TYR HE1 H 1 6.563 0.030 . 1 . . . . 31 TYR HE1 . 10032 1 278 . 1 1 31 31 TYR HE2 H 1 6.563 0.030 . 1 . . . . 31 TYR HE2 . 10032 1 279 . 1 1 31 31 TYR C C 13 176.283 0.300 . 1 . . . . 31 TYR C . 10032 1 280 . 1 1 31 31 TYR CA C 13 58.631 0.300 . 1 . . . . 31 TYR CA . 10032 1 281 . 1 1 31 31 TYR CB C 13 41.451 0.300 . 1 . . . . 31 TYR CB . 10032 1 282 . 1 1 31 31 TYR CD1 C 13 132.410 0.300 . 1 . . . . 31 TYR CD1 . 10032 1 283 . 1 1 31 31 TYR CD2 C 13 132.410 0.300 . 1 . . . . 31 TYR CD2 . 10032 1 284 . 1 1 31 31 TYR CE1 C 13 118.363 0.300 . 1 . . . . 31 TYR CE1 . 10032 1 285 . 1 1 31 31 TYR CE2 C 13 118.363 0.300 . 1 . . . . 31 TYR CE2 . 10032 1 286 . 1 1 31 31 TYR N N 15 124.594 0.300 . 1 . . . . 31 TYR N . 10032 1 287 . 1 1 32 32 CYS H H 1 9.181 0.030 . 1 . . . . 32 CYS H . 10032 1 288 . 1 1 32 32 CYS HA H 1 5.267 0.030 . 1 . . . . 32 CYS HA . 10032 1 289 . 1 1 32 32 CYS HB2 H 1 2.583 0.030 . 2 . . . . 32 CYS HB2 . 10032 1 290 . 1 1 32 32 CYS HB3 H 1 3.295 0.030 . 2 . . . . 32 CYS HB3 . 10032 1 291 . 1 1 32 32 CYS C C 13 173.403 0.300 . 1 . . . . 32 CYS C . 10032 1 292 . 1 1 32 32 CYS CA C 13 58.231 0.300 . 1 . . . . 32 CYS CA . 10032 1 293 . 1 1 32 32 CYS CB C 13 33.759 0.300 . 1 . . . . 32 CYS CB . 10032 1 294 . 1 1 32 32 CYS N N 15 118.585 0.300 . 1 . . . . 32 CYS N . 10032 1 295 . 1 1 33 33 VAL H H 1 7.442 0.030 . 1 . . . . 33 VAL H . 10032 1 296 . 1 1 33 33 VAL HA H 1 4.112 0.030 . 1 . . . . 33 VAL HA . 10032 1 297 . 1 1 33 33 VAL HB H 1 1.618 0.030 . 1 . . . . 33 VAL HB . 10032 1 298 . 1 1 33 33 VAL HG11 H 1 0.260 0.030 . 1 . . . . 33 VAL HG1 . 10032 1 299 . 1 1 33 33 VAL HG12 H 1 0.260 0.030 . 1 . . . . 33 VAL HG1 . 10032 1 300 . 1 1 33 33 VAL HG13 H 1 0.260 0.030 . 1 . . . . 33 VAL HG1 . 10032 1 301 . 1 1 33 33 VAL HG21 H 1 0.909 0.030 . 1 . . . . 33 VAL HG2 . 10032 1 302 . 1 1 33 33 VAL HG22 H 1 0.909 0.030 . 1 . . . . 33 VAL HG2 . 10032 1 303 . 1 1 33 33 VAL HG23 H 1 0.909 0.030 . 1 . . . . 33 VAL HG2 . 10032 1 304 . 1 1 33 33 VAL C C 13 174.737 0.300 . 1 . . . . 33 VAL C . 10032 1 305 . 1 1 33 33 VAL CA C 13 64.567 0.300 . 1 . . . . 33 VAL CA . 10032 1 306 . 1 1 33 33 VAL CB C 13 32.624 0.300 . 1 . . . . 33 VAL CB . 10032 1 307 . 1 1 33 33 VAL CG1 C 13 22.592 0.300 . 2 . . . . 33 VAL CG1 . 10032 1 308 . 1 1 33 33 VAL CG2 C 13 21.090 0.300 . 2 . . . . 33 VAL CG2 . 10032 1 309 . 1 1 33 33 VAL N N 15 121.950 0.300 . 1 . . . . 33 VAL N . 10032 1 310 . 1 1 34 34 LEU H H 1 8.721 0.030 . 1 . . . . 34 LEU H . 10032 1 311 . 1 1 34 34 LEU HA H 1 5.605 0.030 . 1 . . . . 34 LEU HA . 10032 1 312 . 1 1 34 34 LEU HB2 H 1 1.425 0.030 . 2 . . . . 34 LEU HB2 . 10032 1 313 . 1 1 34 34 LEU HB3 H 1 1.069 0.030 . 2 . . . . 34 LEU HB3 . 10032 1 314 . 1 1 34 34 LEU HG H 1 1.502 0.030 . 1 . . . . 34 LEU HG . 10032 1 315 . 1 1 34 34 LEU HD11 H 1 0.565 0.030 . 1 . . . . 34 LEU HD1 . 10032 1 316 . 1 1 34 34 LEU HD12 H 1 0.565 0.030 . 1 . . . . 34 LEU HD1 . 10032 1 317 . 1 1 34 34 LEU HD13 H 1 0.565 0.030 . 1 . . . . 34 LEU HD1 . 10032 1 318 . 1 1 34 34 LEU HD21 H 1 0.116 0.030 . 1 . . . . 34 LEU HD2 . 10032 1 319 . 1 1 34 34 LEU HD22 H 1 0.116 0.030 . 1 . . . . 34 LEU HD2 . 10032 1 320 . 1 1 34 34 LEU HD23 H 1 0.116 0.030 . 1 . . . . 34 LEU HD2 . 10032 1 321 . 1 1 34 34 LEU C C 13 176.004 0.300 . 1 . . . . 34 LEU C . 10032 1 322 . 1 1 34 34 LEU CA C 13 53.479 0.300 . 1 . . . . 34 LEU CA . 10032 1 323 . 1 1 34 34 LEU CB C 13 47.483 0.300 . 1 . . . . 34 LEU CB . 10032 1 324 . 1 1 34 34 LEU CG C 13 26.635 0.300 . 1 . . . . 34 LEU CG . 10032 1 325 . 1 1 34 34 LEU CD1 C 13 27.324 0.300 . 2 . . . . 34 LEU CD1 . 10032 1 326 . 1 1 34 34 LEU CD2 C 13 24.101 0.300 . 2 . . . . 34 LEU CD2 . 10032 1 327 . 1 1 34 34 LEU N N 15 128.090 0.300 . 1 . . . . 34 LEU N . 10032 1 328 . 1 1 35 35 THR H H 1 8.841 0.030 . 1 . . . . 35 THR H . 10032 1 329 . 1 1 35 35 THR HA H 1 5.138 0.030 . 1 . . . . 35 THR HA . 10032 1 330 . 1 1 35 35 THR HB H 1 3.778 0.030 . 1 . . . . 35 THR HB . 10032 1 331 . 1 1 35 35 THR HG21 H 1 1.144 0.030 . 1 . . . . 35 THR HG2 . 10032 1 332 . 1 1 35 35 THR HG22 H 1 1.144 0.030 . 1 . . . . 35 THR HG2 . 10032 1 333 . 1 1 35 35 THR HG23 H 1 1.144 0.030 . 1 . . . . 35 THR HG2 . 10032 1 334 . 1 1 35 35 THR C C 13 174.807 0.300 . 1 . . . . 35 THR C . 10032 1 335 . 1 1 35 35 THR CA C 13 61.575 0.300 . 1 . . . . 35 THR CA . 10032 1 336 . 1 1 35 35 THR CB C 13 72.337 0.300 . 1 . . . . 35 THR CB . 10032 1 337 . 1 1 35 35 THR CG2 C 13 22.295 0.300 . 1 . . . . 35 THR CG2 . 10032 1 338 . 1 1 35 35 THR N N 15 113.939 0.300 . 1 . . . . 35 THR N . 10032 1 339 . 1 1 36 36 VAL H H 1 8.806 0.030 . 1 . . . . 36 VAL H . 10032 1 340 . 1 1 36 36 VAL HA H 1 3.852 0.030 . 1 . . . . 36 VAL HA . 10032 1 341 . 1 1 36 36 VAL HB H 1 2.318 0.030 . 1 . . . . 36 VAL HB . 10032 1 342 . 1 1 36 36 VAL HG11 H 1 0.572 0.030 . 1 . . . . 36 VAL HG1 . 10032 1 343 . 1 1 36 36 VAL HG12 H 1 0.572 0.030 . 1 . . . . 36 VAL HG1 . 10032 1 344 . 1 1 36 36 VAL HG13 H 1 0.572 0.030 . 1 . . . . 36 VAL HG1 . 10032 1 345 . 1 1 36 36 VAL HG21 H 1 0.791 0.030 . 1 . . . . 36 VAL HG2 . 10032 1 346 . 1 1 36 36 VAL HG22 H 1 0.791 0.030 . 1 . . . . 36 VAL HG2 . 10032 1 347 . 1 1 36 36 VAL HG23 H 1 0.791 0.030 . 1 . . . . 36 VAL HG2 . 10032 1 348 . 1 1 36 36 VAL C C 13 174.539 0.300 . 1 . . . . 36 VAL C . 10032 1 349 . 1 1 36 36 VAL CA C 13 63.658 0.300 . 1 . . . . 36 VAL CA . 10032 1 350 . 1 1 36 36 VAL CB C 13 31.139 0.300 . 1 . . . . 36 VAL CB . 10032 1 351 . 1 1 36 36 VAL CG1 C 13 22.733 0.300 . 2 . . . . 36 VAL CG1 . 10032 1 352 . 1 1 36 36 VAL CG2 C 13 22.079 0.300 . 2 . . . . 36 VAL CG2 . 10032 1 353 . 1 1 36 36 VAL N N 15 124.229 0.300 . 1 . . . . 36 VAL N . 10032 1 354 . 1 1 37 37 ALA H H 1 9.671 0.030 . 1 . . . . 37 ALA H . 10032 1 355 . 1 1 37 37 ALA HA H 1 4.490 0.030 . 1 . . . . 37 ALA HA . 10032 1 356 . 1 1 37 37 ALA HB1 H 1 1.085 0.030 . 1 . . . . 37 ALA HB . 10032 1 357 . 1 1 37 37 ALA HB2 H 1 1.085 0.030 . 1 . . . . 37 ALA HB . 10032 1 358 . 1 1 37 37 ALA HB3 H 1 1.085 0.030 . 1 . . . . 37 ALA HB . 10032 1 359 . 1 1 37 37 ALA C C 13 176.734 0.300 . 1 . . . . 37 ALA C . 10032 1 360 . 1 1 37 37 ALA CA C 13 52.618 0.300 . 1 . . . . 37 ALA CA . 10032 1 361 . 1 1 37 37 ALA CB C 13 20.740 0.300 . 1 . . . . 37 ALA CB . 10032 1 362 . 1 1 37 37 ALA N N 15 135.197 0.300 . 1 . . . . 37 ALA N . 10032 1 363 . 1 1 38 38 GLU H H 1 7.435 0.030 . 1 . . . . 38 GLU H . 10032 1 364 . 1 1 38 38 GLU HA H 1 4.258 0.030 . 1 . . . . 38 GLU HA . 10032 1 365 . 1 1 38 38 GLU HB2 H 1 1.820 0.030 . 2 . . . . 38 GLU HB2 . 10032 1 366 . 1 1 38 38 GLU HB3 H 1 1.568 0.030 . 2 . . . . 38 GLU HB3 . 10032 1 367 . 1 1 38 38 GLU HG2 H 1 2.301 0.030 . 1 . . . . 38 GLU HG2 . 10032 1 368 . 1 1 38 38 GLU HG3 H 1 2.301 0.030 . 1 . . . . 38 GLU HG3 . 10032 1 369 . 1 1 38 38 GLU C C 13 172.973 0.300 . 1 . . . . 38 GLU C . 10032 1 370 . 1 1 38 38 GLU CA C 13 56.299 0.300 . 1 . . . . 38 GLU CA . 10032 1 371 . 1 1 38 38 GLU CB C 13 33.790 0.300 . 1 . . . . 38 GLU CB . 10032 1 372 . 1 1 38 38 GLU CG C 13 36.998 0.300 . 1 . . . . 38 GLU CG . 10032 1 373 . 1 1 38 38 GLU N N 15 116.671 0.300 . 1 . . . . 38 GLU N . 10032 1 374 . 1 1 39 39 VAL H H 1 8.774 0.030 . 1 . . . . 39 VAL H . 10032 1 375 . 1 1 39 39 VAL HA H 1 4.566 0.030 . 1 . . . . 39 VAL HA . 10032 1 376 . 1 1 39 39 VAL HB H 1 1.981 0.030 . 1 . . . . 39 VAL HB . 10032 1 377 . 1 1 39 39 VAL HG11 H 1 0.948 0.030 . 1 . . . . 39 VAL HG1 . 10032 1 378 . 1 1 39 39 VAL HG12 H 1 0.948 0.030 . 1 . . . . 39 VAL HG1 . 10032 1 379 . 1 1 39 39 VAL HG13 H 1 0.948 0.030 . 1 . . . . 39 VAL HG1 . 10032 1 380 . 1 1 39 39 VAL HG21 H 1 0.772 0.030 . 1 . . . . 39 VAL HG2 . 10032 1 381 . 1 1 39 39 VAL HG22 H 1 0.772 0.030 . 1 . . . . 39 VAL HG2 . 10032 1 382 . 1 1 39 39 VAL HG23 H 1 0.772 0.030 . 1 . . . . 39 VAL HG2 . 10032 1 383 . 1 1 39 39 VAL C C 13 175.127 0.300 . 1 . . . . 39 VAL C . 10032 1 384 . 1 1 39 39 VAL CA C 13 61.965 0.300 . 1 . . . . 39 VAL CA . 10032 1 385 . 1 1 39 39 VAL CB C 13 34.853 0.300 . 1 . . . . 39 VAL CB . 10032 1 386 . 1 1 39 39 VAL CG1 C 13 21.260 0.300 . 2 . . . . 39 VAL CG1 . 10032 1 387 . 1 1 39 39 VAL CG2 C 13 20.717 0.300 . 2 . . . . 39 VAL CG2 . 10032 1 388 . 1 1 39 39 VAL N N 15 123.038 0.300 . 1 . . . . 39 VAL N . 10032 1 389 . 1 1 40 40 CYS H H 1 8.648 0.030 . 1 . . . . 40 CYS H . 10032 1 390 . 1 1 40 40 CYS HA H 1 4.632 0.030 . 1 . . . . 40 CYS HA . 10032 1 391 . 1 1 40 40 CYS HB2 H 1 2.946 0.030 . 2 . . . . 40 CYS HB2 . 10032 1 392 . 1 1 40 40 CYS HB3 H 1 2.697 0.030 . 2 . . . . 40 CYS HB3 . 10032 1 393 . 1 1 40 40 CYS C C 13 174.694 0.300 . 1 . . . . 40 CYS C . 10032 1 394 . 1 1 40 40 CYS CA C 13 58.623 0.300 . 1 . . . . 40 CYS CA . 10032 1 395 . 1 1 40 40 CYS CB C 13 28.267 0.300 . 1 . . . . 40 CYS CB . 10032 1 396 . 1 1 40 40 CYS N N 15 126.619 0.300 . 1 . . . . 40 CYS N . 10032 1 397 . 1 1 41 41 GLY HA2 H 1 3.982 0.030 . 2 . . . . 41 GLY HA2 . 10032 1 398 . 1 1 41 41 GLY HA3 H 1 3.707 0.030 . 2 . . . . 41 GLY HA3 . 10032 1 399 . 1 1 41 41 GLY CA C 13 47.223 0.300 . 1 . . . . 41 GLY CA . 10032 1 400 . 1 1 42 42 TYR HA H 1 4.675 0.030 . 1 . . . . 42 TYR HA . 10032 1 401 . 1 1 42 42 TYR HB2 H 1 3.045 0.030 . 2 . . . . 42 TYR HB2 . 10032 1 402 . 1 1 42 42 TYR HB3 H 1 3.175 0.030 . 2 . . . . 42 TYR HB3 . 10032 1 403 . 1 1 42 42 TYR HD1 H 1 7.133 0.030 . 1 . . . . 42 TYR HD1 . 10032 1 404 . 1 1 42 42 TYR HD2 H 1 7.133 0.030 . 1 . . . . 42 TYR HD2 . 10032 1 405 . 1 1 42 42 TYR HE1 H 1 6.753 0.030 . 1 . . . . 42 TYR HE1 . 10032 1 406 . 1 1 42 42 TYR HE2 H 1 6.753 0.030 . 1 . . . . 42 TYR HE2 . 10032 1 407 . 1 1 42 42 TYR C C 13 173.771 0.300 . 1 . . . . 42 TYR C . 10032 1 408 . 1 1 42 42 TYR CA C 13 57.813 0.300 . 1 . . . . 42 TYR CA . 10032 1 409 . 1 1 42 42 TYR CB C 13 38.759 0.300 . 1 . . . . 42 TYR CB . 10032 1 410 . 1 1 42 42 TYR CD1 C 13 133.079 0.300 . 1 . . . . 42 TYR CD1 . 10032 1 411 . 1 1 42 42 TYR CD2 C 13 133.079 0.300 . 1 . . . . 42 TYR CD2 . 10032 1 412 . 1 1 42 42 TYR CE1 C 13 118.314 0.300 . 1 . . . . 42 TYR CE1 . 10032 1 413 . 1 1 42 42 TYR CE2 C 13 118.314 0.300 . 1 . . . . 42 TYR CE2 . 10032 1 414 . 1 1 43 43 ARG H H 1 8.090 0.030 . 1 . . . . 43 ARG H . 10032 1 415 . 1 1 43 43 ARG HA H 1 5.188 0.030 . 1 . . . . 43 ARG HA . 10032 1 416 . 1 1 43 43 ARG HB2 H 1 1.957 0.030 . 2 . . . . 43 ARG HB2 . 10032 1 417 . 1 1 43 43 ARG HB3 H 1 2.036 0.030 . 2 . . . . 43 ARG HB3 . 10032 1 418 . 1 1 43 43 ARG HG2 H 1 1.701 0.030 . 2 . . . . 43 ARG HG2 . 10032 1 419 . 1 1 43 43 ARG HG3 H 1 1.619 0.030 . 2 . . . . 43 ARG HG3 . 10032 1 420 . 1 1 43 43 ARG HD2 H 1 3.038 0.030 . 1 . . . . 43 ARG HD2 . 10032 1 421 . 1 1 43 43 ARG HD3 H 1 3.038 0.030 . 1 . . . . 43 ARG HD3 . 10032 1 422 . 1 1 43 43 ARG C C 13 175.360 0.300 . 1 . . . . 43 ARG C . 10032 1 423 . 1 1 43 43 ARG CA C 13 54.972 0.300 . 1 . . . . 43 ARG CA . 10032 1 424 . 1 1 43 43 ARG CB C 13 34.082 0.300 . 1 . . . . 43 ARG CB . 10032 1 425 . 1 1 43 43 ARG CG C 13 27.223 0.300 . 1 . . . . 43 ARG CG . 10032 1 426 . 1 1 43 43 ARG CD C 13 43.907 0.300 . 1 . . . . 43 ARG CD . 10032 1 427 . 1 1 43 43 ARG N N 15 117.988 0.300 . 1 . . . . 43 ARG N . 10032 1 428 . 1 1 44 44 ILE H H 1 9.128 0.030 . 1 . . . . 44 ILE H . 10032 1 429 . 1 1 44 44 ILE HA H 1 4.874 0.030 . 1 . . . . 44 ILE HA . 10032 1 430 . 1 1 44 44 ILE HB H 1 1.375 0.030 . 1 . . . . 44 ILE HB . 10032 1 431 . 1 1 44 44 ILE HG12 H 1 0.491 0.030 . 2 . . . . 44 ILE HG12 . 10032 1 432 . 1 1 44 44 ILE HG13 H 1 1.058 0.030 . 2 . . . . 44 ILE HG13 . 10032 1 433 . 1 1 44 44 ILE HG21 H 1 0.672 0.030 . 1 . . . . 44 ILE HG2 . 10032 1 434 . 1 1 44 44 ILE HG22 H 1 0.672 0.030 . 1 . . . . 44 ILE HG2 . 10032 1 435 . 1 1 44 44 ILE HG23 H 1 0.672 0.030 . 1 . . . . 44 ILE HG2 . 10032 1 436 . 1 1 44 44 ILE HD11 H 1 -0.311 0.030 . 1 . . . . 44 ILE HD1 . 10032 1 437 . 1 1 44 44 ILE HD12 H 1 -0.311 0.030 . 1 . . . . 44 ILE HD1 . 10032 1 438 . 1 1 44 44 ILE HD13 H 1 -0.311 0.030 . 1 . . . . 44 ILE HD1 . 10032 1 439 . 1 1 44 44 ILE C C 13 171.641 0.300 . 1 . . . . 44 ILE C . 10032 1 440 . 1 1 44 44 ILE CA C 13 59.209 0.300 . 1 . . . . 44 ILE CA . 10032 1 441 . 1 1 44 44 ILE CB C 13 41.550 0.300 . 1 . . . . 44 ILE CB . 10032 1 442 . 1 1 44 44 ILE CG1 C 13 25.383 0.300 . 1 . . . . 44 ILE CG1 . 10032 1 443 . 1 1 44 44 ILE CG2 C 13 20.014 0.300 . 1 . . . . 44 ILE CG2 . 10032 1 444 . 1 1 44 44 ILE CD1 C 13 12.298 0.300 . 1 . . . . 44 ILE CD1 . 10032 1 445 . 1 1 44 44 ILE N N 15 114.395 0.300 . 1 . . . . 44 ILE N . 10032 1 446 . 1 1 45 45 LYS H H 1 8.289 0.030 . 1 . . . . 45 LYS H . 10032 1 447 . 1 1 45 45 LYS HA H 1 3.920 0.030 . 1 . . . . 45 LYS HA . 10032 1 448 . 1 1 45 45 LYS HB2 H 1 -1.416 0.030 . 2 . . . . 45 LYS HB2 . 10032 1 449 . 1 1 45 45 LYS HB3 H 1 0.738 0.030 . 2 . . . . 45 LYS HB3 . 10032 1 450 . 1 1 45 45 LYS HG2 H 1 0.354 0.030 . 2 . . . . 45 LYS HG2 . 10032 1 451 . 1 1 45 45 LYS HG3 H 1 -0.419 0.030 . 2 . . . . 45 LYS HG3 . 10032 1 452 . 1 1 45 45 LYS HD2 H 1 1.119 0.030 . 2 . . . . 45 LYS HD2 . 10032 1 453 . 1 1 45 45 LYS HD3 H 1 1.204 0.030 . 2 . . . . 45 LYS HD3 . 10032 1 454 . 1 1 45 45 LYS HE2 H 1 2.495 0.030 . 2 . . . . 45 LYS HE2 . 10032 1 455 . 1 1 45 45 LYS HE3 H 1 2.652 0.030 . 2 . . . . 45 LYS HE3 . 10032 1 456 . 1 1 45 45 LYS C C 13 174.866 0.300 . 1 . . . . 45 LYS C . 10032 1 457 . 1 1 45 45 LYS CA C 13 53.398 0.300 . 1 . . . . 45 LYS CA . 10032 1 458 . 1 1 45 45 LYS CB C 13 33.482 0.300 . 1 . . . . 45 LYS CB . 10032 1 459 . 1 1 45 45 LYS CG C 13 24.942 0.300 . 1 . . . . 45 LYS CG . 10032 1 460 . 1 1 45 45 LYS CD C 13 29.011 0.300 . 1 . . . . 45 LYS CD . 10032 1 461 . 1 1 45 45 LYS CE C 13 41.880 0.300 . 1 . . . . 45 LYS CE . 10032 1 462 . 1 1 45 45 LYS N N 15 126.580 0.300 . 1 . . . . 45 LYS N . 10032 1 463 . 1 1 46 46 LEU H H 1 9.027 0.030 . 1 . . . . 46 LEU H . 10032 1 464 . 1 1 46 46 LEU HA H 1 4.606 0.030 . 1 . . . . 46 LEU HA . 10032 1 465 . 1 1 46 46 LEU HB2 H 1 0.508 0.030 . 2 . . . . 46 LEU HB2 . 10032 1 466 . 1 1 46 46 LEU HB3 H 1 0.385 0.030 . 2 . . . . 46 LEU HB3 . 10032 1 467 . 1 1 46 46 LEU HG H 1 0.978 0.030 . 1 . . . . 46 LEU HG . 10032 1 468 . 1 1 46 46 LEU HD11 H 1 0.394 0.030 . 1 . . . . 46 LEU HD1 . 10032 1 469 . 1 1 46 46 LEU HD12 H 1 0.394 0.030 . 1 . . . . 46 LEU HD1 . 10032 1 470 . 1 1 46 46 LEU HD13 H 1 0.394 0.030 . 1 . . . . 46 LEU HD1 . 10032 1 471 . 1 1 46 46 LEU HD21 H 1 0.460 0.030 . 1 . . . . 46 LEU HD2 . 10032 1 472 . 1 1 46 46 LEU HD22 H 1 0.460 0.030 . 1 . . . . 46 LEU HD2 . 10032 1 473 . 1 1 46 46 LEU HD23 H 1 0.460 0.030 . 1 . . . . 46 LEU HD2 . 10032 1 474 . 1 1 46 46 LEU C C 13 173.461 0.300 . 1 . . . . 46 LEU C . 10032 1 475 . 1 1 46 46 LEU CA C 13 52.917 0.300 . 1 . . . . 46 LEU CA . 10032 1 476 . 1 1 46 46 LEU CB C 13 43.048 0.300 . 1 . . . . 46 LEU CB . 10032 1 477 . 1 1 46 46 LEU CG C 13 26.874 0.300 . 1 . . . . 46 LEU CG . 10032 1 478 . 1 1 46 46 LEU CD1 C 13 25.027 0.300 . 2 . . . . 46 LEU CD1 . 10032 1 479 . 1 1 46 46 LEU CD2 C 13 27.024 0.300 . 2 . . . . 46 LEU CD2 . 10032 1 480 . 1 1 46 46 LEU N N 15 128.568 0.300 . 1 . . . . 46 LEU N . 10032 1 481 . 1 1 47 47 HIS H H 1 8.746 0.030 . 1 . . . . 47 HIS H . 10032 1 482 . 1 1 47 47 HIS HA H 1 5.039 0.030 . 1 . . . . 47 HIS HA . 10032 1 483 . 1 1 47 47 HIS HB2 H 1 2.816 0.030 . 2 . . . . 47 HIS HB2 . 10032 1 484 . 1 1 47 47 HIS HB3 H 1 2.948 0.030 . 2 . . . . 47 HIS HB3 . 10032 1 485 . 1 1 47 47 HIS HD2 H 1 7.129 0.030 . 1 . . . . 47 HIS HD2 . 10032 1 486 . 1 1 47 47 HIS HE1 H 1 8.479 0.030 . 1 . . . . 47 HIS HE1 . 10032 1 487 . 1 1 47 47 HIS C C 13 174.137 0.300 . 1 . . . . 47 HIS C . 10032 1 488 . 1 1 47 47 HIS CA C 13 53.152 0.300 . 1 . . . . 47 HIS CA . 10032 1 489 . 1 1 47 47 HIS CB C 13 32.559 0.300 . 1 . . . . 47 HIS CB . 10032 1 490 . 1 1 47 47 HIS CD2 C 13 118.728 0.300 . 1 . . . . 47 HIS CD2 . 10032 1 491 . 1 1 47 47 HIS CE1 C 13 136.920 0.300 . 1 . . . . 47 HIS CE1 . 10032 1 492 . 1 1 47 47 HIS N N 15 117.726 0.300 . 1 . . . . 47 HIS N . 10032 1 493 . 1 1 48 48 PHE H H 1 8.413 0.030 . 1 . . . . 48 PHE H . 10032 1 494 . 1 1 48 48 PHE HA H 1 4.749 0.030 . 1 . . . . 48 PHE HA . 10032 1 495 . 1 1 48 48 PHE HB2 H 1 2.859 0.030 . 2 . . . . 48 PHE HB2 . 10032 1 496 . 1 1 48 48 PHE HB3 H 1 2.689 0.030 . 2 . . . . 48 PHE HB3 . 10032 1 497 . 1 1 48 48 PHE HD1 H 1 7.227 0.030 . 1 . . . . 48 PHE HD1 . 10032 1 498 . 1 1 48 48 PHE HD2 H 1 7.227 0.030 . 1 . . . . 48 PHE HD2 . 10032 1 499 . 1 1 48 48 PHE HE1 H 1 7.499 0.030 . 1 . . . . 48 PHE HE1 . 10032 1 500 . 1 1 48 48 PHE HE2 H 1 7.499 0.030 . 1 . . . . 48 PHE HE2 . 10032 1 501 . 1 1 48 48 PHE HZ H 1 7.049 0.030 . 1 . . . . 48 PHE HZ . 10032 1 502 . 1 1 48 48 PHE C C 13 175.109 0.300 . 1 . . . . 48 PHE C . 10032 1 503 . 1 1 48 48 PHE CA C 13 56.398 0.300 . 1 . . . . 48 PHE CA . 10032 1 504 . 1 1 48 48 PHE CB C 13 38.521 0.300 . 1 . . . . 48 PHE CB . 10032 1 505 . 1 1 48 48 PHE CD1 C 13 132.274 0.300 . 1 . . . . 48 PHE CD1 . 10032 1 506 . 1 1 48 48 PHE CD2 C 13 132.274 0.300 . 1 . . . . 48 PHE CD2 . 10032 1 507 . 1 1 48 48 PHE CE1 C 13 131.430 0.300 . 1 . . . . 48 PHE CE1 . 10032 1 508 . 1 1 48 48 PHE CE2 C 13 131.430 0.300 . 1 . . . . 48 PHE CE2 . 10032 1 509 . 1 1 48 48 PHE CZ C 13 129.641 0.300 . 1 . . . . 48 PHE CZ . 10032 1 510 . 1 1 48 48 PHE N N 15 125.449 0.300 . 1 . . . . 48 PHE N . 10032 1 511 . 1 1 49 49 ASP H H 1 8.136 0.030 . 1 . . . . 49 ASP H . 10032 1 512 . 1 1 49 49 ASP HA H 1 4.330 0.030 . 1 . . . . 49 ASP HA . 10032 1 513 . 1 1 49 49 ASP HB2 H 1 2.413 0.030 . 2 . . . . 49 ASP HB2 . 10032 1 514 . 1 1 49 49 ASP HB3 H 1 2.600 0.030 . 2 . . . . 49 ASP HB3 . 10032 1 515 . 1 1 49 49 ASP CA C 13 57.318 0.300 . 1 . . . . 49 ASP CA . 10032 1 516 . 1 1 49 49 ASP CB C 13 39.766 0.300 . 1 . . . . 49 ASP CB . 10032 1 517 . 1 1 49 49 ASP N N 15 126.433 0.300 . 1 . . . . 49 ASP N . 10032 1 518 . 1 1 50 50 GLY H H 1 8.902 0.030 . 1 . . . . 50 GLY H . 10032 1 519 . 1 1 50 50 GLY HA2 H 1 4.312 0.030 . 2 . . . . 50 GLY HA2 . 10032 1 520 . 1 1 50 50 GLY HA3 H 1 3.799 0.030 . 2 . . . . 50 GLY HA3 . 10032 1 521 . 1 1 50 50 GLY C C 13 173.844 0.300 . 1 . . . . 50 GLY C . 10032 1 522 . 1 1 50 50 GLY CA C 13 45.786 0.300 . 1 . . . . 50 GLY CA . 10032 1 523 . 1 1 50 50 GLY N N 15 111.157 0.300 . 1 . . . . 50 GLY N . 10032 1 524 . 1 1 51 51 TYR H H 1 8.484 0.030 . 1 . . . . 51 TYR H . 10032 1 525 . 1 1 51 51 TYR HA H 1 4.761 0.030 . 1 . . . . 51 TYR HA . 10032 1 526 . 1 1 51 51 TYR HB2 H 1 3.223 0.030 . 1 . . . . 51 TYR HB2 . 10032 1 527 . 1 1 51 51 TYR HB3 H 1 3.223 0.030 . 1 . . . . 51 TYR HB3 . 10032 1 528 . 1 1 51 51 TYR HD1 H 1 7.018 0.030 . 1 . . . . 51 TYR HD1 . 10032 1 529 . 1 1 51 51 TYR HD2 H 1 7.018 0.030 . 1 . . . . 51 TYR HD2 . 10032 1 530 . 1 1 51 51 TYR HE1 H 1 6.679 0.030 . 1 . . . . 51 TYR HE1 . 10032 1 531 . 1 1 51 51 TYR HE2 H 1 6.679 0.030 . 1 . . . . 51 TYR HE2 . 10032 1 532 . 1 1 51 51 TYR C C 13 175.921 0.300 . 1 . . . . 51 TYR C . 10032 1 533 . 1 1 51 51 TYR CA C 13 57.535 0.300 . 1 . . . . 51 TYR CA . 10032 1 534 . 1 1 51 51 TYR CB C 13 40.367 0.300 . 1 . . . . 51 TYR CB . 10032 1 535 . 1 1 51 51 TYR CD1 C 13 133.987 0.300 . 1 . . . . 51 TYR CD1 . 10032 1 536 . 1 1 51 51 TYR CD2 C 13 133.987 0.300 . 1 . . . . 51 TYR CD2 . 10032 1 537 . 1 1 51 51 TYR CE1 C 13 117.850 0.300 . 1 . . . . 51 TYR CE1 . 10032 1 538 . 1 1 51 51 TYR CE2 C 13 117.850 0.300 . 1 . . . . 51 TYR CE2 . 10032 1 539 . 1 1 51 51 TYR N N 15 119.796 0.300 . 1 . . . . 51 TYR N . 10032 1 540 . 1 1 52 52 SER H H 1 8.615 0.030 . 1 . . . . 52 SER H . 10032 1 541 . 1 1 52 52 SER HA H 1 4.622 0.030 . 1 . . . . 52 SER HA . 10032 1 542 . 1 1 52 52 SER HB2 H 1 4.273 0.030 . 2 . . . . 52 SER HB2 . 10032 1 543 . 1 1 52 52 SER HB3 H 1 4.071 0.030 . 2 . . . . 52 SER HB3 . 10032 1 544 . 1 1 52 52 SER C C 13 176.083 0.300 . 1 . . . . 52 SER C . 10032 1 545 . 1 1 52 52 SER CA C 13 58.789 0.300 . 1 . . . . 52 SER CA . 10032 1 546 . 1 1 52 52 SER CB C 13 63.552 0.300 . 1 . . . . 52 SER CB . 10032 1 547 . 1 1 52 52 SER N N 15 112.939 0.300 . 1 . . . . 52 SER N . 10032 1 548 . 1 1 53 53 ASP H H 1 8.881 0.030 . 1 . . . . 53 ASP H . 10032 1 549 . 1 1 53 53 ASP HA H 1 4.809 0.030 . 1 . . . . 53 ASP HA . 10032 1 550 . 1 1 53 53 ASP HB2 H 1 2.779 0.030 . 2 . . . . 53 ASP HB2 . 10032 1 551 . 1 1 53 53 ASP HB3 H 1 2.826 0.030 . 2 . . . . 53 ASP HB3 . 10032 1 552 . 1 1 53 53 ASP C C 13 178.043 0.300 . 1 . . . . 53 ASP C . 10032 1 553 . 1 1 53 53 ASP CA C 13 55.762 0.300 . 1 . . . . 53 ASP CA . 10032 1 554 . 1 1 53 53 ASP CB C 13 39.994 0.300 . 1 . . . . 53 ASP CB . 10032 1 555 . 1 1 53 53 ASP N N 15 125.683 0.300 . 1 . . . . 53 ASP N . 10032 1 556 . 1 1 54 54 CYS H H 1 8.341 0.030 . 1 . . . . 54 CYS H . 10032 1 557 . 1 1 54 54 CYS HA H 1 4.326 0.030 . 1 . . . . 54 CYS HA . 10032 1 558 . 1 1 54 54 CYS HB2 H 1 2.830 0.030 . 2 . . . . 54 CYS HB2 . 10032 1 559 . 1 1 54 54 CYS HB3 H 1 2.640 0.030 . 2 . . . . 54 CYS HB3 . 10032 1 560 . 1 1 54 54 CYS C C 13 175.353 0.300 . 1 . . . . 54 CYS C . 10032 1 561 . 1 1 54 54 CYS CA C 13 60.309 0.300 . 1 . . . . 54 CYS CA . 10032 1 562 . 1 1 54 54 CYS CB C 13 26.599 0.300 . 1 . . . . 54 CYS CB . 10032 1 563 . 1 1 54 54 CYS N N 15 118.536 0.300 . 1 . . . . 54 CYS N . 10032 1 564 . 1 1 55 55 TYR H H 1 7.058 0.030 . 1 . . . . 55 TYR H . 10032 1 565 . 1 1 55 55 TYR HA H 1 4.777 0.030 . 1 . . . . 55 TYR HA . 10032 1 566 . 1 1 55 55 TYR HB2 H 1 3.153 0.030 . 2 . . . . 55 TYR HB2 . 10032 1 567 . 1 1 55 55 TYR HB3 H 1 3.427 0.030 . 2 . . . . 55 TYR HB3 . 10032 1 568 . 1 1 55 55 TYR HD1 H 1 7.222 0.030 . 1 . . . . 55 TYR HD1 . 10032 1 569 . 1 1 55 55 TYR HD2 H 1 7.222 0.030 . 1 . . . . 55 TYR HD2 . 10032 1 570 . 1 1 55 55 TYR HE1 H 1 6.895 0.030 . 1 . . . . 55 TYR HE1 . 10032 1 571 . 1 1 55 55 TYR HE2 H 1 6.895 0.030 . 1 . . . . 55 TYR HE2 . 10032 1 572 . 1 1 55 55 TYR C C 13 174.755 0.300 . 1 . . . . 55 TYR C . 10032 1 573 . 1 1 55 55 TYR CA C 13 57.748 0.300 . 1 . . . . 55 TYR CA . 10032 1 574 . 1 1 55 55 TYR CB C 13 38.242 0.300 . 1 . . . . 55 TYR CB . 10032 1 575 . 1 1 55 55 TYR CD1 C 13 133.168 0.300 . 1 . . . . 55 TYR CD1 . 10032 1 576 . 1 1 55 55 TYR CD2 C 13 133.168 0.300 . 1 . . . . 55 TYR CD2 . 10032 1 577 . 1 1 55 55 TYR CE1 C 13 118.513 0.300 . 1 . . . . 55 TYR CE1 . 10032 1 578 . 1 1 55 55 TYR CE2 C 13 118.513 0.300 . 1 . . . . 55 TYR CE2 . 10032 1 579 . 1 1 55 55 TYR N N 15 118.811 0.300 . 1 . . . . 55 TYR N . 10032 1 580 . 1 1 56 56 ASP H H 1 7.721 0.030 . 1 . . . . 56 ASP H . 10032 1 581 . 1 1 56 56 ASP HA H 1 5.143 0.030 . 1 . . . . 56 ASP HA . 10032 1 582 . 1 1 56 56 ASP HB2 H 1 2.731 0.030 . 2 . . . . 56 ASP HB2 . 10032 1 583 . 1 1 56 56 ASP HB3 H 1 2.226 0.030 . 2 . . . . 56 ASP HB3 . 10032 1 584 . 1 1 56 56 ASP C C 13 176.341 0.300 . 1 . . . . 56 ASP C . 10032 1 585 . 1 1 56 56 ASP CA C 13 55.656 0.300 . 1 . . . . 56 ASP CA . 10032 1 586 . 1 1 56 56 ASP CB C 13 40.562 0.300 . 1 . . . . 56 ASP CB . 10032 1 587 . 1 1 56 56 ASP N N 15 120.698 0.300 . 1 . . . . 56 ASP N . 10032 1 588 . 1 1 57 57 PHE H H 1 8.338 0.030 . 1 . . . . 57 PHE H . 10032 1 589 . 1 1 57 57 PHE HA H 1 5.224 0.030 . 1 . . . . 57 PHE HA . 10032 1 590 . 1 1 57 57 PHE HB2 H 1 3.176 0.030 . 2 . . . . 57 PHE HB2 . 10032 1 591 . 1 1 57 57 PHE HB3 H 1 3.119 0.030 . 2 . . . . 57 PHE HB3 . 10032 1 592 . 1 1 57 57 PHE HD1 H 1 7.302 0.030 . 1 . . . . 57 PHE HD1 . 10032 1 593 . 1 1 57 57 PHE HD2 H 1 7.302 0.030 . 1 . . . . 57 PHE HD2 . 10032 1 594 . 1 1 57 57 PHE HE1 H 1 6.710 0.030 . 1 . . . . 57 PHE HE1 . 10032 1 595 . 1 1 57 57 PHE HE2 H 1 6.710 0.030 . 1 . . . . 57 PHE HE2 . 10032 1 596 . 1 1 57 57 PHE HZ H 1 6.814 0.030 . 1 . . . . 57 PHE HZ . 10032 1 597 . 1 1 57 57 PHE C C 13 171.896 0.300 . 1 . . . . 57 PHE C . 10032 1 598 . 1 1 57 57 PHE CA C 13 55.437 0.300 . 1 . . . . 57 PHE CA . 10032 1 599 . 1 1 57 57 PHE CB C 13 41.905 0.300 . 1 . . . . 57 PHE CB . 10032 1 600 . 1 1 57 57 PHE CD1 C 13 132.759 0.300 . 1 . . . . 57 PHE CD1 . 10032 1 601 . 1 1 57 57 PHE CD2 C 13 132.759 0.300 . 1 . . . . 57 PHE CD2 . 10032 1 602 . 1 1 57 57 PHE CE1 C 13 131.319 0.300 . 1 . . . . 57 PHE CE1 . 10032 1 603 . 1 1 57 57 PHE CE2 C 13 131.319 0.300 . 1 . . . . 57 PHE CE2 . 10032 1 604 . 1 1 57 57 PHE CZ C 13 129.606 0.300 . 1 . . . . 57 PHE CZ . 10032 1 605 . 1 1 57 57 PHE N N 15 117.734 0.300 . 1 . . . . 57 PHE N . 10032 1 606 . 1 1 58 58 TRP H H 1 8.843 0.030 . 1 . . . . 58 TRP H . 10032 1 607 . 1 1 58 58 TRP HA H 1 5.383 0.030 . 1 . . . . 58 TRP HA . 10032 1 608 . 1 1 58 58 TRP HB2 H 1 2.917 0.030 . 2 . . . . 58 TRP HB2 . 10032 1 609 . 1 1 58 58 TRP HB3 H 1 3.054 0.030 . 2 . . . . 58 TRP HB3 . 10032 1 610 . 1 1 58 58 TRP HD1 H 1 7.337 0.030 . 1 . . . . 58 TRP HD1 . 10032 1 611 . 1 1 58 58 TRP HE1 H 1 10.307 0.030 . 1 . . . . 58 TRP HE1 . 10032 1 612 . 1 1 58 58 TRP HE3 H 1 7.246 0.030 . 1 . . . . 58 TRP HE3 . 10032 1 613 . 1 1 58 58 TRP HZ2 H 1 7.394 0.030 . 1 . . . . 58 TRP HZ2 . 10032 1 614 . 1 1 58 58 TRP HZ3 H 1 6.526 0.030 . 1 . . . . 58 TRP HZ3 . 10032 1 615 . 1 1 58 58 TRP HH2 H 1 6.871 0.030 . 1 . . . . 58 TRP HH2 . 10032 1 616 . 1 1 58 58 TRP C C 13 177.235 0.300 . 1 . . . . 58 TRP C . 10032 1 617 . 1 1 58 58 TRP CA C 13 56.447 0.300 . 1 . . . . 58 TRP CA . 10032 1 618 . 1 1 58 58 TRP CB C 13 32.022 0.300 . 1 . . . . 58 TRP CB . 10032 1 619 . 1 1 58 58 TRP CD1 C 13 127.754 0.300 . 1 . . . . 58 TRP CD1 . 10032 1 620 . 1 1 58 58 TRP CE3 C 13 120.998 0.300 . 1 . . . . 58 TRP CE3 . 10032 1 621 . 1 1 58 58 TRP CZ2 C 13 115.159 0.300 . 1 . . . . 58 TRP CZ2 . 10032 1 622 . 1 1 58 58 TRP CZ3 C 13 120.969 0.300 . 1 . . . . 58 TRP CZ3 . 10032 1 623 . 1 1 58 58 TRP CH2 C 13 123.770 0.300 . 1 . . . . 58 TRP CH2 . 10032 1 624 . 1 1 58 58 TRP N N 15 120.580 0.300 . 1 . . . . 58 TRP N . 10032 1 625 . 1 1 58 58 TRP NE1 N 15 129.710 0.300 . 1 . . . . 58 TRP NE1 . 10032 1 626 . 1 1 59 59 VAL H H 1 9.195 0.030 . 1 . . . . 59 VAL H . 10032 1 627 . 1 1 59 59 VAL HA H 1 4.729 0.030 . 1 . . . . 59 VAL HA . 10032 1 628 . 1 1 59 59 VAL HB H 1 2.348 0.030 . 1 . . . . 59 VAL HB . 10032 1 629 . 1 1 59 59 VAL HG11 H 1 1.050 0.030 . 1 . . . . 59 VAL HG1 . 10032 1 630 . 1 1 59 59 VAL HG12 H 1 1.050 0.030 . 1 . . . . 59 VAL HG1 . 10032 1 631 . 1 1 59 59 VAL HG13 H 1 1.050 0.030 . 1 . . . . 59 VAL HG1 . 10032 1 632 . 1 1 59 59 VAL HG21 H 1 0.651 0.030 . 1 . . . . 59 VAL HG2 . 10032 1 633 . 1 1 59 59 VAL HG22 H 1 0.651 0.030 . 1 . . . . 59 VAL HG2 . 10032 1 634 . 1 1 59 59 VAL HG23 H 1 0.651 0.030 . 1 . . . . 59 VAL HG2 . 10032 1 635 . 1 1 59 59 VAL C C 13 174.937 0.300 . 1 . . . . 59 VAL C . 10032 1 636 . 1 1 59 59 VAL CA C 13 59.439 0.300 . 1 . . . . 59 VAL CA . 10032 1 637 . 1 1 59 59 VAL CB C 13 36.615 0.300 . 1 . . . . 59 VAL CB . 10032 1 638 . 1 1 59 59 VAL CG1 C 13 22.921 0.300 . 2 . . . . 59 VAL CG1 . 10032 1 639 . 1 1 59 59 VAL CG2 C 13 19.716 0.300 . 2 . . . . 59 VAL CG2 . 10032 1 640 . 1 1 59 59 VAL N N 15 114.281 0.300 . 1 . . . . 59 VAL N . 10032 1 641 . 1 1 60 60 ASN H H 1 8.621 0.030 . 1 . . . . 60 ASN H . 10032 1 642 . 1 1 60 60 ASN HA H 1 5.041 0.030 . 1 . . . . 60 ASN HA . 10032 1 643 . 1 1 60 60 ASN HB2 H 1 3.070 0.030 . 2 . . . . 60 ASN HB2 . 10032 1 644 . 1 1 60 60 ASN HB3 H 1 2.810 0.030 . 2 . . . . 60 ASN HB3 . 10032 1 645 . 1 1 60 60 ASN HD21 H 1 7.984 0.030 . 2 . . . . 60 ASN HD21 . 10032 1 646 . 1 1 60 60 ASN HD22 H 1 6.970 0.030 . 2 . . . . 60 ASN HD22 . 10032 1 647 . 1 1 60 60 ASN C C 13 176.799 0.300 . 1 . . . . 60 ASN C . 10032 1 648 . 1 1 60 60 ASN CA C 13 53.136 0.300 . 1 . . . . 60 ASN CA . 10032 1 649 . 1 1 60 60 ASN CB C 13 39.129 0.300 . 1 . . . . 60 ASN CB . 10032 1 650 . 1 1 60 60 ASN N N 15 119.796 0.300 . 1 . . . . 60 ASN N . 10032 1 651 . 1 1 60 60 ASN ND2 N 15 112.884 0.300 . 1 . . . . 60 ASN ND2 . 10032 1 652 . 1 1 61 61 ALA H H 1 8.430 0.030 . 1 . . . . 61 ALA H . 10032 1 653 . 1 1 61 61 ALA HA H 1 3.708 0.030 . 1 . . . . 61 ALA HA . 10032 1 654 . 1 1 61 61 ALA HB1 H 1 1.057 0.030 . 1 . . . . 61 ALA HB . 10032 1 655 . 1 1 61 61 ALA HB2 H 1 1.057 0.030 . 1 . . . . 61 ALA HB . 10032 1 656 . 1 1 61 61 ALA HB3 H 1 1.057 0.030 . 1 . . . . 61 ALA HB . 10032 1 657 . 1 1 61 61 ALA C C 13 176.146 0.300 . 1 . . . . 61 ALA C . 10032 1 658 . 1 1 61 61 ALA CA C 13 54.302 0.300 . 1 . . . . 61 ALA CA . 10032 1 659 . 1 1 61 61 ALA CB C 13 17.287 0.300 . 1 . . . . 61 ALA CB . 10032 1 660 . 1 1 61 61 ALA N N 15 120.422 0.300 . 1 . . . . 61 ALA N . 10032 1 661 . 1 1 62 62 ASP H H 1 7.851 0.030 . 1 . . . . 62 ASP H . 10032 1 662 . 1 1 62 62 ASP HA H 1 4.720 0.030 . 1 . . . . 62 ASP HA . 10032 1 663 . 1 1 62 62 ASP HB2 H 1 3.079 0.030 . 2 . . . . 62 ASP HB2 . 10032 1 664 . 1 1 62 62 ASP HB3 H 1 2.697 0.030 . 2 . . . . 62 ASP HB3 . 10032 1 665 . 1 1 62 62 ASP C C 13 176.065 0.300 . 1 . . . . 62 ASP C . 10032 1 666 . 1 1 62 62 ASP CA C 13 52.097 0.300 . 1 . . . . 62 ASP CA . 10032 1 667 . 1 1 62 62 ASP CB C 13 39.766 0.300 . 1 . . . . 62 ASP CB . 10032 1 668 . 1 1 62 62 ASP N N 15 114.096 0.300 . 1 . . . . 62 ASP N . 10032 1 669 . 1 1 63 63 ALA H H 1 7.440 0.030 . 1 . . . . 63 ALA H . 10032 1 670 . 1 1 63 63 ALA HA H 1 4.169 0.030 . 1 . . . . 63 ALA HA . 10032 1 671 . 1 1 63 63 ALA HB1 H 1 1.612 0.030 . 1 . . . . 63 ALA HB . 10032 1 672 . 1 1 63 63 ALA HB2 H 1 1.612 0.030 . 1 . . . . 63 ALA HB . 10032 1 673 . 1 1 63 63 ALA HB3 H 1 1.612 0.030 . 1 . . . . 63 ALA HB . 10032 1 674 . 1 1 63 63 ALA C C 13 177.903 0.300 . 1 . . . . 63 ALA C . 10032 1 675 . 1 1 63 63 ALA CA C 13 53.199 0.300 . 1 . . . . 63 ALA CA . 10032 1 676 . 1 1 63 63 ALA CB C 13 18.995 0.300 . 1 . . . . 63 ALA CB . 10032 1 677 . 1 1 63 63 ALA N N 15 121.918 0.300 . 1 . . . . 63 ALA N . 10032 1 678 . 1 1 64 64 LEU H H 1 8.273 0.030 . 1 . . . . 64 LEU H . 10032 1 679 . 1 1 64 64 LEU HA H 1 4.266 0.030 . 1 . . . . 64 LEU HA . 10032 1 680 . 1 1 64 64 LEU HB2 H 1 1.707 0.030 . 2 . . . . 64 LEU HB2 . 10032 1 681 . 1 1 64 64 LEU HB3 H 1 1.640 0.030 . 2 . . . . 64 LEU HB3 . 10032 1 682 . 1 1 64 64 LEU HG H 1 1.848 0.030 . 1 . . . . 64 LEU HG . 10032 1 683 . 1 1 64 64 LEU HD11 H 1 0.974 0.030 . 1 . . . . 64 LEU HD1 . 10032 1 684 . 1 1 64 64 LEU HD12 H 1 0.974 0.030 . 1 . . . . 64 LEU HD1 . 10032 1 685 . 1 1 64 64 LEU HD13 H 1 0.974 0.030 . 1 . . . . 64 LEU HD1 . 10032 1 686 . 1 1 64 64 LEU HD21 H 1 1.017 0.030 . 1 . . . . 64 LEU HD2 . 10032 1 687 . 1 1 64 64 LEU HD22 H 1 1.017 0.030 . 1 . . . . 64 LEU HD2 . 10032 1 688 . 1 1 64 64 LEU HD23 H 1 1.017 0.030 . 1 . . . . 64 LEU HD2 . 10032 1 689 . 1 1 64 64 LEU C C 13 177.887 0.300 . 1 . . . . 64 LEU C . 10032 1 690 . 1 1 64 64 LEU CA C 13 56.106 0.300 . 1 . . . . 64 LEU CA . 10032 1 691 . 1 1 64 64 LEU CB C 13 42.387 0.300 . 1 . . . . 64 LEU CB . 10032 1 692 . 1 1 64 64 LEU CG C 13 27.230 0.300 . 1 . . . . 64 LEU CG . 10032 1 693 . 1 1 64 64 LEU CD1 C 13 23.229 0.300 . 2 . . . . 64 LEU CD1 . 10032 1 694 . 1 1 64 64 LEU CD2 C 13 25.306 0.300 . 2 . . . . 64 LEU CD2 . 10032 1 695 . 1 1 64 64 LEU N N 15 118.281 0.300 . 1 . . . . 64 LEU N . 10032 1 696 . 1 1 65 65 ASP H H 1 7.535 0.030 . 1 . . . . 65 ASP H . 10032 1 697 . 1 1 65 65 ASP HA H 1 4.668 0.030 . 1 . . . . 65 ASP HA . 10032 1 698 . 1 1 65 65 ASP HB2 H 1 2.478 0.030 . 2 . . . . 65 ASP HB2 . 10032 1 699 . 1 1 65 65 ASP HB3 H 1 3.013 0.030 . 2 . . . . 65 ASP HB3 . 10032 1 700 . 1 1 65 65 ASP C C 13 174.428 0.300 . 1 . . . . 65 ASP C . 10032 1 701 . 1 1 65 65 ASP CA C 13 54.205 0.300 . 1 . . . . 65 ASP CA . 10032 1 702 . 1 1 65 65 ASP CB C 13 41.486 0.300 . 1 . . . . 65 ASP CB . 10032 1 703 . 1 1 65 65 ASP N N 15 113.497 0.300 . 1 . . . . 65 ASP N . 10032 1 704 . 1 1 66 66 ILE H H 1 6.418 0.030 . 1 . . . . 66 ILE H . 10032 1 705 . 1 1 66 66 ILE HA H 1 4.793 0.030 . 1 . . . . 66 ILE HA . 10032 1 706 . 1 1 66 66 ILE HB H 1 1.854 0.030 . 1 . . . . 66 ILE HB . 10032 1 707 . 1 1 66 66 ILE HG12 H 1 1.569 0.030 . 2 . . . . 66 ILE HG12 . 10032 1 708 . 1 1 66 66 ILE HG13 H 1 0.978 0.030 . 2 . . . . 66 ILE HG13 . 10032 1 709 . 1 1 66 66 ILE HG21 H 1 0.704 0.030 . 1 . . . . 66 ILE HG2 . 10032 1 710 . 1 1 66 66 ILE HG22 H 1 0.704 0.030 . 1 . . . . 66 ILE HG2 . 10032 1 711 . 1 1 66 66 ILE HG23 H 1 0.704 0.030 . 1 . . . . 66 ILE HG2 . 10032 1 712 . 1 1 66 66 ILE HD11 H 1 0.600 0.030 . 1 . . . . 66 ILE HD1 . 10032 1 713 . 1 1 66 66 ILE HD12 H 1 0.600 0.030 . 1 . . . . 66 ILE HD1 . 10032 1 714 . 1 1 66 66 ILE HD13 H 1 0.600 0.030 . 1 . . . . 66 ILE HD1 . 10032 1 715 . 1 1 66 66 ILE C C 13 172.997 0.300 . 1 . . . . 66 ILE C . 10032 1 716 . 1 1 66 66 ILE CA C 13 59.485 0.300 . 1 . . . . 66 ILE CA . 10032 1 717 . 1 1 66 66 ILE CB C 13 40.666 0.300 . 1 . . . . 66 ILE CB . 10032 1 718 . 1 1 66 66 ILE CG1 C 13 24.502 0.300 . 1 . . . . 66 ILE CG1 . 10032 1 719 . 1 1 66 66 ILE CG2 C 13 18.297 0.300 . 1 . . . . 66 ILE CG2 . 10032 1 720 . 1 1 66 66 ILE CD1 C 13 13.299 0.300 . 1 . . . . 66 ILE CD1 . 10032 1 721 . 1 1 66 66 ILE N N 15 109.248 0.300 . 1 . . . . 66 ILE N . 10032 1 722 . 1 1 67 67 HIS H H 1 9.091 0.030 . 1 . . . . 67 HIS H . 10032 1 723 . 1 1 67 67 HIS HA H 1 4.346 0.030 . 1 . . . . 67 HIS HA . 10032 1 724 . 1 1 67 67 HIS HB2 H 1 2.500 0.030 . 2 . . . . 67 HIS HB2 . 10032 1 725 . 1 1 67 67 HIS HB3 H 1 1.837 0.030 . 2 . . . . 67 HIS HB3 . 10032 1 726 . 1 1 67 67 HIS HD2 H 1 5.385 0.030 . 1 . . . . 67 HIS HD2 . 10032 1 727 . 1 1 67 67 HIS HE1 H 1 8.038 0.030 . 1 . . . . 67 HIS HE1 . 10032 1 728 . 1 1 67 67 HIS C C 13 169.065 0.300 . 1 . . . . 67 HIS C . 10032 1 729 . 1 1 67 67 HIS CA C 13 52.737 0.300 . 1 . . . . 67 HIS CA . 10032 1 730 . 1 1 67 67 HIS CB C 13 31.504 0.300 . 1 . . . . 67 HIS CB . 10032 1 731 . 1 1 67 67 HIS CD2 C 13 117.693 0.300 . 1 . . . . 67 HIS CD2 . 10032 1 732 . 1 1 67 67 HIS CE1 C 13 136.474 0.300 . 1 . . . . 67 HIS CE1 . 10032 1 733 . 1 1 67 67 HIS N N 15 117.847 0.300 . 1 . . . . 67 HIS N . 10032 1 734 . 1 1 68 68 PRO HA H 1 4.525 0.030 . 1 . . . . 68 PRO HA . 10032 1 735 . 1 1 68 68 PRO HB2 H 1 1.810 0.030 . 1 . . . . 68 PRO HB2 . 10032 1 736 . 1 1 68 68 PRO HB3 H 1 1.810 0.030 . 1 . . . . 68 PRO HB3 . 10032 1 737 . 1 1 68 68 PRO HG2 H 1 1.725 0.030 . 2 . . . . 68 PRO HG2 . 10032 1 738 . 1 1 68 68 PRO HG3 H 1 1.899 0.030 . 2 . . . . 68 PRO HG3 . 10032 1 739 . 1 1 68 68 PRO HD2 H 1 3.261 0.030 . 2 . . . . 68 PRO HD2 . 10032 1 740 . 1 1 68 68 PRO HD3 H 1 2.608 0.030 . 2 . . . . 68 PRO HD3 . 10032 1 741 . 1 1 68 68 PRO CA C 13 60.900 0.300 . 1 . . . . 68 PRO CA . 10032 1 742 . 1 1 68 68 PRO CB C 13 31.371 0.300 . 1 . . . . 68 PRO CB . 10032 1 743 . 1 1 68 68 PRO CG C 13 26.814 0.300 . 1 . . . . 68 PRO CG . 10032 1 744 . 1 1 68 68 PRO CD C 13 49.611 0.300 . 1 . . . . 68 PRO CD . 10032 1 745 . 1 1 69 69 VAL H H 1 8.415 0.030 . 1 . . . . 69 VAL H . 10032 1 746 . 1 1 69 69 VAL HA H 1 3.033 0.030 . 1 . . . . 69 VAL HA . 10032 1 747 . 1 1 69 69 VAL HB H 1 1.037 0.030 . 1 . . . . 69 VAL HB . 10032 1 748 . 1 1 69 69 VAL HG11 H 1 -0.286 0.030 . 1 . . . . 69 VAL HG1 . 10032 1 749 . 1 1 69 69 VAL HG12 H 1 -0.286 0.030 . 1 . . . . 69 VAL HG1 . 10032 1 750 . 1 1 69 69 VAL HG13 H 1 -0.286 0.030 . 1 . . . . 69 VAL HG1 . 10032 1 751 . 1 1 69 69 VAL HG21 H 1 -0.089 0.030 . 1 . . . . 69 VAL HG2 . 10032 1 752 . 1 1 69 69 VAL HG22 H 1 -0.089 0.030 . 1 . . . . 69 VAL HG2 . 10032 1 753 . 1 1 69 69 VAL HG23 H 1 -0.089 0.030 . 1 . . . . 69 VAL HG2 . 10032 1 754 . 1 1 69 69 VAL CA C 13 64.737 0.300 . 1 . . . . 69 VAL CA . 10032 1 755 . 1 1 69 69 VAL CB C 13 31.515 0.300 . 1 . . . . 69 VAL CB . 10032 1 756 . 1 1 69 69 VAL CG1 C 13 19.145 0.300 . 2 . . . . 69 VAL CG1 . 10032 1 757 . 1 1 69 69 VAL CG2 C 13 20.399 0.300 . 2 . . . . 69 VAL CG2 . 10032 1 758 . 1 1 69 69 VAL N N 15 115.906 0.300 . 1 . . . . 69 VAL N . 10032 1 759 . 1 1 70 70 GLY H H 1 8.820 0.030 . 1 . . . . 70 GLY H . 10032 1 760 . 1 1 70 70 GLY HA2 H 1 4.390 0.030 . 2 . . . . 70 GLY HA2 . 10032 1 761 . 1 1 70 70 GLY HA3 H 1 4.017 0.030 . 2 . . . . 70 GLY HA3 . 10032 1 762 . 1 1 70 70 GLY C C 13 174.737 0.300 . 1 . . . . 70 GLY C . 10032 1 763 . 1 1 70 70 GLY CA C 13 45.042 0.300 . 1 . . . . 70 GLY CA . 10032 1 764 . 1 1 70 70 GLY N N 15 117.148 0.300 . 1 . . . . 70 GLY N . 10032 1 765 . 1 1 71 71 TRP H H 1 8.432 0.030 . 1 . . . . 71 TRP H . 10032 1 766 . 1 1 71 71 TRP HA H 1 3.952 0.030 . 1 . . . . 71 TRP HA . 10032 1 767 . 1 1 71 71 TRP HB2 H 1 3.110 0.030 . 2 . . . . 71 TRP HB2 . 10032 1 768 . 1 1 71 71 TRP HB3 H 1 3.379 0.030 . 2 . . . . 71 TRP HB3 . 10032 1 769 . 1 1 71 71 TRP HD1 H 1 7.193 0.030 . 1 . . . . 71 TRP HD1 . 10032 1 770 . 1 1 71 71 TRP HE1 H 1 9.912 0.030 . 1 . . . . 71 TRP HE1 . 10032 1 771 . 1 1 71 71 TRP HE3 H 1 7.102 0.030 . 1 . . . . 71 TRP HE3 . 10032 1 772 . 1 1 71 71 TRP HZ2 H 1 6.927 0.030 . 1 . . . . 71 TRP HZ2 . 10032 1 773 . 1 1 71 71 TRP HZ3 H 1 5.105 0.030 . 1 . . . . 71 TRP HZ3 . 10032 1 774 . 1 1 71 71 TRP HH2 H 1 5.963 0.030 . 1 . . . . 71 TRP HH2 . 10032 1 775 . 1 1 71 71 TRP C C 13 180.065 0.300 . 1 . . . . 71 TRP C . 10032 1 776 . 1 1 71 71 TRP CA C 13 62.967 0.300 . 1 . . . . 71 TRP CA . 10032 1 777 . 1 1 71 71 TRP CB C 13 29.626 0.300 . 1 . . . . 71 TRP CB . 10032 1 778 . 1 1 71 71 TRP CD1 C 13 125.774 0.300 . 1 . . . . 71 TRP CD1 . 10032 1 779 . 1 1 71 71 TRP CE3 C 13 120.053 0.300 . 1 . . . . 71 TRP CE3 . 10032 1 780 . 1 1 71 71 TRP CZ2 C 13 113.648 0.300 . 1 . . . . 71 TRP CZ2 . 10032 1 781 . 1 1 71 71 TRP CZ3 C 13 122.181 0.300 . 1 . . . . 71 TRP CZ3 . 10032 1 782 . 1 1 71 71 TRP CH2 C 13 123.921 0.300 . 1 . . . . 71 TRP CH2 . 10032 1 783 . 1 1 71 71 TRP N N 15 126.706 0.300 . 1 . . . . 71 TRP N . 10032 1 784 . 1 1 71 71 TRP NE1 N 15 129.710 0.300 . 1 . . . . 71 TRP NE1 . 10032 1 785 . 1 1 72 72 CYS H H 1 11.848 0.030 . 1 . . . . 72 CYS H . 10032 1 786 . 1 1 72 72 CYS HA H 1 3.427 0.030 . 1 . . . . 72 CYS HA . 10032 1 787 . 1 1 72 72 CYS HB2 H 1 3.166 0.030 . 2 . . . . 72 CYS HB2 . 10032 1 788 . 1 1 72 72 CYS HB3 H 1 2.850 0.030 . 2 . . . . 72 CYS HB3 . 10032 1 789 . 1 1 72 72 CYS C C 13 177.021 0.300 . 1 . . . . 72 CYS C . 10032 1 790 . 1 1 72 72 CYS CA C 13 66.942 0.300 . 1 . . . . 72 CYS CA . 10032 1 791 . 1 1 72 72 CYS CB C 13 25.874 0.300 . 1 . . . . 72 CYS CB . 10032 1 792 . 1 1 72 72 CYS N N 15 125.942 0.300 . 1 . . . . 72 CYS N . 10032 1 793 . 1 1 73 73 GLU H H 1 8.665 0.030 . 1 . . . . 73 GLU H . 10032 1 794 . 1 1 73 73 GLU HA H 1 3.991 0.030 . 1 . . . . 73 GLU HA . 10032 1 795 . 1 1 73 73 GLU HB2 H 1 2.069 0.030 . 2 . . . . 73 GLU HB2 . 10032 1 796 . 1 1 73 73 GLU HB3 H 1 2.222 0.030 . 2 . . . . 73 GLU HB3 . 10032 1 797 . 1 1 73 73 GLU HG2 H 1 2.221 0.030 . 2 . . . . 73 GLU HG2 . 10032 1 798 . 1 1 73 73 GLU HG3 H 1 2.350 0.030 . 2 . . . . 73 GLU HG3 . 10032 1 799 . 1 1 73 73 GLU C C 13 179.052 0.300 . 1 . . . . 73 GLU C . 10032 1 800 . 1 1 73 73 GLU CA C 13 58.928 0.300 . 1 . . . . 73 GLU CA . 10032 1 801 . 1 1 73 73 GLU CB C 13 29.539 0.300 . 1 . . . . 73 GLU CB . 10032 1 802 . 1 1 73 73 GLU CG C 13 35.983 0.300 . 1 . . . . 73 GLU CG . 10032 1 803 . 1 1 73 73 GLU N N 15 120.458 0.300 . 1 . . . . 73 GLU N . 10032 1 804 . 1 1 74 74 LYS H H 1 7.816 0.030 . 1 . . . . 74 LYS H . 10032 1 805 . 1 1 74 74 LYS HA H 1 4.059 0.030 . 1 . . . . 74 LYS HA . 10032 1 806 . 1 1 74 74 LYS HB2 H 1 1.806 0.030 . 1 . . . . 74 LYS HB2 . 10032 1 807 . 1 1 74 74 LYS HB3 H 1 1.806 0.030 . 1 . . . . 74 LYS HB3 . 10032 1 808 . 1 1 74 74 LYS HG2 H 1 1.402 0.030 . 2 . . . . 74 LYS HG2 . 10032 1 809 . 1 1 74 74 LYS HG3 H 1 1.478 0.030 . 2 . . . . 74 LYS HG3 . 10032 1 810 . 1 1 74 74 LYS HD2 H 1 1.630 0.030 . 1 . . . . 74 LYS HD2 . 10032 1 811 . 1 1 74 74 LYS HD3 H 1 1.630 0.030 . 1 . . . . 74 LYS HD3 . 10032 1 812 . 1 1 74 74 LYS HE2 H 1 2.953 0.030 . 1 . . . . 74 LYS HE2 . 10032 1 813 . 1 1 74 74 LYS HE3 H 1 2.953 0.030 . 1 . . . . 74 LYS HE3 . 10032 1 814 . 1 1 74 74 LYS C C 13 178.296 0.300 . 1 . . . . 74 LYS C . 10032 1 815 . 1 1 74 74 LYS CA C 13 58.387 0.300 . 1 . . . . 74 LYS CA . 10032 1 816 . 1 1 74 74 LYS CB C 13 32.951 0.300 . 1 . . . . 74 LYS CB . 10032 1 817 . 1 1 74 74 LYS CG C 13 24.891 0.300 . 1 . . . . 74 LYS CG . 10032 1 818 . 1 1 74 74 LYS CD C 13 29.031 0.300 . 1 . . . . 74 LYS CD . 10032 1 819 . 1 1 74 74 LYS CE C 13 42.302 0.300 . 1 . . . . 74 LYS CE . 10032 1 820 . 1 1 74 74 LYS N N 15 118.017 0.300 . 1 . . . . 74 LYS N . 10032 1 821 . 1 1 75 75 THR H H 1 7.688 0.030 . 1 . . . . 75 THR H . 10032 1 822 . 1 1 75 75 THR HA H 1 4.062 0.030 . 1 . . . . 75 THR HA . 10032 1 823 . 1 1 75 75 THR HB H 1 3.823 0.030 . 1 . . . . 75 THR HB . 10032 1 824 . 1 1 75 75 THR HG21 H 1 0.378 0.030 . 1 . . . . 75 THR HG2 . 10032 1 825 . 1 1 75 75 THR HG22 H 1 0.378 0.030 . 1 . . . . 75 THR HG2 . 10032 1 826 . 1 1 75 75 THR HG23 H 1 0.378 0.030 . 1 . . . . 75 THR HG2 . 10032 1 827 . 1 1 75 75 THR C C 13 175.038 0.300 . 1 . . . . 75 THR C . 10032 1 828 . 1 1 75 75 THR CA C 13 61.784 0.300 . 1 . . . . 75 THR CA . 10032 1 829 . 1 1 75 75 THR CB C 13 70.555 0.300 . 1 . . . . 75 THR CB . 10032 1 830 . 1 1 75 75 THR CG2 C 13 19.335 0.300 . 1 . . . . 75 THR CG2 . 10032 1 831 . 1 1 75 75 THR N N 15 106.478 0.300 . 1 . . . . 75 THR N . 10032 1 832 . 1 1 76 76 GLY H H 1 7.606 0.030 . 1 . . . . 76 GLY H . 10032 1 833 . 1 1 76 76 GLY HA2 H 1 3.857 0.030 . 2 . . . . 76 GLY HA2 . 10032 1 834 . 1 1 76 76 GLY HA3 H 1 3.724 0.030 . 2 . . . . 76 GLY HA3 . 10032 1 835 . 1 1 76 76 GLY C C 13 174.987 0.300 . 1 . . . . 76 GLY C . 10032 1 836 . 1 1 76 76 GLY CA C 13 46.380 0.300 . 1 . . . . 76 GLY CA . 10032 1 837 . 1 1 76 76 GLY N N 15 110.500 0.300 . 1 . . . . 76 GLY N . 10032 1 838 . 1 1 77 77 HIS H H 1 7.948 0.030 . 1 . . . . 77 HIS H . 10032 1 839 . 1 1 77 77 HIS HA H 1 4.616 0.030 . 1 . . . . 77 HIS HA . 10032 1 840 . 1 1 77 77 HIS HB2 H 1 3.090 0.030 . 2 . . . . 77 HIS HB2 . 10032 1 841 . 1 1 77 77 HIS HB3 H 1 2.306 0.030 . 2 . . . . 77 HIS HB3 . 10032 1 842 . 1 1 77 77 HIS HD2 H 1 7.302 0.030 . 1 . . . . 77 HIS HD2 . 10032 1 843 . 1 1 77 77 HIS HE1 H 1 8.174 0.030 . 1 . . . . 77 HIS HE1 . 10032 1 844 . 1 1 77 77 HIS C C 13 173.783 0.300 . 1 . . . . 77 HIS C . 10032 1 845 . 1 1 77 77 HIS CA C 13 56.534 0.300 . 1 . . . . 77 HIS CA . 10032 1 846 . 1 1 77 77 HIS CB C 13 32.018 0.300 . 1 . . . . 77 HIS CB . 10032 1 847 . 1 1 77 77 HIS CD2 C 13 122.092 0.300 . 1 . . . . 77 HIS CD2 . 10032 1 848 . 1 1 77 77 HIS CE1 C 13 136.866 0.300 . 1 . . . . 77 HIS CE1 . 10032 1 849 . 1 1 77 77 HIS N N 15 117.849 0.300 . 1 . . . . 77 HIS N . 10032 1 850 . 1 1 78 78 LYS H H 1 8.981 0.030 . 1 . . . . 78 LYS H . 10032 1 851 . 1 1 78 78 LYS HA H 1 4.199 0.030 . 1 . . . . 78 LYS HA . 10032 1 852 . 1 1 78 78 LYS HB2 H 1 1.903 0.030 . 2 . . . . 78 LYS HB2 . 10032 1 853 . 1 1 78 78 LYS HB3 H 1 1.837 0.030 . 2 . . . . 78 LYS HB3 . 10032 1 854 . 1 1 78 78 LYS HG2 H 1 1.171 0.030 . 2 . . . . 78 LYS HG2 . 10032 1 855 . 1 1 78 78 LYS HG3 H 1 1.341 0.030 . 2 . . . . 78 LYS HG3 . 10032 1 856 . 1 1 78 78 LYS HD2 H 1 1.656 0.030 . 1 . . . . 78 LYS HD2 . 10032 1 857 . 1 1 78 78 LYS HD3 H 1 1.656 0.030 . 1 . . . . 78 LYS HD3 . 10032 1 858 . 1 1 78 78 LYS HE2 H 1 2.846 0.030 . 1 . . . . 78 LYS HE2 . 10032 1 859 . 1 1 78 78 LYS HE3 H 1 2.846 0.030 . 1 . . . . 78 LYS HE3 . 10032 1 860 . 1 1 78 78 LYS C C 13 174.472 0.300 . 1 . . . . 78 LYS C . 10032 1 861 . 1 1 78 78 LYS CA C 13 56.163 0.300 . 1 . . . . 78 LYS CA . 10032 1 862 . 1 1 78 78 LYS CB C 13 32.842 0.300 . 1 . . . . 78 LYS CB . 10032 1 863 . 1 1 78 78 LYS CG C 13 24.742 0.300 . 1 . . . . 78 LYS CG . 10032 1 864 . 1 1 78 78 LYS CD C 13 28.810 0.300 . 1 . . . . 78 LYS CD . 10032 1 865 . 1 1 78 78 LYS CE C 13 42.000 0.300 . 1 . . . . 78 LYS CE . 10032 1 866 . 1 1 78 78 LYS N N 15 123.682 0.300 . 1 . . . . 78 LYS N . 10032 1 867 . 1 1 79 79 LEU H H 1 8.433 0.030 . 1 . . . . 79 LEU H . 10032 1 868 . 1 1 79 79 LEU HA H 1 4.734 0.030 . 1 . . . . 79 LEU HA . 10032 1 869 . 1 1 79 79 LEU HB2 H 1 1.791 0.030 . 2 . . . . 79 LEU HB2 . 10032 1 870 . 1 1 79 79 LEU HB3 H 1 1.427 0.030 . 2 . . . . 79 LEU HB3 . 10032 1 871 . 1 1 79 79 LEU HG H 1 1.655 0.030 . 1 . . . . 79 LEU HG . 10032 1 872 . 1 1 79 79 LEU HD11 H 1 0.923 0.030 . 1 . . . . 79 LEU HD1 . 10032 1 873 . 1 1 79 79 LEU HD12 H 1 0.923 0.030 . 1 . . . . 79 LEU HD1 . 10032 1 874 . 1 1 79 79 LEU HD13 H 1 0.923 0.030 . 1 . . . . 79 LEU HD1 . 10032 1 875 . 1 1 79 79 LEU HD21 H 1 0.889 0.030 . 1 . . . . 79 LEU HD2 . 10032 1 876 . 1 1 79 79 LEU HD22 H 1 0.889 0.030 . 1 . . . . 79 LEU HD2 . 10032 1 877 . 1 1 79 79 LEU HD23 H 1 0.889 0.030 . 1 . . . . 79 LEU HD2 . 10032 1 878 . 1 1 79 79 LEU C C 13 176.440 0.300 . 1 . . . . 79 LEU C . 10032 1 879 . 1 1 79 79 LEU CA C 13 53.487 0.300 . 1 . . . . 79 LEU CA . 10032 1 880 . 1 1 79 79 LEU CB C 13 43.692 0.300 . 1 . . . . 79 LEU CB . 10032 1 881 . 1 1 79 79 LEU CG C 13 28.817 0.300 . 1 . . . . 79 LEU CG . 10032 1 882 . 1 1 79 79 LEU CD1 C 13 23.149 0.300 . 2 . . . . 79 LEU CD1 . 10032 1 883 . 1 1 79 79 LEU CD2 C 13 27.347 0.300 . 2 . . . . 79 LEU CD2 . 10032 1 884 . 1 1 79 79 LEU N N 15 128.683 0.300 . 1 . . . . 79 LEU N . 10032 1 885 . 1 1 80 80 HIS H H 1 9.589 0.030 . 1 . . . . 80 HIS H . 10032 1 886 . 1 1 80 80 HIS HA H 1 4.762 0.030 . 1 . . . . 80 HIS HA . 10032 1 887 . 1 1 80 80 HIS HB2 H 1 3.356 0.030 . 2 . . . . 80 HIS HB2 . 10032 1 888 . 1 1 80 80 HIS HB3 H 1 3.175 0.030 . 2 . . . . 80 HIS HB3 . 10032 1 889 . 1 1 80 80 HIS HD2 H 1 7.322 0.030 . 1 . . . . 80 HIS HD2 . 10032 1 890 . 1 1 80 80 HIS HE1 H 1 8.155 0.030 . 1 . . . . 80 HIS HE1 . 10032 1 891 . 1 1 80 80 HIS C C 13 173.061 0.300 . 1 . . . . 80 HIS C . 10032 1 892 . 1 1 80 80 HIS CA C 13 54.073 0.300 . 1 . . . . 80 HIS CA . 10032 1 893 . 1 1 80 80 HIS CB C 13 28.889 0.300 . 1 . . . . 80 HIS CB . 10032 1 894 . 1 1 80 80 HIS CD2 C 13 121.904 0.300 . 1 . . . . 80 HIS CD2 . 10032 1 895 . 1 1 80 80 HIS CE1 C 13 137.460 0.300 . 1 . . . . 80 HIS CE1 . 10032 1 896 . 1 1 80 80 HIS N N 15 130.316 0.300 . 1 . . . . 80 HIS N . 10032 1 897 . 1 1 81 81 PRO HA H 1 3.553 0.030 . 1 . . . . 81 PRO HA . 10032 1 898 . 1 1 81 81 PRO HB2 H 1 1.535 0.030 . 2 . . . . 81 PRO HB2 . 10032 1 899 . 1 1 81 81 PRO HB3 H 1 1.363 0.030 . 2 . . . . 81 PRO HB3 . 10032 1 900 . 1 1 81 81 PRO HG2 H 1 1.735 0.030 . 2 . . . . 81 PRO HG2 . 10032 1 901 . 1 1 81 81 PRO HG3 H 1 1.583 0.030 . 2 . . . . 81 PRO HG3 . 10032 1 902 . 1 1 81 81 PRO HD2 H 1 3.519 0.030 . 2 . . . . 81 PRO HD2 . 10032 1 903 . 1 1 81 81 PRO HD3 H 1 3.879 0.030 . 2 . . . . 81 PRO HD3 . 10032 1 904 . 1 1 81 81 PRO CA C 13 60.919 0.300 . 1 . . . . 81 PRO CA . 10032 1 905 . 1 1 81 81 PRO CB C 13 30.453 0.300 . 1 . . . . 81 PRO CB . 10032 1 906 . 1 1 81 81 PRO CG C 13 26.738 0.300 . 1 . . . . 81 PRO CG . 10032 1 907 . 1 1 81 81 PRO CD C 13 50.234 0.300 . 1 . . . . 81 PRO CD . 10032 1 908 . 1 1 82 82 PRO HA H 1 4.457 0.030 . 1 . . . . 82 PRO HA . 10032 1 909 . 1 1 82 82 PRO HB2 H 1 1.998 0.030 . 2 . . . . 82 PRO HB2 . 10032 1 910 . 1 1 82 82 PRO HB3 H 1 1.596 0.030 . 2 . . . . 82 PRO HB3 . 10032 1 911 . 1 1 82 82 PRO HG2 H 1 1.646 0.030 . 2 . . . . 82 PRO HG2 . 10032 1 912 . 1 1 82 82 PRO HG3 H 1 1.827 0.030 . 2 . . . . 82 PRO HG3 . 10032 1 913 . 1 1 82 82 PRO HD2 H 1 3.432 0.030 . 1 . . . . 82 PRO HD2 . 10032 1 914 . 1 1 82 82 PRO HD3 H 1 3.432 0.030 . 1 . . . . 82 PRO HD3 . 10032 1 915 . 1 1 82 82 PRO C C 13 175.483 0.300 . 1 . . . . 82 PRO C . 10032 1 916 . 1 1 82 82 PRO CA C 13 62.235 0.300 . 1 . . . . 82 PRO CA . 10032 1 917 . 1 1 82 82 PRO CB C 13 31.548 0.300 . 1 . . . . 82 PRO CB . 10032 1 918 . 1 1 82 82 PRO CG C 13 24.783 0.300 . 1 . . . . 82 PRO CG . 10032 1 919 . 1 1 82 82 PRO CD C 13 50.354 0.300 . 1 . . . . 82 PRO CD . 10032 1 920 . 1 1 83 83 LYS H H 1 6.514 0.030 . 1 . . . . 83 LYS H . 10032 1 921 . 1 1 83 83 LYS HA H 1 3.864 0.030 . 1 . . . . 83 LYS HA . 10032 1 922 . 1 1 83 83 LYS HB2 H 1 1.162 0.030 . 2 . . . . 83 LYS HB2 . 10032 1 923 . 1 1 83 83 LYS HB3 H 1 0.495 0.030 . 2 . . . . 83 LYS HB3 . 10032 1 924 . 1 1 83 83 LYS HG2 H 1 1.115 0.030 . 1 . . . . 83 LYS HG2 . 10032 1 925 . 1 1 83 83 LYS HG3 H 1 1.115 0.030 . 1 . . . . 83 LYS HG3 . 10032 1 926 . 1 1 83 83 LYS HD2 H 1 1.309 0.030 . 2 . . . . 83 LYS HD2 . 10032 1 927 . 1 1 83 83 LYS HD3 H 1 1.205 0.030 . 2 . . . . 83 LYS HD3 . 10032 1 928 . 1 1 83 83 LYS HE2 H 1 2.788 0.030 . 1 . . . . 83 LYS HE2 . 10032 1 929 . 1 1 83 83 LYS HE3 H 1 2.788 0.030 . 1 . . . . 83 LYS HE3 . 10032 1 930 . 1 1 83 83 LYS C C 13 177.096 0.300 . 1 . . . . 83 LYS C . 10032 1 931 . 1 1 83 83 LYS CA C 13 58.613 0.300 . 1 . . . . 83 LYS CA . 10032 1 932 . 1 1 83 83 LYS CB C 13 31.923 0.300 . 1 . . . . 83 LYS CB . 10032 1 933 . 1 1 83 83 LYS CG C 13 24.875 0.300 . 1 . . . . 83 LYS CG . 10032 1 934 . 1 1 83 83 LYS CD C 13 28.970 0.300 . 1 . . . . 83 LYS CD . 10032 1 935 . 1 1 83 83 LYS CE C 13 42.165 0.300 . 1 . . . . 83 LYS CE . 10032 1 936 . 1 1 83 83 LYS N N 15 121.439 0.300 . 1 . . . . 83 LYS N . 10032 1 937 . 1 1 84 84 GLY H H 1 8.822 0.030 . 1 . . . . 84 GLY H . 10032 1 938 . 1 1 84 84 GLY HA2 H 1 3.571 0.030 . 2 . . . . 84 GLY HA2 . 10032 1 939 . 1 1 84 84 GLY HA3 H 1 4.268 0.030 . 2 . . . . 84 GLY HA3 . 10032 1 940 . 1 1 84 84 GLY C C 13 174.297 0.300 . 1 . . . . 84 GLY C . 10032 1 941 . 1 1 84 84 GLY CA C 13 44.924 0.300 . 1 . . . . 84 GLY CA . 10032 1 942 . 1 1 84 84 GLY N N 15 113.971 0.300 . 1 . . . . 84 GLY N . 10032 1 943 . 1 1 85 85 TYR H H 1 7.947 0.030 . 1 . . . . 85 TYR H . 10032 1 944 . 1 1 85 85 TYR HA H 1 4.506 0.030 . 1 . . . . 85 TYR HA . 10032 1 945 . 1 1 85 85 TYR HB2 H 1 3.031 0.030 . 2 . . . . 85 TYR HB2 . 10032 1 946 . 1 1 85 85 TYR HB3 H 1 2.730 0.030 . 2 . . . . 85 TYR HB3 . 10032 1 947 . 1 1 85 85 TYR HD1 H 1 7.063 0.030 . 1 . . . . 85 TYR HD1 . 10032 1 948 . 1 1 85 85 TYR HD2 H 1 7.063 0.030 . 1 . . . . 85 TYR HD2 . 10032 1 949 . 1 1 85 85 TYR HE1 H 1 6.966 0.030 . 1 . . . . 85 TYR HE1 . 10032 1 950 . 1 1 85 85 TYR HE2 H 1 6.966 0.030 . 1 . . . . 85 TYR HE2 . 10032 1 951 . 1 1 85 85 TYR C C 13 176.277 0.300 . 1 . . . . 85 TYR C . 10032 1 952 . 1 1 85 85 TYR CA C 13 58.167 0.300 . 1 . . . . 85 TYR CA . 10032 1 953 . 1 1 85 85 TYR CB C 13 40.077 0.300 . 1 . . . . 85 TYR CB . 10032 1 954 . 1 1 85 85 TYR CD1 C 13 132.905 0.300 . 1 . . . . 85 TYR CD1 . 10032 1 955 . 1 1 85 85 TYR CD2 C 13 132.905 0.300 . 1 . . . . 85 TYR CD2 . 10032 1 956 . 1 1 85 85 TYR CE1 C 13 118.539 0.300 . 1 . . . . 85 TYR CE1 . 10032 1 957 . 1 1 85 85 TYR CE2 C 13 118.539 0.300 . 1 . . . . 85 TYR CE2 . 10032 1 958 . 1 1 85 85 TYR N N 15 120.394 0.300 . 1 . . . . 85 TYR N . 10032 1 959 . 1 1 86 86 LYS H H 1 8.731 0.030 . 1 . . . . 86 LYS H . 10032 1 960 . 1 1 86 86 LYS HA H 1 4.423 0.030 . 1 . . . . 86 LYS HA . 10032 1 961 . 1 1 86 86 LYS HB2 H 1 2.044 0.030 . 2 . . . . 86 LYS HB2 . 10032 1 962 . 1 1 86 86 LYS HB3 H 1 1.565 0.030 . 2 . . . . 86 LYS HB3 . 10032 1 963 . 1 1 86 86 LYS HG2 H 1 1.443 0.030 . 2 . . . . 86 LYS HG2 . 10032 1 964 . 1 1 86 86 LYS HG3 H 1 1.535 0.030 . 2 . . . . 86 LYS HG3 . 10032 1 965 . 1 1 86 86 LYS HD2 H 1 1.704 0.030 . 1 . . . . 86 LYS HD2 . 10032 1 966 . 1 1 86 86 LYS HD3 H 1 1.704 0.030 . 1 . . . . 86 LYS HD3 . 10032 1 967 . 1 1 86 86 LYS HE2 H 1 2.983 0.030 . 1 . . . . 86 LYS HE2 . 10032 1 968 . 1 1 86 86 LYS HE3 H 1 2.983 0.030 . 1 . . . . 86 LYS HE3 . 10032 1 969 . 1 1 86 86 LYS C C 13 178.009 0.300 . 1 . . . . 86 LYS C . 10032 1 970 . 1 1 86 86 LYS CA C 13 55.926 0.300 . 1 . . . . 86 LYS CA . 10032 1 971 . 1 1 86 86 LYS CB C 13 33.290 0.300 . 1 . . . . 86 LYS CB . 10032 1 972 . 1 1 86 86 LYS CG C 13 25.103 0.300 . 1 . . . . 86 LYS CG . 10032 1 973 . 1 1 86 86 LYS CD C 13 29.347 0.300 . 1 . . . . 86 LYS CD . 10032 1 974 . 1 1 86 86 LYS CE C 13 42.157 0.300 . 1 . . . . 86 LYS CE . 10032 1 975 . 1 1 86 86 LYS N N 15 122.425 0.300 . 1 . . . . 86 LYS N . 10032 1 976 . 1 1 87 87 GLU H H 1 8.797 0.030 . 1 . . . . 87 GLU H . 10032 1 977 . 1 1 87 87 GLU HA H 1 3.922 0.030 . 1 . . . . 87 GLU HA . 10032 1 978 . 1 1 87 87 GLU HB2 H 1 2.078 0.030 . 1 . . . . 87 GLU HB2 . 10032 1 979 . 1 1 87 87 GLU HB3 H 1 2.078 0.030 . 1 . . . . 87 GLU HB3 . 10032 1 980 . 1 1 87 87 GLU HG2 H 1 2.275 0.030 . 2 . . . . 87 GLU HG2 . 10032 1 981 . 1 1 87 87 GLU HG3 H 1 2.370 0.030 . 2 . . . . 87 GLU HG3 . 10032 1 982 . 1 1 87 87 GLU C C 13 178.176 0.300 . 1 . . . . 87 GLU C . 10032 1 983 . 1 1 87 87 GLU CA C 13 59.917 0.300 . 1 . . . . 87 GLU CA . 10032 1 984 . 1 1 87 87 GLU CB C 13 29.525 0.300 . 1 . . . . 87 GLU CB . 10032 1 985 . 1 1 87 87 GLU CG C 13 36.285 0.300 . 1 . . . . 87 GLU CG . 10032 1 986 . 1 1 87 87 GLU N N 15 123.525 0.300 . 1 . . . . 87 GLU N . 10032 1 987 . 1 1 88 88 GLU H H 1 9.451 0.030 . 1 . . . . 88 GLU H . 10032 1 988 . 1 1 88 88 GLU HA H 1 4.269 0.030 . 1 . . . . 88 GLU HA . 10032 1 989 . 1 1 88 88 GLU HB2 H 1 2.082 0.030 . 2 . . . . 88 GLU HB2 . 10032 1 990 . 1 1 88 88 GLU HB3 H 1 2.145 0.030 . 2 . . . . 88 GLU HB3 . 10032 1 991 . 1 1 88 88 GLU HG2 H 1 2.297 0.030 . 2 . . . . 88 GLU HG2 . 10032 1 992 . 1 1 88 88 GLU HG3 H 1 2.373 0.030 . 2 . . . . 88 GLU HG3 . 10032 1 993 . 1 1 88 88 GLU C C 13 176.659 0.300 . 1 . . . . 88 GLU C . 10032 1 994 . 1 1 88 88 GLU CA C 13 58.371 0.300 . 1 . . . . 88 GLU CA . 10032 1 995 . 1 1 88 88 GLU CB C 13 28.990 0.300 . 1 . . . . 88 GLU CB . 10032 1 996 . 1 1 88 88 GLU CG C 13 36.367 0.300 . 1 . . . . 88 GLU CG . 10032 1 997 . 1 1 88 88 GLU N N 15 116.525 0.300 . 1 . . . . 88 GLU N . 10032 1 998 . 1 1 89 89 GLU H H 1 7.628 0.030 . 1 . . . . 89 GLU H . 10032 1 999 . 1 1 89 89 GLU HA H 1 4.495 0.030 . 1 . . . . 89 GLU HA . 10032 1 1000 . 1 1 89 89 GLU HB2 H 1 2.232 0.030 . 2 . . . . 89 GLU HB2 . 10032 1 1001 . 1 1 89 89 GLU HB3 H 1 2.152 0.030 . 2 . . . . 89 GLU HB3 . 10032 1 1002 . 1 1 89 89 GLU HG2 H 1 2.236 0.030 . 2 . . . . 89 GLU HG2 . 10032 1 1003 . 1 1 89 89 GLU HG3 H 1 2.366 0.030 . 2 . . . . 89 GLU HG3 . 10032 1 1004 . 1 1 89 89 GLU C C 13 176.158 0.300 . 1 . . . . 89 GLU C . 10032 1 1005 . 1 1 89 89 GLU CA C 13 55.656 0.300 . 1 . . . . 89 GLU CA . 10032 1 1006 . 1 1 89 89 GLU CB C 13 31.627 0.300 . 1 . . . . 89 GLU CB . 10032 1 1007 . 1 1 89 89 GLU CG C 13 36.615 0.300 . 1 . . . . 89 GLU CG . 10032 1 1008 . 1 1 89 89 GLU N N 15 116.975 0.300 . 1 . . . . 89 GLU N . 10032 1 1009 . 1 1 90 90 PHE H H 1 7.873 0.030 . 1 . . . . 90 PHE H . 10032 1 1010 . 1 1 90 90 PHE HA H 1 4.206 0.030 . 1 . . . . 90 PHE HA . 10032 1 1011 . 1 1 90 90 PHE HB2 H 1 2.848 0.030 . 2 . . . . 90 PHE HB2 . 10032 1 1012 . 1 1 90 90 PHE HB3 H 1 2.590 0.030 . 2 . . . . 90 PHE HB3 . 10032 1 1013 . 1 1 90 90 PHE HD1 H 1 6.289 0.030 . 1 . . . . 90 PHE HD1 . 10032 1 1014 . 1 1 90 90 PHE HD2 H 1 6.289 0.030 . 1 . . . . 90 PHE HD2 . 10032 1 1015 . 1 1 90 90 PHE HE1 H 1 5.379 0.030 . 1 . . . . 90 PHE HE1 . 10032 1 1016 . 1 1 90 90 PHE HE2 H 1 5.379 0.030 . 1 . . . . 90 PHE HE2 . 10032 1 1017 . 1 1 90 90 PHE HZ H 1 5.233 0.030 . 1 . . . . 90 PHE HZ . 10032 1 1018 . 1 1 90 90 PHE C C 13 173.519 0.300 . 1 . . . . 90 PHE C . 10032 1 1019 . 1 1 90 90 PHE CA C 13 59.498 0.300 . 1 . . . . 90 PHE CA . 10032 1 1020 . 1 1 90 90 PHE CB C 13 40.118 0.300 . 1 . . . . 90 PHE CB . 10032 1 1021 . 1 1 90 90 PHE CD1 C 13 130.713 0.300 . 1 . . . . 90 PHE CD1 . 10032 1 1022 . 1 1 90 90 PHE CD2 C 13 130.713 0.300 . 1 . . . . 90 PHE CD2 . 10032 1 1023 . 1 1 90 90 PHE CE1 C 13 130.782 0.300 . 1 . . . . 90 PHE CE1 . 10032 1 1024 . 1 1 90 90 PHE CE2 C 13 130.782 0.300 . 1 . . . . 90 PHE CE2 . 10032 1 1025 . 1 1 90 90 PHE CZ C 13 128.948 0.300 . 1 . . . . 90 PHE CZ . 10032 1 1026 . 1 1 90 90 PHE N N 15 121.713 0.300 . 1 . . . . 90 PHE N . 10032 1 1027 . 1 1 91 91 ASN H H 1 7.117 0.030 . 1 . . . . 91 ASN H . 10032 1 1028 . 1 1 91 91 ASN HA H 1 4.491 0.030 . 1 . . . . 91 ASN HA . 10032 1 1029 . 1 1 91 91 ASN HB2 H 1 2.715 0.030 . 2 . . . . 91 ASN HB2 . 10032 1 1030 . 1 1 91 91 ASN HB3 H 1 2.671 0.030 . 2 . . . . 91 ASN HB3 . 10032 1 1031 . 1 1 91 91 ASN HD21 H 1 7.779 0.030 . 2 . . . . 91 ASN HD21 . 10032 1 1032 . 1 1 91 91 ASN HD22 H 1 7.019 0.030 . 2 . . . . 91 ASN HD22 . 10032 1 1033 . 1 1 91 91 ASN C C 13 173.899 0.300 . 1 . . . . 91 ASN C . 10032 1 1034 . 1 1 91 91 ASN CA C 13 52.266 0.300 . 1 . . . . 91 ASN CA . 10032 1 1035 . 1 1 91 91 ASN CB C 13 41.847 0.300 . 1 . . . . 91 ASN CB . 10032 1 1036 . 1 1 91 91 ASN N N 15 125.910 0.300 . 1 . . . . 91 ASN N . 10032 1 1037 . 1 1 91 91 ASN ND2 N 15 114.144 0.300 . 1 . . . . 91 ASN ND2 . 10032 1 1038 . 1 1 92 92 TRP H H 1 9.234 0.030 . 1 . . . . 92 TRP H . 10032 1 1039 . 1 1 92 92 TRP HA H 1 4.227 0.030 . 1 . . . . 92 TRP HA . 10032 1 1040 . 1 1 92 92 TRP HB2 H 1 3.195 0.030 . 2 . . . . 92 TRP HB2 . 10032 1 1041 . 1 1 92 92 TRP HB3 H 1 3.075 0.030 . 2 . . . . 92 TRP HB3 . 10032 1 1042 . 1 1 92 92 TRP HD1 H 1 7.454 0.030 . 1 . . . . 92 TRP HD1 . 10032 1 1043 . 1 1 92 92 TRP HE1 H 1 12.024 0.030 . 1 . . . . 92 TRP HE1 . 10032 1 1044 . 1 1 92 92 TRP HE3 H 1 8.024 0.030 . 1 . . . . 92 TRP HE3 . 10032 1 1045 . 1 1 92 92 TRP HZ2 H 1 7.629 0.030 . 1 . . . . 92 TRP HZ2 . 10032 1 1046 . 1 1 92 92 TRP HZ3 H 1 7.114 0.030 . 1 . . . . 92 TRP HZ3 . 10032 1 1047 . 1 1 92 92 TRP HH2 H 1 7.509 0.030 . 1 . . . . 92 TRP HH2 . 10032 1 1048 . 1 1 92 92 TRP C C 13 178.461 0.300 . 1 . . . . 92 TRP C . 10032 1 1049 . 1 1 92 92 TRP CA C 13 61.250 0.300 . 1 . . . . 92 TRP CA . 10032 1 1050 . 1 1 92 92 TRP CB C 13 31.220 0.300 . 1 . . . . 92 TRP CB . 10032 1 1051 . 1 1 92 92 TRP CD1 C 13 127.048 0.300 . 1 . . . . 92 TRP CD1 . 10032 1 1052 . 1 1 92 92 TRP CE3 C 13 121.136 0.300 . 1 . . . . 92 TRP CE3 . 10032 1 1053 . 1 1 92 92 TRP CZ2 C 13 115.680 0.300 . 1 . . . . 92 TRP CZ2 . 10032 1 1054 . 1 1 92 92 TRP CZ3 C 13 121.130 0.300 . 1 . . . . 92 TRP CZ3 . 10032 1 1055 . 1 1 92 92 TRP CH2 C 13 126.359 0.300 . 1 . . . . 92 TRP CH2 . 10032 1 1056 . 1 1 92 92 TRP N N 15 126.543 0.300 . 1 . . . . 92 TRP N . 10032 1 1057 . 1 1 92 92 TRP NE1 N 15 133.684 0.300 . 1 . . . . 92 TRP NE1 . 10032 1 1058 . 1 1 93 93 GLN H H 1 8.273 0.030 . 1 . . . . 93 GLN H . 10032 1 1059 . 1 1 93 93 GLN HA H 1 4.139 0.030 . 1 . . . . 93 GLN HA . 10032 1 1060 . 1 1 93 93 GLN HB2 H 1 2.283 0.030 . 2 . . . . 93 GLN HB2 . 10032 1 1061 . 1 1 93 93 GLN HB3 H 1 2.203 0.030 . 2 . . . . 93 GLN HB3 . 10032 1 1062 . 1 1 93 93 GLN HG2 H 1 2.515 0.030 . 1 . . . . 93 GLN HG2 . 10032 1 1063 . 1 1 93 93 GLN HG3 H 1 2.515 0.030 . 1 . . . . 93 GLN HG3 . 10032 1 1064 . 1 1 93 93 GLN HE21 H 1 6.938 0.030 . 2 . . . . 93 GLN HE21 . 10032 1 1065 . 1 1 93 93 GLN HE22 H 1 7.637 0.030 . 2 . . . . 93 GLN HE22 . 10032 1 1066 . 1 1 93 93 GLN C C 13 179.761 0.300 . 1 . . . . 93 GLN C . 10032 1 1067 . 1 1 93 93 GLN CA C 13 60.016 0.300 . 1 . . . . 93 GLN CA . 10032 1 1068 . 1 1 93 93 GLN CB C 13 27.943 0.300 . 1 . . . . 93 GLN CB . 10032 1 1069 . 1 1 93 93 GLN CG C 13 34.432 0.300 . 1 . . . . 93 GLN CG . 10032 1 1070 . 1 1 93 93 GLN N N 15 115.515 0.300 . 1 . . . . 93 GLN N . 10032 1 1071 . 1 1 93 93 GLN NE2 N 15 112.609 0.300 . 1 . . . . 93 GLN NE2 . 10032 1 1072 . 1 1 94 94 THR H H 1 8.139 0.030 . 1 . . . . 94 THR H . 10032 1 1073 . 1 1 94 94 THR HA H 1 4.045 0.030 . 1 . . . . 94 THR HA . 10032 1 1074 . 1 1 94 94 THR HB H 1 4.262 0.030 . 1 . . . . 94 THR HB . 10032 1 1075 . 1 1 94 94 THR HG21 H 1 1.338 0.030 . 1 . . . . 94 THR HG2 . 10032 1 1076 . 1 1 94 94 THR HG22 H 1 1.338 0.030 . 1 . . . . 94 THR HG2 . 10032 1 1077 . 1 1 94 94 THR HG23 H 1 1.338 0.030 . 1 . . . . 94 THR HG2 . 10032 1 1078 . 1 1 94 94 THR C C 13 176.451 0.300 . 1 . . . . 94 THR C . 10032 1 1079 . 1 1 94 94 THR CA C 13 65.745 0.300 . 1 . . . . 94 THR CA . 10032 1 1080 . 1 1 94 94 THR CB C 13 68.604 0.300 . 1 . . . . 94 THR CB . 10032 1 1081 . 1 1 94 94 THR CG2 C 13 22.286 0.300 . 1 . . . . 94 THR CG2 . 10032 1 1082 . 1 1 94 94 THR N N 15 115.678 0.300 . 1 . . . . 94 THR N . 10032 1 1083 . 1 1 95 95 TYR H H 1 8.585 0.030 . 1 . . . . 95 TYR H . 10032 1 1084 . 1 1 95 95 TYR HA H 1 4.483 0.030 . 1 . . . . 95 TYR HA . 10032 1 1085 . 1 1 95 95 TYR HB2 H 1 2.805 0.030 . 1 . . . . 95 TYR HB2 . 10032 1 1086 . 1 1 95 95 TYR HB3 H 1 2.805 0.030 . 1 . . . . 95 TYR HB3 . 10032 1 1087 . 1 1 95 95 TYR HD1 H 1 7.197 0.030 . 1 . . . . 95 TYR HD1 . 10032 1 1088 . 1 1 95 95 TYR HD2 H 1 7.197 0.030 . 1 . . . . 95 TYR HD2 . 10032 1 1089 . 1 1 95 95 TYR HE1 H 1 6.692 0.030 . 1 . . . . 95 TYR HE1 . 10032 1 1090 . 1 1 95 95 TYR HE2 H 1 6.692 0.030 . 1 . . . . 95 TYR HE2 . 10032 1 1091 . 1 1 95 95 TYR C C 13 178.468 0.300 . 1 . . . . 95 TYR C . 10032 1 1092 . 1 1 95 95 TYR CA C 13 61.883 0.300 . 1 . . . . 95 TYR CA . 10032 1 1093 . 1 1 95 95 TYR CB C 13 39.992 0.300 . 1 . . . . 95 TYR CB . 10032 1 1094 . 1 1 95 95 TYR CD1 C 13 132.710 0.300 . 1 . . . . 95 TYR CD1 . 10032 1 1095 . 1 1 95 95 TYR CD2 C 13 132.710 0.300 . 1 . . . . 95 TYR CD2 . 10032 1 1096 . 1 1 95 95 TYR CE1 C 13 117.850 0.300 . 1 . . . . 95 TYR CE1 . 10032 1 1097 . 1 1 95 95 TYR CE2 C 13 117.850 0.300 . 1 . . . . 95 TYR CE2 . 10032 1 1098 . 1 1 95 95 TYR N N 15 125.140 0.300 . 1 . . . . 95 TYR N . 10032 1 1099 . 1 1 96 96 LEU H H 1 9.135 0.030 . 1 . . . . 96 LEU H . 10032 1 1100 . 1 1 96 96 LEU HA H 1 3.794 0.030 . 1 . . . . 96 LEU HA . 10032 1 1101 . 1 1 96 96 LEU HB2 H 1 2.064 0.030 . 2 . . . . 96 LEU HB2 . 10032 1 1102 . 1 1 96 96 LEU HB3 H 1 1.748 0.030 . 2 . . . . 96 LEU HB3 . 10032 1 1103 . 1 1 96 96 LEU HG H 1 2.541 0.030 . 1 . . . . 96 LEU HG . 10032 1 1104 . 1 1 96 96 LEU HD11 H 1 1.003 0.030 . 1 . . . . 96 LEU HD1 . 10032 1 1105 . 1 1 96 96 LEU HD12 H 1 1.003 0.030 . 1 . . . . 96 LEU HD1 . 10032 1 1106 . 1 1 96 96 LEU HD13 H 1 1.003 0.030 . 1 . . . . 96 LEU HD1 . 10032 1 1107 . 1 1 96 96 LEU HD21 H 1 0.887 0.030 . 1 . . . . 96 LEU HD2 . 10032 1 1108 . 1 1 96 96 LEU HD22 H 1 0.887 0.030 . 1 . . . . 96 LEU HD2 . 10032 1 1109 . 1 1 96 96 LEU HD23 H 1 0.887 0.030 . 1 . . . . 96 LEU HD2 . 10032 1 1110 . 1 1 96 96 LEU C C 13 179.239 0.300 . 1 . . . . 96 LEU C . 10032 1 1111 . 1 1 96 96 LEU CA C 13 59.121 0.300 . 1 . . . . 96 LEU CA . 10032 1 1112 . 1 1 96 96 LEU CB C 13 40.765 0.300 . 1 . . . . 96 LEU CB . 10032 1 1113 . 1 1 96 96 LEU CG C 13 27.679 0.300 . 1 . . . . 96 LEU CG . 10032 1 1114 . 1 1 96 96 LEU CD1 C 13 26.283 0.300 . 2 . . . . 96 LEU CD1 . 10032 1 1115 . 1 1 96 96 LEU CD2 C 13 23.478 0.300 . 2 . . . . 96 LEU CD2 . 10032 1 1116 . 1 1 96 96 LEU N N 15 118.926 0.300 . 1 . . . . 96 LEU N . 10032 1 1117 . 1 1 97 97 LYS H H 1 7.364 0.030 . 1 . . . . 97 LYS H . 10032 1 1118 . 1 1 97 97 LYS HA H 1 4.239 0.030 . 1 . . . . 97 LYS HA . 10032 1 1119 . 1 1 97 97 LYS HB2 H 1 2.071 0.030 . 1 . . . . 97 LYS HB2 . 10032 1 1120 . 1 1 97 97 LYS HB3 H 1 2.071 0.030 . 1 . . . . 97 LYS HB3 . 10032 1 1121 . 1 1 97 97 LYS HG2 H 1 1.660 0.030 . 2 . . . . 97 LYS HG2 . 10032 1 1122 . 1 1 97 97 LYS HG3 H 1 1.503 0.030 . 2 . . . . 97 LYS HG3 . 10032 1 1123 . 1 1 97 97 LYS HD2 H 1 1.771 0.030 . 1 . . . . 97 LYS HD2 . 10032 1 1124 . 1 1 97 97 LYS HD3 H 1 1.771 0.030 . 1 . . . . 97 LYS HD3 . 10032 1 1125 . 1 1 97 97 LYS HE2 H 1 3.056 0.030 . 1 . . . . 97 LYS HE2 . 10032 1 1126 . 1 1 97 97 LYS HE3 H 1 3.056 0.030 . 1 . . . . 97 LYS HE3 . 10032 1 1127 . 1 1 97 97 LYS C C 13 180.576 0.300 . 1 . . . . 97 LYS C . 10032 1 1128 . 1 1 97 97 LYS CA C 13 59.528 0.300 . 1 . . . . 97 LYS CA . 10032 1 1129 . 1 1 97 97 LYS CB C 13 32.291 0.300 . 1 . . . . 97 LYS CB . 10032 1 1130 . 1 1 97 97 LYS CG C 13 25.105 0.300 . 1 . . . . 97 LYS CG . 10032 1 1131 . 1 1 97 97 LYS CD C 13 29.298 0.300 . 1 . . . . 97 LYS CD . 10032 1 1132 . 1 1 97 97 LYS CE C 13 42.249 0.300 . 1 . . . . 97 LYS CE . 10032 1 1133 . 1 1 97 97 LYS N N 15 117.446 0.300 . 1 . . . . 97 LYS N . 10032 1 1134 . 1 1 98 98 THR H H 1 8.748 0.030 . 1 . . . . 98 THR H . 10032 1 1135 . 1 1 98 98 THR HA H 1 4.006 0.030 . 1 . . . . 98 THR HA . 10032 1 1136 . 1 1 98 98 THR HB H 1 4.425 0.030 . 1 . . . . 98 THR HB . 10032 1 1137 . 1 1 98 98 THR HG21 H 1 1.398 0.030 . 1 . . . . 98 THR HG2 . 10032 1 1138 . 1 1 98 98 THR HG22 H 1 1.398 0.030 . 1 . . . . 98 THR HG2 . 10032 1 1139 . 1 1 98 98 THR HG23 H 1 1.398 0.030 . 1 . . . . 98 THR HG2 . 10032 1 1140 . 1 1 98 98 THR C C 13 176.516 0.300 . 1 . . . . 98 THR C . 10032 1 1141 . 1 1 98 98 THR CA C 13 66.516 0.300 . 1 . . . . 98 THR CA . 10032 1 1142 . 1 1 98 98 THR CB C 13 69.100 0.300 . 1 . . . . 98 THR CB . 10032 1 1143 . 1 1 98 98 THR CG2 C 13 21.639 0.300 . 1 . . . . 98 THR CG2 . 10032 1 1144 . 1 1 98 98 THR N N 15 117.849 0.300 . 1 . . . . 98 THR N . 10032 1 1145 . 1 1 99 99 CYS H H 1 8.021 0.030 . 1 . . . . 99 CYS H . 10032 1 1146 . 1 1 99 99 CYS HA H 1 4.196 0.030 . 1 . . . . 99 CYS HA . 10032 1 1147 . 1 1 99 99 CYS HB2 H 1 2.820 0.030 . 2 . . . . 99 CYS HB2 . 10032 1 1148 . 1 1 99 99 CYS HB3 H 1 2.471 0.030 . 2 . . . . 99 CYS HB3 . 10032 1 1149 . 1 1 99 99 CYS C C 13 173.380 0.300 . 1 . . . . 99 CYS C . 10032 1 1150 . 1 1 99 99 CYS CA C 13 60.451 0.300 . 1 . . . . 99 CYS CA . 10032 1 1151 . 1 1 99 99 CYS CB C 13 28.147 0.300 . 1 . . . . 99 CYS CB . 10032 1 1152 . 1 1 99 99 CYS N N 15 116.178 0.300 . 1 . . . . 99 CYS N . 10032 1 1153 . 1 1 100 100 LYS H H 1 7.843 0.030 . 1 . . . . 100 LYS H . 10032 1 1154 . 1 1 100 100 LYS HA H 1 3.935 0.030 . 1 . . . . 100 LYS HA . 10032 1 1155 . 1 1 100 100 LYS HB2 H 1 1.695 0.030 . 2 . . . . 100 LYS HB2 . 10032 1 1156 . 1 1 100 100 LYS HB3 H 1 1.812 0.030 . 2 . . . . 100 LYS HB3 . 10032 1 1157 . 1 1 100 100 LYS HG2 H 1 1.414 0.030 . 2 . . . . 100 LYS HG2 . 10032 1 1158 . 1 1 100 100 LYS HG3 H 1 1.454 0.030 . 2 . . . . 100 LYS HG3 . 10032 1 1159 . 1 1 100 100 LYS HD2 H 1 2.040 0.030 . 2 . . . . 100 LYS HD2 . 10032 1 1160 . 1 1 100 100 LYS HD3 H 1 1.896 0.030 . 2 . . . . 100 LYS HD3 . 10032 1 1161 . 1 1 100 100 LYS HE2 H 1 3.060 0.030 . 1 . . . . 100 LYS HE2 . 10032 1 1162 . 1 1 100 100 LYS HE3 H 1 3.060 0.030 . 1 . . . . 100 LYS HE3 . 10032 1 1163 . 1 1 100 100 LYS C C 13 175.106 0.300 . 1 . . . . 100 LYS C . 10032 1 1164 . 1 1 100 100 LYS CA C 13 57.187 0.300 . 1 . . . . 100 LYS CA . 10032 1 1165 . 1 1 100 100 LYS CB C 13 33.130 0.300 . 1 . . . . 100 LYS CB . 10032 1 1166 . 1 1 100 100 LYS CG C 13 25.036 0.300 . 1 . . . . 100 LYS CG . 10032 1 1167 . 1 1 100 100 LYS CD C 13 29.278 0.300 . 1 . . . . 100 LYS CD . 10032 1 1168 . 1 1 100 100 LYS CE C 13 42.322 0.300 . 1 . . . . 100 LYS CE . 10032 1 1169 . 1 1 100 100 LYS N N 15 119.497 0.300 . 1 . . . . 100 LYS N . 10032 1 1170 . 1 1 101 101 ALA H H 1 8.093 0.030 . 1 . . . . 101 ALA H . 10032 1 1171 . 1 1 101 101 ALA HA H 1 4.924 0.030 . 1 . . . . 101 ALA HA . 10032 1 1172 . 1 1 101 101 ALA HB1 H 1 1.357 0.030 . 1 . . . . 101 ALA HB . 10032 1 1173 . 1 1 101 101 ALA HB2 H 1 1.357 0.030 . 1 . . . . 101 ALA HB . 10032 1 1174 . 1 1 101 101 ALA HB3 H 1 1.357 0.030 . 1 . . . . 101 ALA HB . 10032 1 1175 . 1 1 101 101 ALA C C 13 175.272 0.300 . 1 . . . . 101 ALA C . 10032 1 1176 . 1 1 101 101 ALA CA C 13 50.075 0.300 . 1 . . . . 101 ALA CA . 10032 1 1177 . 1 1 101 101 ALA CB C 13 25.182 0.300 . 1 . . . . 101 ALA CB . 10032 1 1178 . 1 1 101 101 ALA N N 15 119.603 0.300 . 1 . . . . 101 ALA N . 10032 1 1179 . 1 1 102 102 GLN H H 1 8.547 0.030 . 1 . . . . 102 GLN H . 10032 1 1180 . 1 1 102 102 GLN HA H 1 4.673 0.030 . 1 . . . . 102 GLN HA . 10032 1 1181 . 1 1 102 102 GLN HB2 H 1 2.087 0.030 . 2 . . . . 102 GLN HB2 . 10032 1 1182 . 1 1 102 102 GLN HB3 H 1 1.908 0.030 . 2 . . . . 102 GLN HB3 . 10032 1 1183 . 1 1 102 102 GLN HG2 H 1 2.425 0.030 . 2 . . . . 102 GLN HG2 . 10032 1 1184 . 1 1 102 102 GLN HG3 H 1 2.357 0.030 . 2 . . . . 102 GLN HG3 . 10032 1 1185 . 1 1 102 102 GLN C C 13 175.690 0.300 . 1 . . . . 102 GLN C . 10032 1 1186 . 1 1 102 102 GLN CA C 13 53.676 0.300 . 1 . . . . 102 GLN CA . 10032 1 1187 . 1 1 102 102 GLN CB C 13 31.627 0.300 . 1 . . . . 102 GLN CB . 10032 1 1188 . 1 1 102 102 GLN CG C 13 33.870 0.300 . 1 . . . . 102 GLN CG . 10032 1 1189 . 1 1 102 102 GLN N N 15 116.797 0.300 . 1 . . . . 102 GLN N . 10032 1 1190 . 1 1 103 103 ALA H H 1 8.851 0.030 . 1 . . . . 103 ALA H . 10032 1 1191 . 1 1 103 103 ALA HA H 1 4.370 0.030 . 1 . . . . 103 ALA HA . 10032 1 1192 . 1 1 103 103 ALA HB1 H 1 1.308 0.030 . 1 . . . . 103 ALA HB . 10032 1 1193 . 1 1 103 103 ALA HB2 H 1 1.308 0.030 . 1 . . . . 103 ALA HB . 10032 1 1194 . 1 1 103 103 ALA HB3 H 1 1.308 0.030 . 1 . . . . 103 ALA HB . 10032 1 1195 . 1 1 103 103 ALA C C 13 178.356 0.300 . 1 . . . . 103 ALA C . 10032 1 1196 . 1 1 103 103 ALA CA C 13 51.206 0.300 . 1 . . . . 103 ALA CA . 10032 1 1197 . 1 1 103 103 ALA CB C 13 19.671 0.300 . 1 . . . . 103 ALA CB . 10032 1 1198 . 1 1 103 103 ALA N N 15 125.028 0.300 . 1 . . . . 103 ALA N . 10032 1 1199 . 1 1 104 104 ALA H H 1 9.139 0.030 . 1 . . . . 104 ALA H . 10032 1 1200 . 1 1 104 104 ALA HA H 1 5.038 0.030 . 1 . . . . 104 ALA HA . 10032 1 1201 . 1 1 104 104 ALA HB1 H 1 1.651 0.030 . 1 . . . . 104 ALA HB . 10032 1 1202 . 1 1 104 104 ALA HB2 H 1 1.651 0.030 . 1 . . . . 104 ALA HB . 10032 1 1203 . 1 1 104 104 ALA HB3 H 1 1.651 0.030 . 1 . . . . 104 ALA HB . 10032 1 1204 . 1 1 104 104 ALA C C 13 176.010 0.300 . 1 . . . . 104 ALA C . 10032 1 1205 . 1 1 104 104 ALA CA C 13 50.637 0.300 . 1 . . . . 104 ALA CA . 10032 1 1206 . 1 1 104 104 ALA CB C 13 19.052 0.300 . 1 . . . . 104 ALA CB . 10032 1 1207 . 1 1 104 104 ALA N N 15 126.489 0.300 . 1 . . . . 104 ALA N . 10032 1 1208 . 1 1 105 105 PRO HA H 1 4.434 0.030 . 1 . . . . 105 PRO HA . 10032 1 1209 . 1 1 105 105 PRO HB2 H 1 2.452 0.030 . 2 . . . . 105 PRO HB2 . 10032 1 1210 . 1 1 105 105 PRO HB3 H 1 1.986 0.030 . 2 . . . . 105 PRO HB3 . 10032 1 1211 . 1 1 105 105 PRO HG2 H 1 2.037 0.030 . 1 . . . . 105 PRO HG2 . 10032 1 1212 . 1 1 105 105 PRO HG3 H 1 2.037 0.030 . 1 . . . . 105 PRO HG3 . 10032 1 1213 . 1 1 105 105 PRO HD2 H 1 3.559 0.030 . 2 . . . . 105 PRO HD2 . 10032 1 1214 . 1 1 105 105 PRO HD3 H 1 4.084 0.030 . 2 . . . . 105 PRO HD3 . 10032 1 1215 . 1 1 105 105 PRO C C 13 176.559 0.300 . 1 . . . . 105 PRO C . 10032 1 1216 . 1 1 105 105 PRO CA C 13 63.013 0.300 . 1 . . . . 105 PRO CA . 10032 1 1217 . 1 1 105 105 PRO CB C 13 32.673 0.300 . 1 . . . . 105 PRO CB . 10032 1 1218 . 1 1 105 105 PRO CG C 13 27.282 0.300 . 1 . . . . 105 PRO CG . 10032 1 1219 . 1 1 105 105 PRO CD C 13 51.770 0.300 . 1 . . . . 105 PRO CD . 10032 1 1220 . 1 1 106 106 LYS H H 1 8.539 0.030 . 1 . . . . 106 LYS H . 10032 1 1221 . 1 1 106 106 LYS HA H 1 4.080 0.030 . 1 . . . . 106 LYS HA . 10032 1 1222 . 1 1 106 106 LYS HB2 H 1 1.971 0.030 . 1 . . . . 106 LYS HB2 . 10032 1 1223 . 1 1 106 106 LYS HB3 H 1 1.971 0.030 . 1 . . . . 106 LYS HB3 . 10032 1 1224 . 1 1 106 106 LYS HG2 H 1 1.506 0.030 . 2 . . . . 106 LYS HG2 . 10032 1 1225 . 1 1 106 106 LYS HG3 H 1 1.654 0.030 . 2 . . . . 106 LYS HG3 . 10032 1 1226 . 1 1 106 106 LYS HD2 H 1 1.763 0.030 . 1 . . . . 106 LYS HD2 . 10032 1 1227 . 1 1 106 106 LYS HD3 H 1 1.763 0.030 . 1 . . . . 106 LYS HD3 . 10032 1 1228 . 1 1 106 106 LYS HE2 H 1 3.045 0.030 . 1 . . . . 106 LYS HE2 . 10032 1 1229 . 1 1 106 106 LYS HE3 H 1 3.045 0.030 . 1 . . . . 106 LYS HE3 . 10032 1 1230 . 1 1 106 106 LYS C C 13 178.556 0.300 . 1 . . . . 106 LYS C . 10032 1 1231 . 1 1 106 106 LYS CA C 13 60.387 0.300 . 1 . . . . 106 LYS CA . 10032 1 1232 . 1 1 106 106 LYS CB C 13 32.369 0.300 . 1 . . . . 106 LYS CB . 10032 1 1233 . 1 1 106 106 LYS CG C 13 25.318 0.300 . 1 . . . . 106 LYS CG . 10032 1 1234 . 1 1 106 106 LYS CD C 13 29.471 0.300 . 1 . . . . 106 LYS CD . 10032 1 1235 . 1 1 106 106 LYS CE C 13 42.138 0.300 . 1 . . . . 106 LYS CE . 10032 1 1236 . 1 1 106 106 LYS N N 15 121.579 0.300 . 1 . . . . 106 LYS N . 10032 1 1237 . 1 1 107 107 SER H H 1 8.177 0.030 . 1 . . . . 107 SER H . 10032 1 1238 . 1 1 107 107 SER HA H 1 4.224 0.030 . 1 . . . . 107 SER HA . 10032 1 1239 . 1 1 107 107 SER HB2 H 1 3.953 0.030 . 2 . . . . 107 SER HB2 . 10032 1 1240 . 1 1 107 107 SER HB3 H 1 3.907 0.030 . 2 . . . . 107 SER HB3 . 10032 1 1241 . 1 1 107 107 SER C C 13 176.008 0.300 . 1 . . . . 107 SER C . 10032 1 1242 . 1 1 107 107 SER CA C 13 60.335 0.300 . 1 . . . . 107 SER CA . 10032 1 1243 . 1 1 107 107 SER CB C 13 62.253 0.300 . 1 . . . . 107 SER CB . 10032 1 1244 . 1 1 107 107 SER N N 15 112.574 0.300 . 1 . . . . 107 SER N . 10032 1 1245 . 1 1 108 108 LEU H H 1 7.541 0.030 . 1 . . . . 108 LEU H . 10032 1 1246 . 1 1 108 108 LEU HA H 1 3.903 0.030 . 1 . . . . 108 LEU HA . 10032 1 1247 . 1 1 108 108 LEU HB2 H 1 0.906 0.030 . 2 . . . . 108 LEU HB2 . 10032 1 1248 . 1 1 108 108 LEU HB3 H 1 0.326 0.030 . 2 . . . . 108 LEU HB3 . 10032 1 1249 . 1 1 108 108 LEU HG H 1 1.229 0.030 . 1 . . . . 108 LEU HG . 10032 1 1250 . 1 1 108 108 LEU HD11 H 1 -0.144 0.030 . 1 . . . . 108 LEU HD1 . 10032 1 1251 . 1 1 108 108 LEU HD12 H 1 -0.144 0.030 . 1 . . . . 108 LEU HD1 . 10032 1 1252 . 1 1 108 108 LEU HD13 H 1 -0.144 0.030 . 1 . . . . 108 LEU HD1 . 10032 1 1253 . 1 1 108 108 LEU HD21 H 1 0.342 0.030 . 1 . . . . 108 LEU HD2 . 10032 1 1254 . 1 1 108 108 LEU HD22 H 1 0.342 0.030 . 1 . . . . 108 LEU HD2 . 10032 1 1255 . 1 1 108 108 LEU HD23 H 1 0.342 0.030 . 1 . . . . 108 LEU HD2 . 10032 1 1256 . 1 1 108 108 LEU C C 13 176.573 0.300 . 1 . . . . 108 LEU C . 10032 1 1257 . 1 1 108 108 LEU CA C 13 55.844 0.300 . 1 . . . . 108 LEU CA . 10032 1 1258 . 1 1 108 108 LEU CB C 13 40.257 0.300 . 1 . . . . 108 LEU CB . 10032 1 1259 . 1 1 108 108 LEU CG C 13 26.192 0.300 . 1 . . . . 108 LEU CG . 10032 1 1260 . 1 1 108 108 LEU CD1 C 13 25.245 0.300 . 2 . . . . 108 LEU CD1 . 10032 1 1261 . 1 1 108 108 LEU CD2 C 13 21.828 0.300 . 2 . . . . 108 LEU CD2 . 10032 1 1262 . 1 1 108 108 LEU N N 15 120.052 0.300 . 1 . . . . 108 LEU N . 10032 1 1263 . 1 1 109 109 PHE H H 1 7.679 0.030 . 1 . . . . 109 PHE H . 10032 1 1264 . 1 1 109 109 PHE HA H 1 4.585 0.030 . 1 . . . . 109 PHE HA . 10032 1 1265 . 1 1 109 109 PHE HB2 H 1 3.451 0.030 . 2 . . . . 109 PHE HB2 . 10032 1 1266 . 1 1 109 109 PHE HB3 H 1 2.911 0.030 . 2 . . . . 109 PHE HB3 . 10032 1 1267 . 1 1 109 109 PHE HD1 H 1 7.378 0.030 . 1 . . . . 109 PHE HD1 . 10032 1 1268 . 1 1 109 109 PHE HD2 H 1 7.378 0.030 . 1 . . . . 109 PHE HD2 . 10032 1 1269 . 1 1 109 109 PHE HE1 H 1 6.995 0.030 . 1 . . . . 109 PHE HE1 . 10032 1 1270 . 1 1 109 109 PHE HE2 H 1 6.995 0.030 . 1 . . . . 109 PHE HE2 . 10032 1 1271 . 1 1 109 109 PHE HZ H 1 7.158 0.030 . 1 . . . . 109 PHE HZ . 10032 1 1272 . 1 1 109 109 PHE C C 13 175.895 0.300 . 1 . . . . 109 PHE C . 10032 1 1273 . 1 1 109 109 PHE CA C 13 57.023 0.300 . 1 . . . . 109 PHE CA . 10032 1 1274 . 1 1 109 109 PHE CB C 13 39.046 0.300 . 1 . . . . 109 PHE CB . 10032 1 1275 . 1 1 109 109 PHE CD1 C 13 133.060 0.300 . 1 . . . . 109 PHE CD1 . 10032 1 1276 . 1 1 109 109 PHE CD2 C 13 133.060 0.300 . 1 . . . . 109 PHE CD2 . 10032 1 1277 . 1 1 109 109 PHE CE1 C 13 130.956 0.300 . 1 . . . . 109 PHE CE1 . 10032 1 1278 . 1 1 109 109 PHE CE2 C 13 130.956 0.300 . 1 . . . . 109 PHE CE2 . 10032 1 1279 . 1 1 109 109 PHE CZ C 13 128.403 0.300 . 1 . . . . 109 PHE CZ . 10032 1 1280 . 1 1 109 109 PHE N N 15 115.743 0.300 . 1 . . . . 109 PHE N . 10032 1 1281 . 1 1 110 110 GLU H H 1 7.888 0.030 . 1 . . . . 110 GLU H . 10032 1 1282 . 1 1 110 110 GLU HA H 1 4.397 0.030 . 1 . . . . 110 GLU HA . 10032 1 1283 . 1 1 110 110 GLU HB2 H 1 2.112 0.030 . 2 . . . . 110 GLU HB2 . 10032 1 1284 . 1 1 110 110 GLU HB3 H 1 1.987 0.030 . 2 . . . . 110 GLU HB3 . 10032 1 1285 . 1 1 110 110 GLU HG2 H 1 2.295 0.030 . 2 . . . . 110 GLU HG2 . 10032 1 1286 . 1 1 110 110 GLU HG3 H 1 1.949 0.030 . 2 . . . . 110 GLU HG3 . 10032 1 1287 . 1 1 110 110 GLU C C 13 176.378 0.300 . 1 . . . . 110 GLU C . 10032 1 1288 . 1 1 110 110 GLU CA C 13 56.678 0.300 . 1 . . . . 110 GLU CA . 10032 1 1289 . 1 1 110 110 GLU CB C 13 30.524 0.300 . 1 . . . . 110 GLU CB . 10032 1 1290 . 1 1 110 110 GLU CG C 13 34.751 0.300 . 1 . . . . 110 GLU CG . 10032 1 1291 . 1 1 110 110 GLU N N 15 120.736 0.300 . 1 . . . . 110 GLU N . 10032 1 1292 . 1 1 111 111 ASN H H 1 8.608 0.030 . 1 . . . . 111 ASN H . 10032 1 1293 . 1 1 111 111 ASN HA H 1 4.697 0.030 . 1 . . . . 111 ASN HA . 10032 1 1294 . 1 1 111 111 ASN HB2 H 1 2.846 0.030 . 2 . . . . 111 ASN HB2 . 10032 1 1295 . 1 1 111 111 ASN HB3 H 1 2.929 0.030 . 2 . . . . 111 ASN HB3 . 10032 1 1296 . 1 1 111 111 ASN HD21 H 1 7.685 0.030 . 2 . . . . 111 ASN HD21 . 10032 1 1297 . 1 1 111 111 ASN HD22 H 1 7.027 0.030 . 2 . . . . 111 ASN HD22 . 10032 1 1298 . 1 1 111 111 ASN C C 13 175.519 0.300 . 1 . . . . 111 ASN C . 10032 1 1299 . 1 1 111 111 ASN CA C 13 53.617 0.300 . 1 . . . . 111 ASN CA . 10032 1 1300 . 1 1 111 111 ASN CB C 13 38.821 0.300 . 1 . . . . 111 ASN CB . 10032 1 1301 . 1 1 111 111 ASN N N 15 118.426 0.300 . 1 . . . . 111 ASN N . 10032 1 1302 . 1 1 111 111 ASN ND2 N 15 113.455 0.300 . 1 . . . . 111 ASN ND2 . 10032 1 1303 . 1 1 112 112 GLN H H 1 8.377 0.030 . 1 . . . . 112 GLN H . 10032 1 1304 . 1 1 112 112 GLN HA H 1 4.361 0.030 . 1 . . . . 112 GLN HA . 10032 1 1305 . 1 1 112 112 GLN HB2 H 1 2.072 0.030 . 2 . . . . 112 GLN HB2 . 10032 1 1306 . 1 1 112 112 GLN HB3 H 1 2.187 0.030 . 2 . . . . 112 GLN HB3 . 10032 1 1307 . 1 1 112 112 GLN HG2 H 1 2.495 0.030 . 2 . . . . 112 GLN HG2 . 10032 1 1308 . 1 1 112 112 GLN HG3 H 1 2.404 0.030 . 2 . . . . 112 GLN HG3 . 10032 1 1309 . 1 1 112 112 GLN HE21 H 1 7.096 0.030 . 2 . . . . 112 GLN HE21 . 10032 1 1310 . 1 1 112 112 GLN HE22 H 1 7.731 0.030 . 2 . . . . 112 GLN HE22 . 10032 1 1311 . 1 1 112 112 GLN C C 13 176.014 0.300 . 1 . . . . 112 GLN C . 10032 1 1312 . 1 1 112 112 GLN CA C 13 56.320 0.300 . 1 . . . . 112 GLN CA . 10032 1 1313 . 1 1 112 112 GLN CB C 13 29.360 0.300 . 1 . . . . 112 GLN CB . 10032 1 1314 . 1 1 112 112 GLN CG C 13 34.059 0.300 . 1 . . . . 112 GLN CG . 10032 1 1315 . 1 1 112 112 GLN N N 15 119.752 0.300 . 1 . . . . 112 GLN N . 10032 1 1316 . 1 1 112 112 GLN NE2 N 15 113.628 0.300 . 1 . . . . 112 GLN NE2 . 10032 1 1317 . 1 1 113 113 ASN H H 1 8.480 0.030 . 1 . . . . 113 ASN H . 10032 1 1318 . 1 1 113 113 ASN HA H 1 4.745 0.030 . 1 . . . . 113 ASN HA . 10032 1 1319 . 1 1 113 113 ASN HB2 H 1 2.799 0.030 . 2 . . . . 113 ASN HB2 . 10032 1 1320 . 1 1 113 113 ASN HB3 H 1 2.912 0.030 . 2 . . . . 113 ASN HB3 . 10032 1 1321 . 1 1 113 113 ASN HD21 H 1 7.511 0.030 . 2 . . . . 113 ASN HD21 . 10032 1 1322 . 1 1 113 113 ASN HD22 H 1 6.835 0.030 . 2 . . . . 113 ASN HD22 . 10032 1 1323 . 1 1 113 113 ASN C C 13 174.945 0.300 . 1 . . . . 113 ASN C . 10032 1 1324 . 1 1 113 113 ASN CA C 13 53.511 0.300 . 1 . . . . 113 ASN CA . 10032 1 1325 . 1 1 113 113 ASN CB C 13 39.068 0.300 . 1 . . . . 113 ASN CB . 10032 1 1326 . 1 1 113 113 ASN N N 15 119.222 0.300 . 1 . . . . 113 ASN N . 10032 1 1327 . 1 1 113 113 ASN ND2 N 15 111.760 0.300 . 1 . . . . 113 ASN ND2 . 10032 1 1328 . 1 1 114 114 ILE H H 1 8.066 0.030 . 1 . . . . 114 ILE H . 10032 1 1329 . 1 1 114 114 ILE HA H 1 4.288 0.030 . 1 . . . . 114 ILE HA . 10032 1 1330 . 1 1 114 114 ILE HB H 1 1.939 0.030 . 1 . . . . 114 ILE HB . 10032 1 1331 . 1 1 114 114 ILE HG12 H 1 1.485 0.030 . 2 . . . . 114 ILE HG12 . 10032 1 1332 . 1 1 114 114 ILE HG13 H 1 1.222 0.030 . 2 . . . . 114 ILE HG13 . 10032 1 1333 . 1 1 114 114 ILE HG21 H 1 0.928 0.030 . 1 . . . . 114 ILE HG2 . 10032 1 1334 . 1 1 114 114 ILE HG22 H 1 0.928 0.030 . 1 . . . . 114 ILE HG2 . 10032 1 1335 . 1 1 114 114 ILE HG23 H 1 0.928 0.030 . 1 . . . . 114 ILE HG2 . 10032 1 1336 . 1 1 114 114 ILE HD11 H 1 0.904 0.030 . 1 . . . . 114 ILE HD1 . 10032 1 1337 . 1 1 114 114 ILE HD12 H 1 0.904 0.030 . 1 . . . . 114 ILE HD1 . 10032 1 1338 . 1 1 114 114 ILE HD13 H 1 0.904 0.030 . 1 . . . . 114 ILE HD1 . 10032 1 1339 . 1 1 114 114 ILE C C 13 176.237 0.300 . 1 . . . . 114 ILE C . 10032 1 1340 . 1 1 114 114 ILE CA C 13 61.249 0.300 . 1 . . . . 114 ILE CA . 10032 1 1341 . 1 1 114 114 ILE CB C 13 38.947 0.300 . 1 . . . . 114 ILE CB . 10032 1 1342 . 1 1 114 114 ILE CG1 C 13 27.300 0.300 . 1 . . . . 114 ILE CG1 . 10032 1 1343 . 1 1 114 114 ILE CG2 C 13 17.714 0.300 . 1 . . . . 114 ILE CG2 . 10032 1 1344 . 1 1 114 114 ILE CD1 C 13 13.193 0.300 . 1 . . . . 114 ILE CD1 . 10032 1 1345 . 1 1 114 114 ILE N N 15 120.575 0.300 . 1 . . . . 114 ILE N . 10032 1 1346 . 1 1 115 115 THR H H 1 8.292 0.030 . 1 . . . . 115 THR H . 10032 1 1347 . 1 1 115 115 THR HA H 1 4.369 0.030 . 1 . . . . 115 THR HA . 10032 1 1348 . 1 1 115 115 THR HB H 1 4.157 0.030 . 1 . . . . 115 THR HB . 10032 1 1349 . 1 1 115 115 THR HG21 H 1 1.205 0.030 . 1 . . . . 115 THR HG2 . 10032 1 1350 . 1 1 115 115 THR HG22 H 1 1.205 0.030 . 1 . . . . 115 THR HG2 . 10032 1 1351 . 1 1 115 115 THR HG23 H 1 1.205 0.030 . 1 . . . . 115 THR HG2 . 10032 1 1352 . 1 1 115 115 THR C C 13 174.103 0.300 . 1 . . . . 115 THR C . 10032 1 1353 . 1 1 115 115 THR CA C 13 62.164 0.300 . 1 . . . . 115 THR CA . 10032 1 1354 . 1 1 115 115 THR CB C 13 69.840 0.300 . 1 . . . . 115 THR CB . 10032 1 1355 . 1 1 115 115 THR CG2 C 13 21.720 0.300 . 1 . . . . 115 THR CG2 . 10032 1 1356 . 1 1 115 115 THR N N 15 119.379 0.300 . 1 . . . . 115 THR N . 10032 1 1357 . 1 1 116 116 VAL H H 1 8.224 0.030 . 1 . . . . 116 VAL H . 10032 1 1358 . 1 1 116 116 VAL HA H 1 4.133 0.030 . 1 . . . . 116 VAL HA . 10032 1 1359 . 1 1 116 116 VAL HB H 1 2.042 0.030 . 1 . . . . 116 VAL HB . 10032 1 1360 . 1 1 116 116 VAL HG11 H 1 0.895 0.030 . 1 . . . . 116 VAL HG1 . 10032 1 1361 . 1 1 116 116 VAL HG12 H 1 0.895 0.030 . 1 . . . . 116 VAL HG1 . 10032 1 1362 . 1 1 116 116 VAL HG13 H 1 0.895 0.030 . 1 . . . . 116 VAL HG1 . 10032 1 1363 . 1 1 116 116 VAL HG21 H 1 0.939 0.030 . 1 . . . . 116 VAL HG2 . 10032 1 1364 . 1 1 116 116 VAL HG22 H 1 0.939 0.030 . 1 . . . . 116 VAL HG2 . 10032 1 1365 . 1 1 116 116 VAL HG23 H 1 0.939 0.030 . 1 . . . . 116 VAL HG2 . 10032 1 1366 . 1 1 116 116 VAL C C 13 175.675 0.300 . 1 . . . . 116 VAL C . 10032 1 1367 . 1 1 116 116 VAL CA C 13 62.151 0.300 . 1 . . . . 116 VAL CA . 10032 1 1368 . 1 1 116 116 VAL CB C 13 32.845 0.300 . 1 . . . . 116 VAL CB . 10032 1 1369 . 1 1 116 116 VAL CG1 C 13 21.123 0.300 . 2 . . . . 116 VAL CG1 . 10032 1 1370 . 1 1 116 116 VAL CG2 C 13 20.759 0.300 . 2 . . . . 116 VAL CG2 . 10032 1 1371 . 1 1 116 116 VAL N N 15 124.153 0.300 . 1 . . . . 116 VAL N . 10032 1 1372 . 1 1 117 117 ILE H H 1 8.335 0.030 . 1 . . . . 117 ILE H . 10032 1 1373 . 1 1 117 117 ILE HA H 1 4.470 0.030 . 1 . . . . 117 ILE HA . 10032 1 1374 . 1 1 117 117 ILE HB H 1 1.868 0.030 . 1 . . . . 117 ILE HB . 10032 1 1375 . 1 1 117 117 ILE HG12 H 1 1.509 0.030 . 2 . . . . 117 ILE HG12 . 10032 1 1376 . 1 1 117 117 ILE HG13 H 1 1.182 0.030 . 2 . . . . 117 ILE HG13 . 10032 1 1377 . 1 1 117 117 ILE HG21 H 1 0.944 0.030 . 1 . . . . 117 ILE HG2 . 10032 1 1378 . 1 1 117 117 ILE HG22 H 1 0.944 0.030 . 1 . . . . 117 ILE HG2 . 10032 1 1379 . 1 1 117 117 ILE HG23 H 1 0.944 0.030 . 1 . . . . 117 ILE HG2 . 10032 1 1380 . 1 1 117 117 ILE HD11 H 1 0.846 0.030 . 1 . . . . 117 ILE HD1 . 10032 1 1381 . 1 1 117 117 ILE HD12 H 1 0.846 0.030 . 1 . . . . 117 ILE HD1 . 10032 1 1382 . 1 1 117 117 ILE HD13 H 1 0.846 0.030 . 1 . . . . 117 ILE HD1 . 10032 1 1383 . 1 1 117 117 ILE C C 13 174.597 0.300 . 1 . . . . 117 ILE C . 10032 1 1384 . 1 1 117 117 ILE CA C 13 58.398 0.300 . 1 . . . . 117 ILE CA . 10032 1 1385 . 1 1 117 117 ILE CB C 13 38.501 0.300 . 1 . . . . 117 ILE CB . 10032 1 1386 . 1 1 117 117 ILE CG1 C 13 26.993 0.300 . 1 . . . . 117 ILE CG1 . 10032 1 1387 . 1 1 117 117 ILE CG2 C 13 17.058 0.300 . 1 . . . . 117 ILE CG2 . 10032 1 1388 . 1 1 117 117 ILE CD1 C 13 12.581 0.300 . 1 . . . . 117 ILE CD1 . 10032 1 1389 . 1 1 117 117 ILE N N 15 127.371 0.300 . 1 . . . . 117 ILE N . 10032 1 1390 . 1 1 118 118 PRO HA H 1 4.448 0.030 . 1 . . . . 118 PRO HA . 10032 1 1391 . 1 1 118 118 PRO HB2 H 1 2.309 0.030 . 2 . . . . 118 PRO HB2 . 10032 1 1392 . 1 1 118 118 PRO HB3 H 1 1.940 0.030 . 2 . . . . 118 PRO HB3 . 10032 1 1393 . 1 1 118 118 PRO HG2 H 1 1.977 0.030 . 1 . . . . 118 PRO HG2 . 10032 1 1394 . 1 1 118 118 PRO HG3 H 1 1.977 0.030 . 1 . . . . 118 PRO HG3 . 10032 1 1395 . 1 1 118 118 PRO HD2 H 1 3.668 0.030 . 2 . . . . 118 PRO HD2 . 10032 1 1396 . 1 1 118 118 PRO HD3 H 1 3.929 0.030 . 2 . . . . 118 PRO HD3 . 10032 1 1397 . 1 1 118 118 PRO C C 13 176.860 0.300 . 1 . . . . 118 PRO C . 10032 1 1398 . 1 1 118 118 PRO CA C 13 63.223 0.300 . 1 . . . . 118 PRO CA . 10032 1 1399 . 1 1 118 118 PRO CB C 13 32.244 0.300 . 1 . . . . 118 PRO CB . 10032 1 1400 . 1 1 118 118 PRO CG C 13 27.427 0.300 . 1 . . . . 118 PRO CG . 10032 1 1401 . 1 1 118 118 PRO CD C 13 51.191 0.300 . 1 . . . . 118 PRO CD . 10032 1 1402 . 1 1 119 119 SER H H 1 8.417 0.030 . 1 . . . . 119 SER H . 10032 1 1403 . 1 1 119 119 SER HA H 1 4.413 0.030 . 1 . . . . 119 SER HA . 10032 1 1404 . 1 1 119 119 SER HB2 H 1 3.879 0.030 . 2 . . . . 119 SER HB2 . 10032 1 1405 . 1 1 119 119 SER C C 13 175.249 0.300 . 1 . . . . 119 SER C . 10032 1 1406 . 1 1 119 119 SER CA C 13 58.704 0.300 . 1 . . . . 119 SER CA . 10032 1 1407 . 1 1 119 119 SER CB C 13 63.734 0.300 . 1 . . . . 119 SER CB . 10032 1 1408 . 1 1 119 119 SER N N 15 116.314 0.300 . 1 . . . . 119 SER N . 10032 1 1409 . 1 1 120 120 GLY H H 1 8.421 0.030 . 1 . . . . 120 GLY H . 10032 1 1410 . 1 1 120 120 GLY HA2 H 1 3.936 0.030 . 1 . . . . 120 GLY HA2 . 10032 1 1411 . 1 1 120 120 GLY HA3 H 1 3.936 0.030 . 1 . . . . 120 GLY HA3 . 10032 1 1412 . 1 1 120 120 GLY C C 13 173.871 0.300 . 1 . . . . 120 GLY C . 10032 1 1413 . 1 1 120 120 GLY CA C 13 45.310 0.300 . 1 . . . . 120 GLY CA . 10032 1 1414 . 1 1 120 120 GLY N N 15 110.840 0.300 . 1 . . . . 120 GLY N . 10032 1 1415 . 1 1 121 121 PHE H H 1 8.123 0.030 . 1 . . . . 121 PHE H . 10032 1 1416 . 1 1 121 121 PHE HA H 1 4.679 0.030 . 1 . . . . 121 PHE HA . 10032 1 1417 . 1 1 121 121 PHE HB2 H 1 3.059 0.030 . 2 . . . . 121 PHE HB2 . 10032 1 1418 . 1 1 121 121 PHE HB3 H 1 3.132 0.030 . 2 . . . . 121 PHE HB3 . 10032 1 1419 . 1 1 121 121 PHE HD1 H 1 7.265 0.030 . 1 . . . . 121 PHE HD1 . 10032 1 1420 . 1 1 121 121 PHE HD2 H 1 7.265 0.030 . 1 . . . . 121 PHE HD2 . 10032 1 1421 . 1 1 121 121 PHE HE1 H 1 7.366 0.030 . 1 . . . . 121 PHE HE1 . 10032 1 1422 . 1 1 121 121 PHE HE2 H 1 7.366 0.030 . 1 . . . . 121 PHE HE2 . 10032 1 1423 . 1 1 121 121 PHE HZ H 1 7.315 0.030 . 1 . . . . 121 PHE HZ . 10032 1 1424 . 1 1 121 121 PHE C C 13 175.804 0.300 . 1 . . . . 121 PHE C . 10032 1 1425 . 1 1 121 121 PHE CA C 13 57.894 0.300 . 1 . . . . 121 PHE CA . 10032 1 1426 . 1 1 121 121 PHE CB C 13 39.861 0.300 . 1 . . . . 121 PHE CB . 10032 1 1427 . 1 1 121 121 PHE CD1 C 13 131.837 0.300 . 1 . . . . 121 PHE CD1 . 10032 1 1428 . 1 1 121 121 PHE CD2 C 13 131.837 0.300 . 1 . . . . 121 PHE CD2 . 10032 1 1429 . 1 1 121 121 PHE CE1 C 13 131.511 0.300 . 1 . . . . 121 PHE CE1 . 10032 1 1430 . 1 1 121 121 PHE CE2 C 13 131.511 0.300 . 1 . . . . 121 PHE CE2 . 10032 1 1431 . 1 1 121 121 PHE CZ C 13 129.843 0.300 . 1 . . . . 121 PHE CZ . 10032 1 1432 . 1 1 121 121 PHE N N 15 120.346 0.300 . 1 . . . . 121 PHE N . 10032 1 1433 . 1 1 122 122 SER H H 1 8.281 0.030 . 1 . . . . 122 SER H . 10032 1 1434 . 1 1 122 122 SER HA H 1 4.490 0.030 . 1 . . . . 122 SER HA . 10032 1 1435 . 1 1 122 122 SER HB2 H 1 3.799 0.030 . 2 . . . . 122 SER HB2 . 10032 1 1436 . 1 1 122 122 SER C C 13 174.120 0.300 . 1 . . . . 122 SER C . 10032 1 1437 . 1 1 122 122 SER CA C 13 57.995 0.300 . 1 . . . . 122 SER CA . 10032 1 1438 . 1 1 122 122 SER CB C 13 63.899 0.300 . 1 . . . . 122 SER CB . 10032 1 1439 . 1 1 122 122 SER N N 15 118.404 0.300 . 1 . . . . 122 SER N . 10032 1 1440 . 1 1 123 123 GLY H H 1 7.764 0.030 . 1 . . . . 123 GLY H . 10032 1 1441 . 1 1 123 123 GLY HA2 H 1 4.074 0.030 . 2 . . . . 123 GLY HA2 . 10032 1 1442 . 1 1 123 123 GLY C C 13 171.526 0.300 . 1 . . . . 123 GLY C . 10032 1 1443 . 1 1 123 123 GLY CA C 13 44.686 0.300 . 1 . . . . 123 GLY CA . 10032 1 1444 . 1 1 123 123 GLY N N 15 110.425 0.300 . 1 . . . . 123 GLY N . 10032 1 1445 . 1 1 124 124 PRO HA H 1 4.493 0.030 . 1 . . . . 124 PRO HA . 10032 1 1446 . 1 1 124 124 PRO HB2 H 1 2.274 0.030 . 2 . . . . 124 PRO HB2 . 10032 1 1447 . 1 1 124 124 PRO HB3 H 1 1.937 0.030 . 2 . . . . 124 PRO HB3 . 10032 1 1448 . 1 1 124 124 PRO HG2 H 1 1.970 0.030 . 2 . . . . 124 PRO HG2 . 10032 1 1449 . 1 1 124 124 PRO HD2 H 1 3.642 0.030 . 1 . . . . 124 PRO HD2 . 10032 1 1450 . 1 1 124 124 PRO HD3 H 1 3.642 0.030 . 1 . . . . 124 PRO HD3 . 10032 1 1451 . 1 1 124 124 PRO C C 13 177.346 0.300 . 1 . . . . 124 PRO C . 10032 1 1452 . 1 1 124 124 PRO CA C 13 63.261 0.300 . 1 . . . . 124 PRO CA . 10032 1 1453 . 1 1 124 124 PRO CB C 13 32.163 0.300 . 1 . . . . 124 PRO CB . 10032 1 1454 . 1 1 124 124 PRO CG C 13 27.135 0.300 . 1 . . . . 124 PRO CG . 10032 1 1455 . 1 1 124 124 PRO CD C 13 49.788 0.300 . 1 . . . . 124 PRO CD . 10032 1 1456 . 1 1 125 125 SER H H 1 8.515 0.030 . 1 . . . . 125 SER H . 10032 1 1457 . 1 1 125 125 SER HA H 1 4.489 0.030 . 1 . . . . 125 SER HA . 10032 1 1458 . 1 1 125 125 SER HB2 H 1 3.895 0.030 . 2 . . . . 125 SER HB2 . 10032 1 1459 . 1 1 125 125 SER C C 13 174.666 0.300 . 1 . . . . 125 SER C . 10032 1 1460 . 1 1 125 125 SER CA C 13 58.460 0.300 . 1 . . . . 125 SER CA . 10032 1 1461 . 1 1 125 125 SER CB C 13 63.817 0.300 . 1 . . . . 125 SER CB . 10032 1 1462 . 1 1 125 125 SER N N 15 116.319 0.300 . 1 . . . . 125 SER N . 10032 1 1463 . 1 1 126 126 SER H H 1 8.314 0.030 . 1 . . . . 126 SER H . 10032 1 1464 . 1 1 126 126 SER HA H 1 4.473 0.030 . 1 . . . . 126 SER HA . 10032 1 1465 . 1 1 126 126 SER HB2 H 1 3.863 0.030 . 2 . . . . 126 SER HB2 . 10032 1 1466 . 1 1 126 126 SER C C 13 173.940 0.300 . 1 . . . . 126 SER C . 10032 1 1467 . 1 1 126 126 SER CA C 13 58.437 0.300 . 1 . . . . 126 SER CA . 10032 1 1468 . 1 1 126 126 SER CB C 13 63.817 0.300 . 1 . . . . 126 SER CB . 10032 1 1469 . 1 1 126 126 SER N N 15 117.822 0.300 . 1 . . . . 126 SER N . 10032 1 1470 . 1 1 127 127 GLY H H 1 8.046 0.030 . 1 . . . . 127 GLY H . 10032 1 1471 . 1 1 127 127 GLY HA2 H 1 4.043 0.030 . 2 . . . . 127 GLY HA2 . 10032 1 1472 . 1 1 127 127 GLY C C 13 179.057 0.300 . 1 . . . . 127 GLY C . 10032 1 1473 . 1 1 127 127 GLY CA C 13 45.436 0.300 . 1 . . . . 127 GLY CA . 10032 1 1474 . 1 1 127 127 GLY N N 15 116.865 0.300 . 1 . . . . 127 GLY N . 10032 1 stop_ save_