data_15232 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15232 _Entry.Title ; proline-free mutant of SNase V8 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-05-02 _Entry.Accession_date 2007-05-02 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Lu Shan . . . 15232 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15232 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 371 15232 '15N chemical shifts' 127 15232 '1H chemical shifts' 666 15232 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2010-05-26 2007-05-02 update BMRB 'update entity name' 15232 1 . . 2007-10-29 2007-05-02 original author 'original release' 15232 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2PQE 'BMRB Entry Tracking System' 15232 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15232 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17887731 _Citation.Full_citation . _Citation.Title 'Restricted backbone conformational and motional flexibilities of loops containing peptidyl-proline bonds dominate the enzyme activity of staphylococcal nuclease(,).' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 46 _Citation.Journal_issue 41 _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 11504 _Citation.Page_last 11513 _Citation.Year 2007 _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 Lu Shan . . . 15232 1 2 Yufeng Tong . . . 15232 1 3 Tao Xie . . . 15232 1 4 Min Wang . . . 15232 1 5 Jinfeng Wang . . . 15232 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15232 _Assembly.ID 1 _Assembly.Name v8pf _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 v8pf 1 $entity A . yes native no no . . . 15232 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 2PQE . . 'solution NMR' . . . 15232 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 15232 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name v8pf _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ATSTKKLHKEAATLIKAIDG DTVKLMYKGQAMTFRLLLVD TAETKHTKKGVEKYGAEASA FTKKMVENAKKIEVEFDKGQ RTDKYGRGLAYIYADGKMVN EALVRQGLAKVAYVYKGNNT HEQLLRKSEAQAKKEKLNIW SEDNADSGQ ; _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 149 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16678.268 _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 2PQE . "Solution Structure Of Proline-Free Mutant Of Staphylococcal Nuclease" . . . . . 100.00 149 100.00 100.00 1.74e-101 . . . . 15232 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 . ALA . 15232 1 2 . THR . 15232 1 3 . SER . 15232 1 4 . THR . 15232 1 5 . LYS . 15232 1 6 . LYS . 15232 1 7 . LEU . 15232 1 8 . HIS . 15232 1 9 . LYS . 15232 1 10 . GLU . 15232 1 11 . ALA . 15232 1 12 . ALA . 15232 1 13 . THR . 15232 1 14 . LEU . 15232 1 15 . ILE . 15232 1 16 . LYS . 15232 1 17 . ALA . 15232 1 18 . ILE . 15232 1 19 . ASP . 15232 1 20 . GLY . 15232 1 21 . ASP . 15232 1 22 . THR . 15232 1 23 . VAL . 15232 1 24 . LYS . 15232 1 25 . LEU . 15232 1 26 . MET . 15232 1 27 . TYR . 15232 1 28 . LYS . 15232 1 29 . GLY . 15232 1 30 . GLN . 15232 1 31 . ALA . 15232 1 32 . MET . 15232 1 33 . THR . 15232 1 34 . PHE . 15232 1 35 . ARG . 15232 1 36 . LEU . 15232 1 37 . LEU . 15232 1 38 . LEU . 15232 1 39 . VAL . 15232 1 40 . ASP . 15232 1 41 . THR . 15232 1 42 . ALA . 15232 1 43 . GLU . 15232 1 44 . THR . 15232 1 45 . LYS . 15232 1 46 . HIS . 15232 1 47 . THR . 15232 1 48 . LYS . 15232 1 49 . LYS . 15232 1 50 . GLY . 15232 1 51 . VAL . 15232 1 52 . GLU . 15232 1 53 . LYS . 15232 1 54 . TYR . 15232 1 55 . GLY . 15232 1 56 . ALA . 15232 1 57 . GLU . 15232 1 58 . ALA . 15232 1 59 . SER . 15232 1 60 . ALA . 15232 1 61 . PHE . 15232 1 62 . THR . 15232 1 63 . LYS . 15232 1 64 . LYS . 15232 1 65 . MET . 15232 1 66 . VAL . 15232 1 67 . GLU . 15232 1 68 . ASN . 15232 1 69 . ALA . 15232 1 70 . LYS . 15232 1 71 . LYS . 15232 1 72 . ILE . 15232 1 73 . GLU . 15232 1 74 . VAL . 15232 1 75 . GLU . 15232 1 76 . PHE . 15232 1 77 . ASP . 15232 1 78 . LYS . 15232 1 79 . GLY . 15232 1 80 . GLN . 15232 1 81 . ARG . 15232 1 82 . THR . 15232 1 83 . ASP . 15232 1 84 . LYS . 15232 1 85 . TYR . 15232 1 86 . GLY . 15232 1 87 . ARG . 15232 1 88 . GLY . 15232 1 89 . LEU . 15232 1 90 . ALA . 15232 1 91 . TYR . 15232 1 92 . ILE . 15232 1 93 . TYR . 15232 1 94 . ALA . 15232 1 95 . ASP . 15232 1 96 . GLY . 15232 1 97 . LYS . 15232 1 98 . MET . 15232 1 99 . VAL . 15232 1 100 . ASN . 15232 1 101 . GLU . 15232 1 102 . ALA . 15232 1 103 . LEU . 15232 1 104 . VAL . 15232 1 105 . ARG . 15232 1 106 . GLN . 15232 1 107 . GLY . 15232 1 108 . LEU . 15232 1 109 . ALA . 15232 1 110 . LYS . 15232 1 111 . VAL . 15232 1 112 . ALA . 15232 1 113 . TYR . 15232 1 114 . VAL . 15232 1 115 . TYR . 15232 1 116 . LYS . 15232 1 117 . GLY . 15232 1 118 . ASN . 15232 1 119 . ASN . 15232 1 120 . THR . 15232 1 121 . HIS . 15232 1 122 . GLU . 15232 1 123 . GLN . 15232 1 124 . LEU . 15232 1 125 . LEU . 15232 1 126 . ARG . 15232 1 127 . LYS . 15232 1 128 . SER . 15232 1 129 . GLU . 15232 1 130 . ALA . 15232 1 131 . GLN . 15232 1 132 . ALA . 15232 1 133 . LYS . 15232 1 134 . LYS . 15232 1 135 . GLU . 15232 1 136 . LYS . 15232 1 137 . LEU . 15232 1 138 . ASN . 15232 1 139 . ILE . 15232 1 140 . TRP . 15232 1 141 . SER . 15232 1 142 . GLU . 15232 1 143 . ASP . 15232 1 144 . ASN . 15232 1 145 . ALA . 15232 1 146 . ASP . 15232 1 147 . SER . 15232 1 148 . GLY . 15232 1 149 . GLN . 15232 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 . ALA 1 1 15232 1 . THR 2 2 15232 1 . SER 3 3 15232 1 . THR 4 4 15232 1 . LYS 5 5 15232 1 . LYS 6 6 15232 1 . LEU 7 7 15232 1 . HIS 8 8 15232 1 . LYS 9 9 15232 1 . GLU 10 10 15232 1 . ALA 11 11 15232 1 . ALA 12 12 15232 1 . THR 13 13 15232 1 . LEU 14 14 15232 1 . ILE 15 15 15232 1 . LYS 16 16 15232 1 . ALA 17 17 15232 1 . ILE 18 18 15232 1 . ASP 19 19 15232 1 . GLY 20 20 15232 1 . ASP 21 21 15232 1 . THR 22 22 15232 1 . VAL 23 23 15232 1 . LYS 24 24 15232 1 . LEU 25 25 15232 1 . MET 26 26 15232 1 . TYR 27 27 15232 1 . LYS 28 28 15232 1 . GLY 29 29 15232 1 . GLN 30 30 15232 1 . ALA 31 31 15232 1 . MET 32 32 15232 1 . THR 33 33 15232 1 . PHE 34 34 15232 1 . ARG 35 35 15232 1 . LEU 36 36 15232 1 . LEU 37 37 15232 1 . LEU 38 38 15232 1 . VAL 39 39 15232 1 . ASP 40 40 15232 1 . THR 41 41 15232 1 . ALA 42 42 15232 1 . GLU 43 43 15232 1 . THR 44 44 15232 1 . LYS 45 45 15232 1 . HIS 46 46 15232 1 . THR 47 47 15232 1 . LYS 48 48 15232 1 . LYS 49 49 15232 1 . GLY 50 50 15232 1 . VAL 51 51 15232 1 . GLU 52 52 15232 1 . LYS 53 53 15232 1 . TYR 54 54 15232 1 . GLY 55 55 15232 1 . ALA 56 56 15232 1 . GLU 57 57 15232 1 . ALA 58 58 15232 1 . SER 59 59 15232 1 . ALA 60 60 15232 1 . PHE 61 61 15232 1 . THR 62 62 15232 1 . LYS 63 63 15232 1 . LYS 64 64 15232 1 . MET 65 65 15232 1 . VAL 66 66 15232 1 . GLU 67 67 15232 1 . ASN 68 68 15232 1 . ALA 69 69 15232 1 . LYS 70 70 15232 1 . LYS 71 71 15232 1 . ILE 72 72 15232 1 . GLU 73 73 15232 1 . VAL 74 74 15232 1 . GLU 75 75 15232 1 . PHE 76 76 15232 1 . ASP 77 77 15232 1 . LYS 78 78 15232 1 . GLY 79 79 15232 1 . GLN 80 80 15232 1 . ARG 81 81 15232 1 . THR 82 82 15232 1 . ASP 83 83 15232 1 . LYS 84 84 15232 1 . TYR 85 85 15232 1 . GLY 86 86 15232 1 . ARG 87 87 15232 1 . GLY 88 88 15232 1 . LEU 89 89 15232 1 . ALA 90 90 15232 1 . TYR 91 91 15232 1 . ILE 92 92 15232 1 . TYR 93 93 15232 1 . ALA 94 94 15232 1 . ASP 95 95 15232 1 . GLY 96 96 15232 1 . LYS 97 97 15232 1 . MET 98 98 15232 1 . VAL 99 99 15232 1 . ASN 100 100 15232 1 . GLU 101 101 15232 1 . ALA 102 102 15232 1 . LEU 103 103 15232 1 . VAL 104 104 15232 1 . ARG 105 105 15232 1 . GLN 106 106 15232 1 . GLY 107 107 15232 1 . LEU 108 108 15232 1 . ALA 109 109 15232 1 . LYS 110 110 15232 1 . VAL 111 111 15232 1 . ALA 112 112 15232 1 . TYR 113 113 15232 1 . VAL 114 114 15232 1 . TYR 115 115 15232 1 . LYS 116 116 15232 1 . GLY 117 117 15232 1 . ASN 118 118 15232 1 . ASN 119 119 15232 1 . THR 120 120 15232 1 . HIS 121 121 15232 1 . GLU 122 122 15232 1 . GLN 123 123 15232 1 . LEU 124 124 15232 1 . LEU 125 125 15232 1 . ARG 126 126 15232 1 . LYS 127 127 15232 1 . SER 128 128 15232 1 . GLU 129 129 15232 1 . ALA 130 130 15232 1 . GLN 131 131 15232 1 . ALA 132 132 15232 1 . LYS 133 133 15232 1 . LYS 134 134 15232 1 . GLU 135 135 15232 1 . LYS 136 136 15232 1 . LEU 137 137 15232 1 . ASN 138 138 15232 1 . ILE 139 139 15232 1 . TRP 140 140 15232 1 . SER 141 141 15232 1 . GLU 142 142 15232 1 . ASP 143 143 15232 1 . ASN 144 144 15232 1 . ALA 145 145 15232 1 . ASP 146 146 15232 1 . SER 147 147 15232 1 . GLY 148 148 15232 1 . GLN 149 149 15232 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 15232 _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 . 1280 organism . 'Staphylococcus aureus' 'Staphylococcus aureus' . . Bacteria . Staphylococcus aureus . . . . . . . . . . . . . . . . . . . . . 15232 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 15232 _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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21DE3 . . . . . . . . . . . . . . . PET3D . . . . . . 15232 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15232 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM proteins, 100 mM KCl and 50 mM deuterated acetate buffer, pH 5.0' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1 . . mM . . . . 15232 1 2 KCL . . . . . . . 100 . . mM . . . . 15232 1 3 D2O . . . . . . . 10 . . % . . . . 15232 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15232 1 5 acetate . . . . . . . 59 . . mM . . . . 15232 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15232 _Sample_condition_list.ID 1 _Sample_condition_list.Details '1 mM proteins, 100 mM KCl and 50 mM deuterated acetate buffer, pH 5.0' 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' 100 . mM 15232 1 pH 5.0 . pH 15232 1 pressure 1 . atm 15232 1 temperature 300 . K 15232 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 15232 _Software.ID 1 _Software.Name FELIX _Software.Version 98 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 15232 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15232 1 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 15232 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15232 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DMX . 600 . . . 15232 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15232 _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 HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15232 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15232 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15232 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15232 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15232 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15232 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 15232 1 5 '3D HNCO' . . . 15232 1 6 '3D HCCH-TOCSY' . . . 15232 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 3 3 SER H H 1 8.559 0.020 . 1 . . . . 3 SER H . 15232 1 2 . 1 1 3 3 SER HA H 1 4.592 0.020 . 1 . . . . 3 SER HA . 15232 1 3 . 1 1 3 3 SER HB2 H 1 3.926 0.020 . 1 . . . . 3 SER HB2 . 15232 1 4 . 1 1 3 3 SER CA C 13 58.094 0.300 . 1 . . . . 3 SER CA . 15232 1 5 . 1 1 3 3 SER CB C 13 63.978 0.300 . 1 . . . . 3 SER CB . 15232 1 6 . 1 1 3 3 SER N N 15 119.090 0.200 . 1 . . . . 3 SER N . 15232 1 7 . 1 1 4 4 THR H H 1 8.348 0.020 . 1 . . . . 4 THR H . 15232 1 8 . 1 1 4 4 THR HA H 1 4.382 0.020 . 1 . . . . 4 THR HA . 15232 1 9 . 1 1 4 4 THR HB H 1 4.262 0.020 . 1 . . . . 4 THR HB . 15232 1 10 . 1 1 4 4 THR HG21 H 1 1.242 0.020 . 1 . . . . 4 THR HG2 . 15232 1 11 . 1 1 4 4 THR HG22 H 1 1.242 0.020 . 1 . . . . 4 THR HG2 . 15232 1 12 . 1 1 4 4 THR HG23 H 1 1.242 0.020 . 1 . . . . 4 THR HG2 . 15232 1 13 . 1 1 4 4 THR CA C 13 61.983 0.300 . 1 . . . . 4 THR CA . 15232 1 14 . 1 1 4 4 THR CB C 13 69.725 0.300 . 1 . . . . 4 THR CB . 15232 1 15 . 1 1 4 4 THR N N 15 116.912 0.200 . 1 . . . . 4 THR N . 15232 1 16 . 1 1 5 5 LYS H H 1 8.372 0.020 . 1 . . . . 5 LYS H . 15232 1 17 . 1 1 5 5 LYS HA H 1 4.382 0.020 . 1 . . . . 5 LYS HA . 15232 1 18 . 1 1 5 5 LYS HB3 H 1 1.798 0.020 . 1 . . . . 5 LYS HB3 . 15232 1 19 . 1 1 5 5 LYS HG2 H 1 1.493 0.020 . 1 . . . . 5 LYS HG2 . 15232 1 20 . 1 1 5 5 LYS CA C 13 56.343 0.300 . 1 . . . . 5 LYS CA . 15232 1 21 . 1 1 5 5 LYS CB C 13 33.051 0.300 . 1 . . . . 5 LYS CB . 15232 1 22 . 1 1 5 5 LYS CD C 13 29.006 0.300 . 1 . . . . 5 LYS CD . 15232 1 23 . 1 1 5 5 LYS CG C 13 24.869 0.300 . 1 . . . . 5 LYS CG . 15232 1 24 . 1 1 5 5 LYS N N 15 124.167 0.200 . 1 . . . . 5 LYS N . 15232 1 25 . 1 1 6 6 LYS H H 1 8.281 0.020 . 1 . . . . 6 LYS H . 15232 1 26 . 1 1 6 6 LYS HA H 1 4.381 0.020 . 1 . . . . 6 LYS HA . 15232 1 27 . 1 1 6 6 LYS HB3 H 1 1.750 0.020 . 1 . . . . 6 LYS HB3 . 15232 1 28 . 1 1 6 6 LYS HG2 H 1 1.496 0.020 . 1 . . . . 6 LYS HG2 . 15232 1 29 . 1 1 6 6 LYS CA C 13 55.989 0.300 . 1 . . . . 6 LYS CA . 15232 1 30 . 1 1 6 6 LYS CB C 13 33.546 0.300 . 1 . . . . 6 LYS CB . 15232 1 31 . 1 1 6 6 LYS CD C 13 29.188 0.300 . 1 . . . . 6 LYS CD . 15232 1 32 . 1 1 6 6 LYS CG C 13 24.728 0.300 . 1 . . . . 6 LYS CG . 15232 1 33 . 1 1 6 6 LYS N N 15 122.691 0.200 . 1 . . . . 6 LYS N . 15232 1 34 . 1 1 7 7 LEU H H 1 8.435 0.020 . 1 . . . . 7 LEU H . 15232 1 35 . 1 1 7 7 LEU HA H 1 4.537 0.020 . 1 . . . . 7 LEU HA . 15232 1 36 . 1 1 7 7 LEU HB2 H 1 1.765 0.020 . 1 . . . . 7 LEU HB2 . 15232 1 37 . 1 1 7 7 LEU CA C 13 54.649 0.300 . 1 . . . . 7 LEU CA . 15232 1 38 . 1 1 7 7 LEU CB C 13 41.299 0.300 . 1 . . . . 7 LEU CB . 15232 1 39 . 1 1 7 7 LEU CD1 C 13 21.536 0.300 . 1 . . . . 7 LEU CD1 . 15232 1 40 . 1 1 7 7 LEU CD2 C 13 24.708 0.300 . 1 . . . . 7 LEU CD2 . 15232 1 41 . 1 1 7 7 LEU CG C 13 27.534 0.300 . 1 . . . . 7 LEU CG . 15232 1 42 . 1 1 7 7 LEU N N 15 122.669 0.200 . 1 . . . . 7 LEU N . 15232 1 43 . 1 1 8 8 HIS H H 1 8.931 0.020 . 1 . . . . 8 HIS H . 15232 1 44 . 1 1 8 8 HIS HA H 1 4.994 0.020 . 1 . . . . 8 HIS HA . 15232 1 45 . 1 1 8 8 HIS HB2 H 1 3.267 0.020 . 1 . . . . 8 HIS HB2 . 15232 1 46 . 1 1 8 8 HIS CA C 13 54.855 0.300 . 1 . . . . 8 HIS CA . 15232 1 47 . 1 1 8 8 HIS CB C 13 31.009 0.300 . 1 . . . . 8 HIS CB . 15232 1 48 . 1 1 8 8 HIS N N 15 117.958 0.200 . 1 . . . . 8 HIS N . 15232 1 49 . 1 1 9 9 LYS H H 1 8.617 0.020 . 1 . . . . 9 LYS H . 15232 1 50 . 1 1 9 9 LYS HA H 1 4.756 0.020 . 1 . . . . 9 LYS HA . 15232 1 51 . 1 1 9 9 LYS HB2 H 1 1.530 0.020 . 1 . . . . 9 LYS HB2 . 15232 1 52 . 1 1 9 9 LYS HB3 H 1 1.436 0.020 . 1 . . . . 9 LYS HB3 . 15232 1 53 . 1 1 9 9 LYS HG3 H 1 1.326 0.020 . 1 . . . . 9 LYS HG3 . 15232 1 54 . 1 1 9 9 LYS CA C 13 56.131 0.300 . 1 . . . . 9 LYS CA . 15232 1 55 . 1 1 9 9 LYS CB C 13 34.676 0.300 . 1 . . . . 9 LYS CB . 15232 1 56 . 1 1 9 9 LYS CD C 13 29.171 0.300 . 1 . . . . 9 LYS CD . 15232 1 57 . 1 1 9 9 LYS CE C 13 41.852 0.300 . 1 . . . . 9 LYS CE . 15232 1 58 . 1 1 9 9 LYS N N 15 124.238 0.200 . 1 . . . . 9 LYS N . 15232 1 59 . 1 1 10 10 GLU H H 1 9.351 0.020 . 1 . . . . 10 GLU H . 15232 1 60 . 1 1 10 10 GLU HA H 1 4.786 0.020 . 1 . . . . 10 GLU HA . 15232 1 61 . 1 1 10 10 GLU HB3 H 1 2.192 0.020 . 1 . . . . 10 GLU HB3 . 15232 1 62 . 1 1 10 10 GLU HG2 H 1 2.406 0.020 . 1 . . . . 10 GLU HG2 . 15232 1 63 . 1 1 10 10 GLU CA C 13 54.904 0.300 . 1 . . . . 10 GLU CA . 15232 1 64 . 1 1 10 10 GLU CB C 13 34.351 0.300 . 1 . . . . 10 GLU CB . 15232 1 65 . 1 1 10 10 GLU CG C 13 37.231 0.300 . 1 . . . . 10 GLU CG . 15232 1 66 . 1 1 10 10 GLU N N 15 122.364 0.200 . 1 . . . . 10 GLU N . 15232 1 67 . 1 1 11 11 ALA H H 1 8.718 0.020 . 1 . . . . 11 ALA H . 15232 1 68 . 1 1 11 11 ALA HA H 1 4.652 0.020 . 1 . . . . 11 ALA HA . 15232 1 69 . 1 1 11 11 ALA HB1 H 1 1.548 0.020 . 1 . . . . 11 ALA HB . 15232 1 70 . 1 1 11 11 ALA HB2 H 1 1.548 0.020 . 1 . . . . 11 ALA HB . 15232 1 71 . 1 1 11 11 ALA HB3 H 1 1.548 0.020 . 1 . . . . 11 ALA HB . 15232 1 72 . 1 1 11 11 ALA CA C 13 53.200 0.300 . 1 . . . . 11 ALA CA . 15232 1 73 . 1 1 11 11 ALA CB C 13 20.067 0.300 . 1 . . . . 11 ALA CB . 15232 1 74 . 1 1 11 11 ALA N N 15 125.357 0.200 . 1 . . . . 11 ALA N . 15232 1 75 . 1 1 12 12 ALA H H 1 8.181 0.020 . 1 . . . . 12 ALA H . 15232 1 76 . 1 1 12 12 ALA HA H 1 5.043 0.020 . 1 . . . . 12 ALA HA . 15232 1 77 . 1 1 12 12 ALA HB1 H 1 1.352 0.020 . 1 . . . . 12 ALA HB . 15232 1 78 . 1 1 12 12 ALA HB2 H 1 1.352 0.020 . 1 . . . . 12 ALA HB . 15232 1 79 . 1 1 12 12 ALA HB3 H 1 1.352 0.020 . 1 . . . . 12 ALA HB . 15232 1 80 . 1 1 12 12 ALA CA C 13 51.478 0.300 . 1 . . . . 12 ALA CA . 15232 1 81 . 1 1 12 12 ALA CB C 13 24.681 0.300 . 1 . . . . 12 ALA CB . 15232 1 82 . 1 1 12 12 ALA N N 15 120.598 0.200 . 1 . . . . 12 ALA N . 15232 1 83 . 1 1 13 13 THR H H 1 8.204 0.020 . 1 . . . . 13 THR H . 15232 1 84 . 1 1 13 13 THR HA H 1 4.703 0.020 . 1 . . . . 13 THR HA . 15232 1 85 . 1 1 13 13 THR HB H 1 4.113 0.020 . 1 . . . . 13 THR HB . 15232 1 86 . 1 1 13 13 THR HG21 H 1 1.289 0.020 . 1 . . . . 13 THR HG2 . 15232 1 87 . 1 1 13 13 THR HG22 H 1 1.289 0.020 . 1 . . . . 13 THR HG2 . 15232 1 88 . 1 1 13 13 THR HG23 H 1 1.289 0.020 . 1 . . . . 13 THR HG2 . 15232 1 89 . 1 1 13 13 THR CA C 13 60.598 0.300 . 1 . . . . 13 THR CA . 15232 1 90 . 1 1 13 13 THR CB C 13 71.532 0.300 . 1 . . . . 13 THR CB . 15232 1 91 . 1 1 13 13 THR CG2 C 13 22.032 0.300 . 1 . . . . 13 THR CG2 . 15232 1 92 . 1 1 13 13 THR N N 15 109.092 0.200 . 1 . . . . 13 THR N . 15232 1 93 . 1 1 14 14 LEU H H 1 9.200 0.020 . 1 . . . . 14 LEU H . 15232 1 94 . 1 1 14 14 LEU HA H 1 4.130 0.020 . 1 . . . . 14 LEU HA . 15232 1 95 . 1 1 14 14 LEU HB2 H 1 1.829 0.020 . 1 . . . . 14 LEU HB2 . 15232 1 96 . 1 1 14 14 LEU HB3 H 1 1.152 0.020 . 1 . . . . 14 LEU HB3 . 15232 1 97 . 1 1 14 14 LEU HD11 H 1 0.737 0.020 . 1 . . . . 14 LEU HD1 . 15232 1 98 . 1 1 14 14 LEU HD12 H 1 0.737 0.020 . 1 . . . . 14 LEU HD1 . 15232 1 99 . 1 1 14 14 LEU HD13 H 1 0.737 0.020 . 1 . . . . 14 LEU HD1 . 15232 1 100 . 1 1 14 14 LEU HD21 H 1 0.904 0.020 . 1 . . . . 14 LEU HD2 . 15232 1 101 . 1 1 14 14 LEU HD22 H 1 0.904 0.020 . 1 . . . . 14 LEU HD2 . 15232 1 102 . 1 1 14 14 LEU HD23 H 1 0.904 0.020 . 1 . . . . 14 LEU HD2 . 15232 1 103 . 1 1 14 14 LEU CA C 13 56.716 0.300 . 1 . . . . 14 LEU CA . 15232 1 104 . 1 1 14 14 LEU CB C 13 42.945 0.300 . 1 . . . . 14 LEU CB . 15232 1 105 . 1 1 14 14 LEU CD1 C 13 23.108 0.300 . 1 . . . . 14 LEU CD1 . 15232 1 106 . 1 1 14 14 LEU CG C 13 26.970 0.300 . 1 . . . . 14 LEU CG . 15232 1 107 . 1 1 14 14 LEU N N 15 125.088 0.200 . 1 . . . . 14 LEU N . 15232 1 108 . 1 1 15 15 ILE H H 1 8.509 0.020 . 1 . . . . 15 ILE H . 15232 1 109 . 1 1 15 15 ILE HA H 1 4.248 0.020 . 1 . . . . 15 ILE HA . 15232 1 110 . 1 1 15 15 ILE HB H 1 1.340 0.020 . 1 . . . . 15 ILE HB . 15232 1 111 . 1 1 15 15 ILE HG12 H 1 1.620 0.020 . 1 . . . . 15 ILE HG12 . 15232 1 112 . 1 1 15 15 ILE HG13 H 1 1.032 0.020 . 1 . . . . 15 ILE HG13 . 15232 1 113 . 1 1 15 15 ILE CA C 13 64.017 0.300 . 1 . . . . 15 ILE CA . 15232 1 114 . 1 1 15 15 ILE CB C 13 38.868 0.300 . 1 . . . . 15 ILE CB . 15232 1 115 . 1 1 15 15 ILE CD1 C 13 14.468 0.300 . 1 . . . . 15 ILE CD1 . 15232 1 116 . 1 1 15 15 ILE CG1 C 13 27.643 0.300 . 1 . . . . 15 ILE CG1 . 15232 1 117 . 1 1 15 15 ILE CG2 C 13 16.761 0.300 . 1 . . . . 15 ILE CG2 . 15232 1 118 . 1 1 15 15 ILE N N 15 125.366 0.200 . 1 . . . . 15 ILE N . 15232 1 119 . 1 1 16 16 LYS H H 1 8.079 0.020 . 1 . . . . 16 LYS H . 15232 1 120 . 1 1 16 16 LYS HA H 1 4.433 0.020 . 1 . . . . 16 LYS HA . 15232 1 121 . 1 1 16 16 LYS HB2 H 1 1.839 0.020 . 1 . . . . 16 LYS HB2 . 15232 1 122 . 1 1 16 16 LYS HD3 H 1 1.698 0.020 . 1 . . . . 16 LYS HD3 . 15232 1 123 . 1 1 16 16 LYS HG3 H 1 1.340 0.020 . 1 . . . . 16 LYS HG3 . 15232 1 124 . 1 1 16 16 LYS CA C 13 56.514 0.300 . 1 . . . . 16 LYS CA . 15232 1 125 . 1 1 16 16 LYS CB C 13 35.756 0.300 . 1 . . . . 16 LYS CB . 15232 1 126 . 1 1 16 16 LYS CD C 13 29.189 0.300 . 1 . . . . 16 LYS CD . 15232 1 127 . 1 1 16 16 LYS CE C 13 41.827 0.300 . 1 . . . . 16 LYS CE . 15232 1 128 . 1 1 16 16 LYS CG C 13 24.179 0.300 . 1 . . . . 16 LYS CG . 15232 1 129 . 1 1 16 16 LYS N N 15 114.676 0.200 . 1 . . . . 16 LYS N . 15232 1 130 . 1 1 17 17 ALA H H 1 9.549 0.020 . 1 . . . . 17 ALA H . 15232 1 131 . 1 1 17 17 ALA HA H 1 4.459 0.020 . 1 . . . . 17 ALA HA . 15232 1 132 . 1 1 17 17 ALA HB1 H 1 1.432 0.020 . 1 . . . . 17 ALA HB . 15232 1 133 . 1 1 17 17 ALA HB2 H 1 1.432 0.020 . 1 . . . . 17 ALA HB . 15232 1 134 . 1 1 17 17 ALA HB3 H 1 1.432 0.020 . 1 . . . . 17 ALA HB . 15232 1 135 . 1 1 17 17 ALA CA C 13 52.380 0.300 . 1 . . . . 17 ALA CA . 15232 1 136 . 1 1 17 17 ALA CB C 13 18.366 0.300 . 1 . . . . 17 ALA CB . 15232 1 137 . 1 1 17 17 ALA N N 15 129.818 0.200 . 1 . . . . 17 ALA N . 15232 1 138 . 1 1 18 18 ILE H H 1 8.109 0.020 . 1 . . . . 18 ILE H . 15232 1 139 . 1 1 18 18 ILE HA H 1 4.124 0.020 . 1 . . . . 18 ILE HA . 15232 1 140 . 1 1 18 18 ILE HB H 1 1.599 0.020 . 1 . . . . 18 ILE HB . 15232 1 141 . 1 1 18 18 ILE HG13 H 1 1.503 0.020 . 1 . . . . 18 ILE HG13 . 15232 1 142 . 1 1 18 18 ILE HG21 H 1 0.862 0.020 . 1 . . . . 18 ILE HG2 . 15232 1 143 . 1 1 18 18 ILE HG22 H 1 0.862 0.020 . 1 . . . . 18 ILE HG2 . 15232 1 144 . 1 1 18 18 ILE HG23 H 1 0.862 0.020 . 1 . . . . 18 ILE HG2 . 15232 1 145 . 1 1 18 18 ILE N N 15 123.863 0.200 . 1 . . . . 18 ILE N . 15232 1 146 . 1 1 20 20 GLY H H 1 8.750 0.020 . 1 . . . . 20 GLY H . 15232 1 147 . 1 1 20 20 GLY CA C 13 47.367 0.300 . 1 . . . . 20 GLY CA . 15232 1 148 . 1 1 20 20 GLY N N 15 104.559 0.200 . 1 . . . . 20 GLY N . 15232 1 149 . 1 1 21 21 ASP H H 1 7.894 0.020 . 1 . . . . 21 ASP H . 15232 1 150 . 1 1 21 21 ASP HA H 1 4.918 0.020 . 1 . . . . 21 ASP HA . 15232 1 151 . 1 1 21 21 ASP HB2 H 1 3.164 0.020 . 1 . . . . 21 ASP HB2 . 15232 1 152 . 1 1 21 21 ASP HB3 H 1 2.356 0.020 . 1 . . . . 21 ASP HB3 . 15232 1 153 . 1 1 21 21 ASP CA C 13 51.782 0.300 . 1 . . . . 21 ASP CA . 15232 1 154 . 1 1 21 21 ASP CB C 13 40.724 0.300 . 1 . . . . 21 ASP CB . 15232 1 155 . 1 1 21 21 ASP N N 15 111.113 0.200 . 1 . . . . 21 ASP N . 15232 1 156 . 1 1 22 22 THR H H 1 7.572 0.020 . 1 . . . . 22 THR H . 15232 1 157 . 1 1 22 22 THR HA H 1 5.649 0.020 . 1 . . . . 22 THR HA . 15232 1 158 . 1 1 22 22 THR HB H 1 3.727 0.020 . 1 . . . . 22 THR HB . 15232 1 159 . 1 1 22 22 THR HG21 H 1 1.087 0.020 . 1 . . . . 22 THR HG2 . 15232 1 160 . 1 1 22 22 THR HG22 H 1 1.087 0.020 . 1 . . . . 22 THR HG2 . 15232 1 161 . 1 1 22 22 THR HG23 H 1 1.087 0.020 . 1 . . . . 22 THR HG2 . 15232 1 162 . 1 1 22 22 THR CA C 13 61.745 0.300 . 1 . . . . 22 THR CA . 15232 1 163 . 1 1 22 22 THR CB C 13 70.589 0.300 . 1 . . . . 22 THR CB . 15232 1 164 . 1 1 22 22 THR CG2 C 13 21.910 0.300 . 1 . . . . 22 THR CG2 . 15232 1 165 . 1 1 22 22 THR N N 15 115.545 0.200 . 1 . . . . 22 THR N . 15232 1 166 . 1 1 23 23 VAL H H 1 9.057 0.020 . 1 . . . . 23 VAL H . 15232 1 167 . 1 1 23 23 VAL HA H 1 4.637 0.020 . 1 . . . . 23 VAL HA . 15232 1 168 . 1 1 23 23 VAL HB H 1 1.903 0.020 . 1 . . . . 23 VAL HB . 15232 1 169 . 1 1 23 23 VAL HG11 H 1 0.788 0.020 . 1 . . . . 23 VAL HG1 . 15232 1 170 . 1 1 23 23 VAL HG12 H 1 0.788 0.020 . 1 . . . . 23 VAL HG1 . 15232 1 171 . 1 1 23 23 VAL HG13 H 1 0.788 0.020 . 1 . . . . 23 VAL HG1 . 15232 1 172 . 1 1 23 23 VAL HG21 H 1 0.859 0.020 . 1 . . . . 23 VAL HG2 . 15232 1 173 . 1 1 23 23 VAL HG22 H 1 0.859 0.020 . 1 . . . . 23 VAL HG2 . 15232 1 174 . 1 1 23 23 VAL HG23 H 1 0.859 0.020 . 1 . . . . 23 VAL HG2 . 15232 1 175 . 1 1 23 23 VAL CA C 13 60.083 0.300 . 1 . . . . 23 VAL CA . 15232 1 176 . 1 1 23 23 VAL CB C 13 36.252 0.300 . 1 . . . . 23 VAL CB . 15232 1 177 . 1 1 23 23 VAL CG1 C 13 22.354 0.300 . 1 . . . . 23 VAL CG1 . 15232 1 178 . 1 1 23 23 VAL CG2 C 13 20.166 0.300 . 1 . . . . 23 VAL CG2 . 15232 1 179 . 1 1 23 23 VAL N N 15 119.700 0.200 . 1 . . . . 23 VAL N . 15232 1 180 . 1 1 24 24 LYS H H 1 9.452 0.020 . 1 . . . . 24 LYS H . 15232 1 181 . 1 1 24 24 LYS HA H 1 5.448 0.020 . 1 . . . . 24 LYS HA . 15232 1 182 . 1 1 24 24 LYS HB2 H 1 1.997 0.020 . 1 . . . . 24 LYS HB2 . 15232 1 183 . 1 1 24 24 LYS HB3 H 1 1.700 0.020 . 1 . . . . 24 LYS HB3 . 15232 1 184 . 1 1 24 24 LYS HD3 H 1 1.622 0.020 . 1 . . . . 24 LYS HD3 . 15232 1 185 . 1 1 24 24 LYS HG3 H 1 1.386 0.020 . 1 . . . . 24 LYS HG3 . 15232 1 186 . 1 1 24 24 LYS CA C 13 55.898 0.300 . 1 . . . . 24 LYS CA . 15232 1 187 . 1 1 24 24 LYS CB C 13 34.649 0.300 . 1 . . . . 24 LYS CB . 15232 1 188 . 1 1 24 24 LYS CD C 13 29.643 0.300 . 1 . . . . 24 LYS CD . 15232 1 189 . 1 1 24 24 LYS CE C 13 41.609 0.300 . 1 . . . . 24 LYS CE . 15232 1 190 . 1 1 24 24 LYS N N 15 127.354 0.200 . 1 . . . . 24 LYS N . 15232 1 191 . 1 1 25 25 LEU H H 1 9.452 0.020 . 1 . . . . 25 LEU H . 15232 1 192 . 1 1 25 25 LEU HA H 1 5.227 0.020 . 1 . . . . 25 LEU HA . 15232 1 193 . 1 1 25 25 LEU HB2 H 1 1.774 0.020 . 1 . . . . 25 LEU HB2 . 15232 1 194 . 1 1 25 25 LEU HB3 H 1 1.392 0.020 . 1 . . . . 25 LEU HB3 . 15232 1 195 . 1 1 25 25 LEU CA C 13 57.201 0.300 . 1 . . . . 25 LEU CA . 15232 1 196 . 1 1 25 25 LEU CB C 13 42.517 0.300 . 1 . . . . 25 LEU CB . 15232 1 197 . 1 1 25 25 LEU N N 15 127.148 0.200 . 1 . . . . 25 LEU N . 15232 1 198 . 1 1 26 26 MET H H 1 9.540 0.020 . 1 . . . . 26 MET H . 15232 1 199 . 1 1 26 26 MET HA H 1 5.055 0.020 . 1 . . . . 26 MET HA . 15232 1 200 . 1 1 26 26 MET HB2 H 1 2.308 0.020 . 1 . . . . 26 MET HB2 . 15232 1 201 . 1 1 26 26 MET HB3 H 1 1.799 0.020 . 1 . . . . 26 MET HB3 . 15232 1 202 . 1 1 26 26 MET HG3 H 1 2.517 0.020 . 1 . . . . 26 MET HG3 . 15232 1 203 . 1 1 26 26 MET CA C 13 54.374 0.300 . 1 . . . . 26 MET CA . 15232 1 204 . 1 1 26 26 MET CB C 13 31.191 0.300 . 1 . . . . 26 MET CB . 15232 1 205 . 1 1 26 26 MET N N 15 122.084 0.200 . 1 . . . . 26 MET N . 15232 1 206 . 1 1 27 27 TYR H H 1 9.295 0.020 . 1 . . . . 27 TYR H . 15232 1 207 . 1 1 27 27 TYR HA H 1 5.067 0.020 . 1 . . . . 27 TYR HA . 15232 1 208 . 1 1 27 27 TYR HB2 H 1 3.115 0.020 . 1 . . . . 27 TYR HB2 . 15232 1 209 . 1 1 27 27 TYR HB3 H 1 3.005 0.020 . 1 . . . . 27 TYR HB3 . 15232 1 210 . 1 1 27 27 TYR HD2 H 1 7.378 0.020 . 1 . . . . 27 TYR HD2 . 15232 1 211 . 1 1 27 27 TYR HE1 H 1 6.912 0.020 . 1 . . . . 27 TYR HE1 . 15232 1 212 . 1 1 27 27 TYR CA C 13 56.689 0.300 . 1 . . . . 27 TYR CA . 15232 1 213 . 1 1 27 27 TYR CB C 13 41.813 0.300 . 1 . . . . 27 TYR CB . 15232 1 214 . 1 1 27 27 TYR N N 15 130.105 0.200 . 1 . . . . 27 TYR N . 15232 1 215 . 1 1 28 28 LYS H H 1 9.389 0.020 . 1 . . . . 28 LYS H . 15232 1 216 . 1 1 28 28 LYS HA H 1 3.623 0.020 . 1 . . . . 28 LYS HA . 15232 1 217 . 1 1 28 28 LYS HB2 H 1 1.347 0.020 . 1 . . . . 28 LYS HB2 . 15232 1 218 . 1 1 28 28 LYS HB3 H 1 1.746 0.020 . 1 . . . . 28 LYS HB3 . 15232 1 219 . 1 1 28 28 LYS HD2 H 1 1.503 0.020 . 1 . . . . 28 LYS HD2 . 15232 1 220 . 1 1 28 28 LYS HG2 H 1 0.531 0.020 . 1 . . . . 28 LYS HG2 . 15232 1 221 . 1 1 28 28 LYS HG3 H 1 0.834 0.020 . 1 . . . . 28 LYS HG3 . 15232 1 222 . 1 1 28 28 LYS CA C 13 57.206 0.300 . 1 . . . . 28 LYS CA . 15232 1 223 . 1 1 28 28 LYS CB C 13 29.844 0.300 . 1 . . . . 28 LYS CB . 15232 1 224 . 1 1 28 28 LYS CD C 13 24.918 0.300 . 1 . . . . 28 LYS CD . 15232 1 225 . 1 1 28 28 LYS CE C 13 42.051 0.300 . 1 . . . . 28 LYS CE . 15232 1 226 . 1 1 28 28 LYS CG C 13 20.718 0.300 . 1 . . . . 28 LYS CG . 15232 1 227 . 1 1 28 28 LYS N N 15 127.433 0.200 . 1 . . . . 28 LYS N . 15232 1 228 . 1 1 29 29 GLY H H 1 8.495 0.020 . 1 . . . . 29 GLY H . 15232 1 229 . 1 1 29 29 GLY HA2 H 1 4.127 0.020 . 1 . . . . 29 GLY HA2 . 15232 1 230 . 1 1 29 29 GLY HA3 H 1 3.611 0.020 . 1 . . . . 29 GLY HA3 . 15232 1 231 . 1 1 29 29 GLY CA C 13 45.556 0.300 . 1 . . . . 29 GLY CA . 15232 1 232 . 1 1 29 29 GLY N N 15 102.811 0.200 . 1 . . . . 29 GLY N . 15232 1 233 . 1 1 30 30 GLN H H 1 7.889 0.020 . 1 . . . . 30 GLN H . 15232 1 234 . 1 1 30 30 GLN HA H 1 4.682 0.020 . 1 . . . . 30 GLN HA . 15232 1 235 . 1 1 30 30 GLN HB2 H 1 2.122 0.020 . 1 . . . . 30 GLN HB2 . 15232 1 236 . 1 1 30 30 GLN HG3 H 1 2.371 0.020 . 1 . . . . 30 GLN HG3 . 15232 1 237 . 1 1 30 30 GLN CA C 13 53.790 0.300 . 1 . . . . 30 GLN CA . 15232 1 238 . 1 1 30 30 GLN CB C 13 32.321 0.300 . 1 . . . . 30 GLN CB . 15232 1 239 . 1 1 30 30 GLN CG C 13 33.769 0.300 . 1 . . . . 30 GLN CG . 15232 1 240 . 1 1 30 30 GLN N N 15 119.701 0.200 . 1 . . . . 30 GLN N . 15232 1 241 . 1 1 31 31 ALA H H 1 8.706 0.020 . 1 . . . . 31 ALA H . 15232 1 242 . 1 1 31 31 ALA HA H 1 4.752 0.020 . 1 . . . . 31 ALA HA . 15232 1 243 . 1 1 31 31 ALA HB1 H 1 1.281 0.020 . 1 . . . . 31 ALA HB . 15232 1 244 . 1 1 31 31 ALA HB2 H 1 1.281 0.020 . 1 . . . . 31 ALA HB . 15232 1 245 . 1 1 31 31 ALA HB3 H 1 1.281 0.020 . 1 . . . . 31 ALA HB . 15232 1 246 . 1 1 31 31 ALA CA C 13 52.216 0.300 . 1 . . . . 31 ALA CA . 15232 1 247 . 1 1 31 31 ALA CB C 13 18.896 0.300 . 1 . . . . 31 ALA CB . 15232 1 248 . 1 1 31 31 ALA N N 15 126.856 0.200 . 1 . . . . 31 ALA N . 15232 1 249 . 1 1 32 32 MET H H 1 9.499 0.020 . 1 . . . . 32 MET H . 15232 1 250 . 1 1 32 32 MET HA H 1 4.705 0.020 . 1 . . . . 32 MET HA . 15232 1 251 . 1 1 32 32 MET HB2 H 1 2.051 0.020 . 1 . . . . 32 MET HB2 . 15232 1 252 . 1 1 32 32 MET HG3 H 1 2.435 0.020 . 1 . . . . 32 MET HG3 . 15232 1 253 . 1 1 32 32 MET CA C 13 55.503 0.300 . 1 . . . . 32 MET CA . 15232 1 254 . 1 1 32 32 MET CB C 13 37.240 0.300 . 1 . . . . 32 MET CB . 15232 1 255 . 1 1 32 32 MET CG C 13 32.045 0.300 . 1 . . . . 32 MET CG . 15232 1 256 . 1 1 32 32 MET N N 15 125.954 0.200 . 1 . . . . 32 MET N . 15232 1 257 . 1 1 33 33 THR H H 1 9.003 0.020 . 1 . . . . 33 THR H . 15232 1 258 . 1 1 33 33 THR HA H 1 4.561 0.020 . 1 . . . . 33 THR HA . 15232 1 259 . 1 1 33 33 THR HB H 1 3.960 0.020 . 1 . . . . 33 THR HB . 15232 1 260 . 1 1 33 33 THR HG21 H 1 1.016 0.020 . 1 . . . . 33 THR HG2 . 15232 1 261 . 1 1 33 33 THR HG22 H 1 1.016 0.020 . 1 . . . . 33 THR HG2 . 15232 1 262 . 1 1 33 33 THR HG23 H 1 1.016 0.020 . 1 . . . . 33 THR HG2 . 15232 1 263 . 1 1 33 33 THR CA C 13 63.888 0.300 . 1 . . . . 33 THR CA . 15232 1 264 . 1 1 33 33 THR CB C 13 68.590 0.300 . 1 . . . . 33 THR CB . 15232 1 265 . 1 1 33 33 THR CG2 C 13 22.761 0.300 . 1 . . . . 33 THR CG2 . 15232 1 266 . 1 1 33 33 THR N N 15 123.289 0.200 . 1 . . . . 33 THR N . 15232 1 267 . 1 1 34 34 PHE H H 1 9.599 0.020 . 1 . . . . 34 PHE H . 15232 1 268 . 1 1 34 34 PHE HA H 1 5.077 0.020 . 1 . . . . 34 PHE HA . 15232 1 269 . 1 1 34 34 PHE HD1 H 1 6.906 0.020 . 1 . . . . 34 PHE HD1 . 15232 1 270 . 1 1 34 34 PHE HE1 H 1 6.926 0.020 . 1 . . . . 34 PHE HE1 . 15232 1 271 . 1 1 34 34 PHE CA C 13 57.201 0.300 . 1 . . . . 34 PHE CA . 15232 1 272 . 1 1 34 34 PHE CB C 13 42.517 0.300 . 1 . . . . 34 PHE CB . 15232 1 273 . 1 1 34 34 PHE N N 15 125.938 0.200 . 1 . . . . 34 PHE N . 15232 1 274 . 1 1 35 35 ARG H H 1 9.542 0.020 . 1 . . . . 35 ARG H . 15232 1 275 . 1 1 35 35 ARG HA H 1 5.303 0.020 . 9 . . . . 35 ARG HA . 15232 1 276 . 1 1 35 35 ARG HB2 H 1 1.799 0.020 . 1 . . . . 35 ARG HB2 . 15232 1 277 . 1 1 35 35 ARG HB3 H 1 1.461 0.020 . 1 . . . . 35 ARG HB3 . 15232 1 278 . 1 1 35 35 ARG HD3 H 1 4.294 0.020 . 1 . . . . 35 ARG HD3 . 15232 1 279 . 1 1 35 35 ARG HG3 H 1 1.642 0.020 . 1 . . . . 35 ARG HG3 . 15232 1 280 . 1 1 35 35 ARG CA C 13 52.432 0.300 . 1 . . . . 35 ARG CA . 15232 1 281 . 1 1 35 35 ARG CB C 13 32.210 0.300 . 1 . . . . 35 ARG CB . 15232 1 282 . 1 1 35 35 ARG CD C 13 43.443 0.300 . 1 . . . . 35 ARG CD . 15232 1 283 . 1 1 35 35 ARG N N 15 122.090 0.200 . 1 . . . . 35 ARG N . 15232 1 284 . 1 1 36 36 LEU H H 1 8.350 0.020 . 1 . . . . 36 LEU H . 15232 1 285 . 1 1 36 36 LEU HA H 1 4.432 0.020 . 1 . . . . 36 LEU HA . 15232 1 286 . 1 1 36 36 LEU HB3 H 1 1.595 0.020 . 1 . . . . 36 LEU HB3 . 15232 1 287 . 1 1 36 36 LEU HD11 H 1 0.736 0.020 . 1 . . . . 36 LEU HD1 . 15232 1 288 . 1 1 36 36 LEU HD12 H 1 0.736 0.020 . 1 . . . . 36 LEU HD1 . 15232 1 289 . 1 1 36 36 LEU HD13 H 1 0.736 0.020 . 1 . . . . 36 LEU HD1 . 15232 1 290 . 1 1 36 36 LEU HD21 H 1 0.800 0.020 . 1 . . . . 36 LEU HD2 . 15232 1 291 . 1 1 36 36 LEU HD22 H 1 0.800 0.020 . 1 . . . . 36 LEU HD2 . 15232 1 292 . 1 1 36 36 LEU HD23 H 1 0.800 0.020 . 1 . . . . 36 LEU HD2 . 15232 1 293 . 1 1 36 36 LEU CA C 13 55.375 0.300 . 1 . . . . 36 LEU CA . 15232 1 294 . 1 1 36 36 LEU CB C 13 41.776 0.300 . 1 . . . . 36 LEU CB . 15232 1 295 . 1 1 36 36 LEU CD1 C 13 24.694 0.300 . 1 . . . . 36 LEU CD1 . 15232 1 296 . 1 1 36 36 LEU CD2 C 13 26.332 0.300 . 1 . . . . 36 LEU CD2 . 15232 1 297 . 1 1 36 36 LEU CG C 13 28.642 0.300 . 1 . . . . 36 LEU CG . 15232 1 298 . 1 1 36 36 LEU N N 15 122.675 0.200 . 1 . . . . 36 LEU N . 15232 1 299 . 1 1 37 37 LEU H H 1 7.773 0.020 . 1 . . . . 37 LEU H . 15232 1 300 . 1 1 37 37 LEU HA H 1 3.980 0.020 . 1 . . . . 37 LEU HA . 15232 1 301 . 1 1 37 37 LEU HB2 H 1 0.920 0.020 . 1 . . . . 37 LEU HB2 . 15232 1 302 . 1 1 37 37 LEU HB3 H 1 0.757 0.020 . 1 . . . . 37 LEU HB3 . 15232 1 303 . 1 1 37 37 LEU HD21 H 1 0.495 0.020 . 1 . . . . 37 LEU HD2 . 15232 1 304 . 1 1 37 37 LEU HD22 H 1 0.495 0.020 . 1 . . . . 37 LEU HD2 . 15232 1 305 . 1 1 37 37 LEU HD23 H 1 0.495 0.020 . 1 . . . . 37 LEU HD2 . 15232 1 306 . 1 1 37 37 LEU HG H 1 1.041 0.020 . 1 . . . . 37 LEU HG . 15232 1 307 . 1 1 37 37 LEU CA C 13 55.771 0.300 . 1 . . . . 37 LEU CA . 15232 1 308 . 1 1 37 37 LEU CB C 13 44.665 0.300 . 1 . . . . 37 LEU CB . 15232 1 309 . 1 1 37 37 LEU CD1 C 13 25.238 0.300 . 1 . . . . 37 LEU CD1 . 15232 1 310 . 1 1 37 37 LEU CG C 13 25.238 0.300 . 1 . . . . 37 LEU CG . 15232 1 311 . 1 1 37 37 LEU N N 15 125.071 0.200 . 1 . . . . 37 LEU N . 15232 1 312 . 1 1 38 38 LEU H H 1 8.545 0.020 . 1 . . . . 38 LEU H . 15232 1 313 . 1 1 38 38 LEU HA H 1 4.262 0.020 . 1 . . . . 38 LEU HA . 15232 1 314 . 1 1 38 38 LEU HB2 H 1 2.256 0.020 . 1 . . . . 38 LEU HB2 . 15232 1 315 . 1 1 38 38 LEU HB3 H 1 1.928 0.020 . 1 . . . . 38 LEU HB3 . 15232 1 316 . 1 1 38 38 LEU HD11 H 1 1.091 0.020 . 1 . . . . 38 LEU HD1 . 15232 1 317 . 1 1 38 38 LEU HD12 H 1 1.091 0.020 . 1 . . . . 38 LEU HD1 . 15232 1 318 . 1 1 38 38 LEU HD13 H 1 1.091 0.020 . 1 . . . . 38 LEU HD1 . 15232 1 319 . 1 1 38 38 LEU HG H 1 1.867 0.020 . 1 . . . . 38 LEU HG . 15232 1 320 . 1 1 38 38 LEU CA C 13 56.856 0.300 . 1 . . . . 38 LEU CA . 15232 1 321 . 1 1 38 38 LEU CB C 13 40.336 0.300 . 1 . . . . 38 LEU CB . 15232 1 322 . 1 1 38 38 LEU CD1 C 13 24.027 0.300 . 1 . . . . 38 LEU CD1 . 15232 1 323 . 1 1 38 38 LEU CG C 13 27.781 0.300 . 1 . . . . 38 LEU CG . 15232 1 324 . 1 1 38 38 LEU N N 15 111.993 0.200 . 1 . . . . 38 LEU N . 15232 1 325 . 1 1 39 39 VAL H H 1 7.051 0.020 . 1 . . . . 39 VAL H . 15232 1 326 . 1 1 39 39 VAL HA H 1 5.160 0.020 . 1 . . . . 39 VAL HA . 15232 1 327 . 1 1 39 39 VAL HB H 1 1.876 0.020 . 1 . . . . 39 VAL HB . 15232 1 328 . 1 1 39 39 VAL HG11 H 1 0.842 0.020 . 1 . . . . 39 VAL HG1 . 15232 1 329 . 1 1 39 39 VAL HG12 H 1 0.842 0.020 . 1 . . . . 39 VAL HG1 . 15232 1 330 . 1 1 39 39 VAL HG13 H 1 0.842 0.020 . 1 . . . . 39 VAL HG1 . 15232 1 331 . 1 1 39 39 VAL CA C 13 59.359 0.300 . 1 . . . . 39 VAL CA . 15232 1 332 . 1 1 39 39 VAL CB C 13 35.184 0.300 . 1 . . . . 39 VAL CB . 15232 1 333 . 1 1 39 39 VAL CG1 C 13 19.883 0.300 . 1 . . . . 39 VAL CG1 . 15232 1 334 . 1 1 39 39 VAL CG2 C 13 22.766 0.300 . 1 . . . . 39 VAL CG2 . 15232 1 335 . 1 1 39 39 VAL N N 15 109.564 0.200 . 1 . . . . 39 VAL N . 15232 1 336 . 1 1 40 40 ASP H H 1 8.851 0.020 . 1 . . . . 40 ASP H . 15232 1 337 . 1 1 40 40 ASP HA H 1 5.037 0.020 . 1 . . . . 40 ASP HA . 15232 1 338 . 1 1 40 40 ASP HB2 H 1 2.359 0.020 . 1 . . . . 40 ASP HB2 . 15232 1 339 . 1 1 40 40 ASP HB3 H 1 2.609 0.020 . 1 . . . . 40 ASP HB3 . 15232 1 340 . 1 1 40 40 ASP CA C 13 53.372 0.300 . 1 . . . . 40 ASP CA . 15232 1 341 . 1 1 40 40 ASP CB C 13 43.247 0.300 . 1 . . . . 40 ASP CB . 15232 1 342 . 1 1 40 40 ASP N N 15 122.678 0.200 . 1 . . . . 40 ASP N . 15232 1 343 . 1 1 41 41 THR H H 1 8.481 0.020 . 1 . . . . 41 THR H . 15232 1 344 . 1 1 41 41 THR HA H 1 4.325 0.020 . 1 . . . . 41 THR HA . 15232 1 345 . 1 1 41 41 THR HB H 1 4.432 0.020 . 1 . . . . 41 THR HB . 15232 1 346 . 1 1 41 41 THR HG21 H 1 1.089 0.020 . 1 . . . . 41 THR HG2 . 15232 1 347 . 1 1 41 41 THR HG22 H 1 1.089 0.020 . 1 . . . . 41 THR HG2 . 15232 1 348 . 1 1 41 41 THR HG23 H 1 1.089 0.020 . 1 . . . . 41 THR HG2 . 15232 1 349 . 1 1 41 41 THR CA C 13 61.170 0.300 . 1 . . . . 41 THR CA . 15232 1 350 . 1 1 41 41 THR CB C 13 69.085 0.300 . 1 . . . . 41 THR CB . 15232 1 351 . 1 1 41 41 THR CG2 C 13 21.465 0.300 . 1 . . . . 41 THR CG2 . 15232 1 352 . 1 1 41 41 THR N N 15 116.437 0.200 . 1 . . . . 41 THR N . 15232 1 353 . 1 1 42 42 ALA H H 1 8.430 0.020 . 1 . . . . 42 ALA H . 15232 1 354 . 1 1 42 42 ALA HA H 1 4.284 0.020 . 1 . . . . 42 ALA HA . 15232 1 355 . 1 1 42 42 ALA HB1 H 1 1.388 0.020 . 1 . . . . 42 ALA HB . 15232 1 356 . 1 1 42 42 ALA HB2 H 1 1.388 0.020 . 1 . . . . 42 ALA HB . 15232 1 357 . 1 1 42 42 ALA HB3 H 1 1.388 0.020 . 1 . . . . 42 ALA HB . 15232 1 358 . 1 1 42 42 ALA CA C 13 52.869 0.300 . 1 . . . . 42 ALA CA . 15232 1 359 . 1 1 42 42 ALA CB C 13 19.352 0.300 . 1 . . . . 42 ALA CB . 15232 1 360 . 1 1 42 42 ALA N N 15 125.632 0.200 . 1 . . . . 42 ALA N . 15232 1 361 . 1 1 43 43 GLU H H 1 8.407 0.020 . 1 . . . . 43 GLU H . 15232 1 362 . 1 1 43 43 GLU HA H 1 4.285 0.020 . 1 . . . . 43 GLU HA . 15232 1 363 . 1 1 43 43 GLU HB3 H 1 1.952 0.020 . 1 . . . . 43 GLU HB3 . 15232 1 364 . 1 1 43 43 GLU HG3 H 1 2.289 0.020 . 1 . . . . 43 GLU HG3 . 15232 1 365 . 1 1 43 43 GLU CA C 13 56.424 0.300 . 1 . . . . 43 GLU CA . 15232 1 366 . 1 1 43 43 GLU CB C 13 30.349 0.300 . 1 . . . . 43 GLU CB . 15232 1 367 . 1 1 43 43 GLU CG C 13 36.087 0.300 . 1 . . . . 43 GLU CG . 15232 1 368 . 1 1 43 43 GLU N N 15 120.506 0.200 . 1 . . . . 43 GLU N . 15232 1 369 . 1 1 44 44 THR H H 1 8.223 0.020 . 1 . . . . 44 THR H . 15232 1 370 . 1 1 44 44 THR HA H 1 4.283 0.020 . 1 . . . . 44 THR HA . 15232 1 371 . 1 1 44 44 THR HB H 1 4.180 0.020 . 1 . . . . 44 THR HB . 15232 1 372 . 1 1 44 44 THR HG21 H 1 1.125 0.020 . 1 . . . . 44 THR HG2 . 15232 1 373 . 1 1 44 44 THR HG22 H 1 1.125 0.020 . 1 . . . . 44 THR HG2 . 15232 1 374 . 1 1 44 44 THR HG23 H 1 1.125 0.020 . 1 . . . . 44 THR HG2 . 15232 1 375 . 1 1 44 44 THR CA C 13 62.126 0.300 . 1 . . . . 44 THR CA . 15232 1 376 . 1 1 44 44 THR CB C 13 69.668 0.300 . 1 . . . . 44 THR CB . 15232 1 377 . 1 1 44 44 THR CG2 C 13 21.636 0.300 . 1 . . . . 44 THR CG2 . 15232 1 378 . 1 1 44 44 THR N N 15 114.396 0.200 . 1 . . . . 44 THR N . 15232 1 379 . 1 1 45 45 LYS H H 1 8.182 0.020 . 1 . . . . 45 LYS H . 15232 1 380 . 1 1 45 45 LYS HA H 1 4.339 0.020 . 1 . . . . 45 LYS HA . 15232 1 381 . 1 1 45 45 LYS HB3 H 1 1.760 0.020 . 1 . . . . 45 LYS HB3 . 15232 1 382 . 1 1 45 45 LYS HD3 H 1 1.353 0.020 . 1 . . . . 45 LYS HD3 . 15232 1 383 . 1 1 45 45 LYS HG3 H 1 0.930 0.020 . 1 . . . . 45 LYS HG3 . 15232 1 384 . 1 1 45 45 LYS CA C 13 56.130 0.300 . 1 . . . . 45 LYS CA . 15232 1 385 . 1 1 45 45 LYS CB C 13 33.259 0.300 . 1 . . . . 45 LYS CB . 15232 1 386 . 1 1 45 45 LYS CD C 13 28.940 0.300 . 1 . . . . 45 LYS CD . 15232 1 387 . 1 1 45 45 LYS CE C 13 41.900 0.300 . 1 . . . . 45 LYS CE . 15232 1 388 . 1 1 45 45 LYS CG C 13 24.658 0.300 . 1 . . . . 45 LYS CG . 15232 1 389 . 1 1 45 45 LYS N N 15 122.099 0.200 . 1 . . . . 45 LYS N . 15232 1 390 . 1 1 46 46 HIS H H 1 8.645 0.020 . 1 . . . . 46 HIS H . 15232 1 391 . 1 1 46 46 HIS HA H 1 4.790 0.020 . 1 . . . . 46 HIS HA . 15232 1 392 . 1 1 46 46 HIS HB2 H 1 3.200 0.020 . 1 . . . . 46 HIS HB2 . 15232 1 393 . 1 1 46 46 HIS HB3 H 1 3.319 0.020 . 1 . . . . 46 HIS HB3 . 15232 1 394 . 1 1 46 46 HIS CA C 13 55.499 0.300 . 1 . . . . 46 HIS CA . 15232 1 395 . 1 1 46 46 HIS CB C 13 28.650 0.300 . 1 . . . . 46 HIS CB . 15232 1 396 . 1 1 46 46 HIS N N 15 119.422 0.200 . 1 . . . . 46 HIS N . 15232 1 397 . 1 1 47 47 THR H H 1 8.170 0.020 . 1 . . . . 47 THR H . 15232 1 398 . 1 1 47 47 THR HA H 1 4.477 0.020 . 1 . . . . 47 THR HA . 15232 1 399 . 1 1 47 47 THR HB H 1 4.348 0.020 . 1 . . . . 47 THR HB . 15232 1 400 . 1 1 47 47 THR HG21 H 1 1.191 0.020 . 1 . . . . 47 THR HG2 . 15232 1 401 . 1 1 47 47 THR HG22 H 1 1.191 0.020 . 1 . . . . 47 THR HG2 . 15232 1 402 . 1 1 47 47 THR HG23 H 1 1.191 0.020 . 1 . . . . 47 THR HG2 . 15232 1 403 . 1 1 47 47 THR CA C 13 61.443 0.300 . 1 . . . . 47 THR CA . 15232 1 404 . 1 1 47 47 THR CB C 13 70.343 0.300 . 1 . . . . 47 THR CB . 15232 1 405 . 1 1 47 47 THR CG2 C 13 21.606 0.300 . 1 . . . . 47 THR CG2 . 15232 1 406 . 1 1 47 47 THR N N 15 114.363 0.200 . 1 . . . . 47 THR N . 15232 1 407 . 1 1 48 48 LYS H H 1 8.534 0.020 . 1 . . . . 48 LYS H . 15232 1 408 . 1 1 48 48 LYS HA H 1 4.282 0.020 . 1 . . . . 48 LYS HA . 15232 1 409 . 1 1 48 48 LYS HB2 H 1 1.848 0.020 . 1 . . . . 48 LYS HB2 . 15232 1 410 . 1 1 48 48 LYS HD3 H 1 1.712 0.020 . 1 . . . . 48 LYS HD3 . 15232 1 411 . 1 1 48 48 LYS HE2 H 1 3.011 0.020 . 1 . . . . 48 LYS HE2 . 15232 1 412 . 1 1 48 48 LYS HG2 H 1 1.452 0.020 . 1 . . . . 48 LYS HG2 . 15232 1 413 . 1 1 48 48 LYS CA C 13 57.226 0.300 . 1 . . . . 48 LYS CA . 15232 1 414 . 1 1 48 48 LYS CB C 13 32.832 0.300 . 1 . . . . 48 LYS CB . 15232 1 415 . 1 1 48 48 LYS CD C 13 29.209 0.300 . 1 . . . . 48 LYS CD . 15232 1 416 . 1 1 48 48 LYS CE C 13 41.905 0.300 . 1 . . . . 48 LYS CE . 15232 1 417 . 1 1 48 48 LYS CG C 13 24.910 0.300 . 1 . . . . 48 LYS CG . 15232 1 418 . 1 1 48 48 LYS N N 15 122.654 0.200 . 1 . . . . 48 LYS N . 15232 1 419 . 1 1 49 49 LYS H H 1 8.357 0.020 . 1 . . . . 49 LYS H . 15232 1 420 . 1 1 49 49 LYS HA H 1 4.283 0.020 . 1 . . . . 49 LYS HA . 15232 1 421 . 1 1 49 49 LYS HB2 H 1 1.801 0.020 . 1 . . . . 49 LYS HB2 . 15232 1 422 . 1 1 49 49 LYS HD2 H 1 1.446 0.020 . 1 . . . . 49 LYS HD2 . 15232 1 423 . 1 1 49 49 LYS HE2 H 1 3.004 0.020 . 1 . . . . 49 LYS HE2 . 15232 1 424 . 1 1 49 49 LYS HG3 H 1 1.091 0.020 . 1 . . . . 49 LYS HG3 . 15232 1 425 . 1 1 49 49 LYS CA C 13 56.941 0.300 . 1 . . . . 49 LYS CA . 15232 1 426 . 1 1 49 49 LYS CB C 13 32.694 0.300 . 1 . . . . 49 LYS CB . 15232 1 427 . 1 1 49 49 LYS CD C 13 29.035 0.300 . 1 . . . . 49 LYS CD . 15232 1 428 . 1 1 49 49 LYS CE C 13 42.113 0.300 . 1 . . . . 49 LYS CE . 15232 1 429 . 1 1 49 49 LYS CG C 13 24.986 0.300 . 1 . . . . 49 LYS CG . 15232 1 430 . 1 1 49 49 LYS N N 15 120.587 0.200 . 1 . . . . 49 LYS N . 15232 1 431 . 1 1 50 50 GLY H H 1 8.333 0.020 . 1 . . . . 50 GLY H . 15232 1 432 . 1 1 50 50 GLY HA2 H 1 4.085 0.020 . 1 . . . . 50 GLY HA2 . 15232 1 433 . 1 1 50 50 GLY HA3 H 1 3.877 0.020 . 1 . . . . 50 GLY HA3 . 15232 1 434 . 1 1 50 50 GLY CA C 13 45.556 0.300 . 1 . . . . 50 GLY CA . 15232 1 435 . 1 1 50 50 GLY N N 15 109.923 0.200 . 1 . . . . 50 GLY N . 15232 1 436 . 1 1 51 51 VAL H H 1 7.933 0.020 . 1 . . . . 51 VAL H . 15232 1 437 . 1 1 51 51 VAL HA H 1 4.128 0.020 . 1 . . . . 51 VAL HA . 15232 1 438 . 1 1 51 51 VAL HB H 1 2.102 0.020 . 1 . . . . 51 VAL HB . 15232 1 439 . 1 1 51 51 VAL HG21 H 1 0.890 0.020 . 1 . . . . 51 VAL HG2 . 15232 1 440 . 1 1 51 51 VAL HG22 H 1 0.890 0.020 . 1 . . . . 51 VAL HG2 . 15232 1 441 . 1 1 51 51 VAL HG23 H 1 0.890 0.020 . 1 . . . . 51 VAL HG2 . 15232 1 442 . 1 1 51 51 VAL CA C 13 62.595 0.300 . 1 . . . . 51 VAL CA . 15232 1 443 . 1 1 51 51 VAL CB C 13 32.596 0.300 . 1 . . . . 51 VAL CB . 15232 1 444 . 1 1 51 51 VAL CG1 C 13 20.822 0.300 . 1 . . . . 51 VAL CG1 . 15232 1 445 . 1 1 51 51 VAL N N 15 119.102 0.200 . 1 . . . . 51 VAL N . 15232 1 446 . 1 1 52 52 GLU H H 1 8.688 0.020 . 1 . . . . 52 GLU H . 15232 1 447 . 1 1 52 52 GLU HA H 1 4.276 0.020 . 1 . . . . 52 GLU HA . 15232 1 448 . 1 1 52 52 GLU HB3 H 1 1.999 0.020 . 1 . . . . 52 GLU HB3 . 15232 1 449 . 1 1 52 52 GLU HG3 H 1 2.263 0.020 . 1 . . . . 52 GLU HG3 . 15232 1 450 . 1 1 52 52 GLU CA C 13 56.685 0.300 . 1 . . . . 52 GLU CA . 15232 1 451 . 1 1 52 52 GLU CB C 13 29.629 0.300 . 1 . . . . 52 GLU CB . 15232 1 452 . 1 1 52 52 GLU CG C 13 36.031 0.300 . 1 . . . . 52 GLU CG . 15232 1 453 . 1 1 52 52 GLU N N 15 124.490 0.200 . 1 . . . . 52 GLU N . 15232 1 454 . 1 1 53 53 LYS H H 1 8.306 0.020 . 1 . . . . 53 LYS H . 15232 1 455 . 1 1 53 53 LYS HA H 1 4.199 0.020 . 1 . . . . 53 LYS HA . 15232 1 456 . 1 1 53 53 LYS HB2 H 1 1.925 0.020 . 1 . . . . 53 LYS HB2 . 15232 1 457 . 1 1 53 53 LYS HB3 H 1 2.159 0.020 . 1 . . . . 53 LYS HB3 . 15232 1 458 . 1 1 53 53 LYS HD3 H 1 1.595 0.020 . 1 . . . . 53 LYS HD3 . 15232 1 459 . 1 1 53 53 LYS HG3 H 1 1.376 0.020 . 1 . . . . 53 LYS HG3 . 15232 1 460 . 1 1 53 53 LYS CA C 13 57.723 0.300 . 1 . . . . 53 LYS CA . 15232 1 461 . 1 1 53 53 LYS CB C 13 32.920 0.300 . 1 . . . . 53 LYS CB . 15232 1 462 . 1 1 53 53 LYS CD C 13 29.027 0.300 . 1 . . . . 53 LYS CD . 15232 1 463 . 1 1 53 53 LYS CE C 13 41.918 0.300 . 1 . . . . 53 LYS CE . 15232 1 464 . 1 1 53 53 LYS CG C 13 24.130 0.300 . 1 . . . . 53 LYS CG . 15232 1 465 . 1 1 53 53 LYS N N 15 122.387 0.200 . 1 . . . . 53 LYS N . 15232 1 466 . 1 1 54 54 TYR H H 1 8.186 0.020 . 1 . . . . 54 TYR H . 15232 1 467 . 1 1 54 54 TYR HA H 1 4.378 0.020 . 1 . . . . 54 TYR HA . 15232 1 468 . 1 1 54 54 TYR HB2 H 1 3.116 0.020 . 1 . . . . 54 TYR HB2 . 15232 1 469 . 1 1 54 54 TYR HB3 H 1 2.775 0.020 . 1 . . . . 54 TYR HB3 . 15232 1 470 . 1 1 54 54 TYR HD1 H 1 7.006 0.020 . 1 . . . . 54 TYR HD1 . 15232 1 471 . 1 1 54 54 TYR HE1 H 1 6.765 0.020 . 1 . . . . 54 TYR HE1 . 15232 1 472 . 1 1 54 54 TYR CA C 13 60.997 0.300 . 1 . . . . 54 TYR CA . 15232 1 473 . 1 1 54 54 TYR CB C 13 37.369 0.300 . 1 . . . . 54 TYR CB . 15232 1 474 . 1 1 54 54 TYR N N 15 118.543 0.200 . 1 . . . . 54 TYR N . 15232 1 475 . 1 1 55 55 GLY H H 1 8.641 0.020 . 1 . . . . 55 GLY H . 15232 1 476 . 1 1 55 55 GLY HA2 H 1 4.037 0.020 . 1 . . . . 55 GLY HA2 . 15232 1 477 . 1 1 55 55 GLY HA3 H 1 3.925 0.020 . 1 . . . . 55 GLY HA3 . 15232 1 478 . 1 1 55 55 GLY CA C 13 47.670 0.300 . 1 . . . . 55 GLY CA . 15232 1 479 . 1 1 55 55 GLY N N 15 111.088 0.200 . 1 . . . . 55 GLY N . 15232 1 480 . 1 1 56 56 ALA H H 1 8.186 0.020 . 1 . . . . 56 ALA H . 15232 1 481 . 1 1 56 56 ALA HA H 1 4.284 0.020 . 1 . . . . 56 ALA HA . 15232 1 482 . 1 1 56 56 ALA HB1 H 1 1.496 0.020 . 1 . . . . 56 ALA HB . 15232 1 483 . 1 1 56 56 ALA HB2 H 1 1.496 0.020 . 1 . . . . 56 ALA HB . 15232 1 484 . 1 1 56 56 ALA HB3 H 1 1.496 0.020 . 1 . . . . 56 ALA HB . 15232 1 485 . 1 1 56 56 ALA N N 15 125.653 0.200 . 1 . . . . 56 ALA N . 15232 1 486 . 1 1 57 57 GLU H H 1 8.271 0.020 . 1 . . . . 57 GLU H . 15232 1 487 . 1 1 57 57 GLU HA H 1 4.216 0.020 . 1 . . . . 57 GLU HA . 15232 1 488 . 1 1 57 57 GLU HB2 H 1 2.210 0.020 . 1 . . . . 57 GLU HB2 . 15232 1 489 . 1 1 57 57 GLU HG2 H 1 2.473 0.020 . 1 . . . . 57 GLU HG2 . 15232 1 490 . 1 1 57 57 GLU CA C 13 59.335 0.300 . 1 . . . . 57 GLU CA . 15232 1 491 . 1 1 57 57 GLU CB C 13 29.034 0.300 . 1 . . . . 57 GLU CB . 15232 1 492 . 1 1 57 57 GLU CG C 13 35.504 0.300 . 1 . . . . 57 GLU CG . 15232 1 493 . 1 1 57 57 GLU N N 15 120.330 0.200 . 1 . . . . 57 GLU N . 15232 1 494 . 1 1 58 58 ALA H H 1 8.936 0.020 . 1 . . . . 58 ALA H . 15232 1 495 . 1 1 58 58 ALA HA H 1 4.131 0.020 . 1 . . . . 58 ALA HA . 15232 1 496 . 1 1 58 58 ALA HB1 H 1 1.703 0.020 . 1 . . . . 58 ALA HB . 15232 1 497 . 1 1 58 58 ALA HB2 H 1 1.703 0.020 . 1 . . . . 58 ALA HB . 15232 1 498 . 1 1 58 58 ALA HB3 H 1 1.703 0.020 . 1 . . . . 58 ALA HB . 15232 1 499 . 1 1 58 58 ALA CA C 13 55.637 0.300 . 1 . . . . 58 ALA CA . 15232 1 500 . 1 1 58 58 ALA CB C 13 18.122 0.300 . 1 . . . . 58 ALA CB . 15232 1 501 . 1 1 58 58 ALA N N 15 123.853 0.200 . 1 . . . . 58 ALA N . 15232 1 502 . 1 1 59 59 SER H H 1 8.137 0.020 . 1 . . . . 59 SER H . 15232 1 503 . 1 1 59 59 SER HA H 1 4.379 0.020 . 1 . . . . 59 SER HA . 15232 1 504 . 1 1 59 59 SER HB3 H 1 3.725 0.020 . 1 . . . . 59 SER HB3 . 15232 1 505 . 1 1 59 59 SER CA C 13 62.653 0.300 . 1 . . . . 59 SER CA . 15232 1 506 . 1 1 59 59 SER N N 15 112.563 0.200 . 1 . . . . 59 SER N . 15232 1 507 . 1 1 60 60 ALA H H 1 7.957 0.020 . 1 . . . . 60 ALA H . 15232 1 508 . 1 1 60 60 ALA HA H 1 4.080 0.020 . 1 . . . . 60 ALA HA . 15232 1 509 . 1 1 60 60 ALA HB1 H 1 1.532 0.020 . 1 . . . . 60 ALA HB . 15232 1 510 . 1 1 60 60 ALA HB2 H 1 1.532 0.020 . 1 . . . . 60 ALA HB . 15232 1 511 . 1 1 60 60 ALA HB3 H 1 1.532 0.020 . 1 . . . . 60 ALA HB . 15232 1 512 . 1 1 60 60 ALA CA C 13 55.156 0.300 . 1 . . . . 60 ALA CA . 15232 1 513 . 1 1 60 60 ALA CB C 13 18.162 0.300 . 1 . . . . 60 ALA CB . 15232 1 514 . 1 1 60 60 ALA N N 15 122.970 0.200 . 1 . . . . 60 ALA N . 15232 1 515 . 1 1 61 61 PHE H H 1 8.343 0.020 . 1 . . . . 61 PHE H . 15232 1 516 . 1 1 61 61 PHE HA H 1 4.060 0.020 . 1 . . . . 61 PHE HA . 15232 1 517 . 1 1 61 61 PHE HB2 H 1 3.330 0.020 . 1 . . . . 61 PHE HB2 . 15232 1 518 . 1 1 61 61 PHE HB3 H 1 3.141 0.020 . 1 . . . . 61 PHE HB3 . 15232 1 519 . 1 1 61 61 PHE HD1 H 1 7.166 0.020 . 1 . . . . 61 PHE HD1 . 15232 1 520 . 1 1 61 61 PHE HE1 H 1 7.258 0.020 . 1 . . . . 61 PHE HE1 . 15232 1 521 . 1 1 61 61 PHE CA C 13 61.725 0.300 . 1 . . . . 61 PHE CA . 15232 1 522 . 1 1 61 61 PHE CB C 13 40.011 0.300 . 1 . . . . 61 PHE CB . 15232 1 523 . 1 1 61 61 PHE N N 15 122.084 0.200 . 1 . . . . 61 PHE N . 15232 1 524 . 1 1 62 62 THR H H 1 8.926 0.020 . 1 . . . . 62 THR H . 15232 1 525 . 1 1 62 62 THR HA H 1 3.573 0.020 . 1 . . . . 62 THR HA . 15232 1 526 . 1 1 62 62 THR HB H 1 4.127 0.020 . 1 . . . . 62 THR HB . 15232 1 527 . 1 1 62 62 THR CA C 13 67.702 0.300 . 1 . . . . 62 THR CA . 15232 1 528 . 1 1 62 62 THR CB C 13 68.337 0.300 . 1 . . . . 62 THR CB . 15232 1 529 . 1 1 62 62 THR CG2 C 13 21.982 0.300 . 1 . . . . 62 THR CG2 . 15232 1 530 . 1 1 62 62 THR N N 15 120.616 0.200 . 1 . . . . 62 THR N . 15232 1 531 . 1 1 63 63 LYS HB2 H 1 1.797 0.020 . 1 . . . . 63 LYS HB2 . 15232 1 532 . 1 1 63 63 LYS HD3 H 1 1.261 0.020 . 1 . . . . 63 LYS HD3 . 15232 1 533 . 1 1 63 63 LYS HG3 H 1 1.089 0.020 . 1 . . . . 63 LYS HG3 . 15232 1 534 . 1 1 63 63 LYS CA C 13 60.275 0.300 . 1 . . . . 63 LYS CA . 15232 1 535 . 1 1 63 63 LYS CB C 13 33.218 0.300 . 1 . . . . 63 LYS CB . 15232 1 536 . 1 1 63 63 LYS CD C 13 29.922 0.300 . 1 . . . . 63 LYS CD . 15232 1 537 . 1 1 63 63 LYS CE C 13 41.802 0.300 . 1 . . . . 63 LYS CE . 15232 1 538 . 1 1 63 63 LYS CG C 13 24.200 0.300 . 1 . . . . 63 LYS CG . 15232 1 539 . 1 1 64 64 LYS H H 1 7.801 0.020 . 1 . . . . 64 LYS H . 15232 1 540 . 1 1 64 64 LYS HA H 1 3.967 0.020 . 1 . . . . 64 LYS HA . 15232 1 541 . 1 1 64 64 LYS HB2 H 1 2.131 0.020 . 1 . . . . 64 LYS HB2 . 15232 1 542 . 1 1 64 64 LYS HB3 H 1 1.749 0.020 . 1 . . . . 64 LYS HB3 . 15232 1 543 . 1 1 64 64 LYS HD2 H 1 2.476 0.020 . 1 . . . . 64 LYS HD2 . 15232 1 544 . 1 1 64 64 LYS HG3 H 1 1.393 0.020 . 1 . . . . 64 LYS HG3 . 15232 1 545 . 1 1 64 64 LYS CA C 13 59.233 0.300 . 1 . . . . 64 LYS CA . 15232 1 546 . 1 1 64 64 LYS CB C 13 32.084 0.300 . 1 . . . . 64 LYS CB . 15232 1 547 . 1 1 64 64 LYS CD C 13 28.660 0.300 . 1 . . . . 64 LYS CD . 15232 1 548 . 1 1 64 64 LYS CG C 13 24.623 0.300 . 1 . . . . 64 LYS CG . 15232 1 549 . 1 1 64 64 LYS N N 15 117.331 0.200 . 1 . . . . 64 LYS N . 15232 1 550 . 1 1 65 65 MET H H 1 7.729 0.020 . 1 . . . . 65 MET H . 15232 1 551 . 1 1 65 65 MET HA H 1 3.900 0.020 . 1 . . . . 65 MET HA . 15232 1 552 . 1 1 65 65 MET HB2 H 1 2.130 0.020 . 1 . . . . 65 MET HB2 . 15232 1 553 . 1 1 65 65 MET HB3 H 1 1.807 0.020 . 1 . . . . 65 MET HB3 . 15232 1 554 . 1 1 65 65 MET HG3 H 1 2.459 0.020 . 1 . . . . 65 MET HG3 . 15232 1 555 . 1 1 65 65 MET CA C 13 59.732 0.300 . 1 . . . . 65 MET CA . 15232 1 556 . 1 1 65 65 MET CB C 13 32.442 0.300 . 1 . . . . 65 MET CB . 15232 1 557 . 1 1 65 65 MET N N 15 116.220 0.200 . 1 . . . . 65 MET N . 15232 1 558 . 1 1 66 66 VAL H H 1 8.292 0.020 . 1 . . . . 66 VAL H . 15232 1 559 . 1 1 66 66 VAL HA H 1 4.163 0.020 . 1 . . . . 66 VAL HA . 15232 1 560 . 1 1 66 66 VAL HB H 1 2.189 0.020 . 1 . . . . 66 VAL HB . 15232 1 561 . 1 1 66 66 VAL HG11 H 1 0.918 0.020 . 1 . . . . 66 VAL HG1 . 15232 1 562 . 1 1 66 66 VAL HG12 H 1 0.918 0.020 . 1 . . . . 66 VAL HG1 . 15232 1 563 . 1 1 66 66 VAL HG13 H 1 0.918 0.020 . 1 . . . . 66 VAL HG1 . 15232 1 564 . 1 1 66 66 VAL HG21 H 1 1.175 0.020 . 1 . . . . 66 VAL HG2 . 15232 1 565 . 1 1 66 66 VAL HG22 H 1 1.175 0.020 . 1 . . . . 66 VAL HG2 . 15232 1 566 . 1 1 66 66 VAL HG23 H 1 1.175 0.020 . 1 . . . . 66 VAL HG2 . 15232 1 567 . 1 1 66 66 VAL CA C 13 64.320 0.300 . 1 . . . . 66 VAL CA . 15232 1 568 . 1 1 66 66 VAL CB C 13 31.293 0.300 . 1 . . . . 66 VAL CB . 15232 1 569 . 1 1 66 66 VAL CG1 C 13 19.962 0.300 . 1 . . . . 66 VAL CG1 . 15232 1 570 . 1 1 66 66 VAL CG2 C 13 21.698 0.300 . 1 . . . . 66 VAL CG2 . 15232 1 571 . 1 1 66 66 VAL N N 15 108.125 0.200 . 1 . . . . 66 VAL N . 15232 1 572 . 1 1 67 67 GLU H H 1 8.708 0.020 . 1 . . . . 67 GLU H . 15232 1 573 . 1 1 67 67 GLU HA H 1 3.974 0.020 . 1 . . . . 67 GLU HA . 15232 1 574 . 1 1 67 67 GLU HB2 H 1 2.065 0.020 . 1 . . . . 67 GLU HB2 . 15232 1 575 . 1 1 67 67 GLU HB3 H 1 1.850 0.020 . 1 . . . . 67 GLU HB3 . 15232 1 576 . 1 1 67 67 GLU HG2 H 1 2.561 0.020 . 1 . . . . 67 GLU HG2 . 15232 1 577 . 1 1 67 67 GLU HG3 H 1 2.203 0.020 . 1 . . . . 67 GLU HG3 . 15232 1 578 . 1 1 67 67 GLU CA C 13 59.244 0.300 . 1 . . . . 67 GLU CA . 15232 1 579 . 1 1 67 67 GLU CB C 13 29.175 0.300 . 1 . . . . 67 GLU CB . 15232 1 580 . 1 1 67 67 GLU CG C 13 37.695 0.300 . 1 . . . . 67 GLU CG . 15232 1 581 . 1 1 67 67 GLU N N 15 121.073 0.200 . 1 . . . . 67 GLU N . 15232 1 582 . 1 1 68 68 ASN H H 1 7.380 0.020 . 1 . . . . 68 ASN H . 15232 1 583 . 1 1 68 68 ASN HA H 1 4.683 0.020 . 1 . . . . 68 ASN HA . 15232 1 584 . 1 1 68 68 ASN HB3 H 1 2.811 0.020 . 1 . . . . 68 ASN HB3 . 15232 1 585 . 1 1 68 68 ASN CA C 13 53.400 0.300 . 1 . . . . 68 ASN CA . 15232 1 586 . 1 1 68 68 ASN CB C 13 38.981 0.300 . 1 . . . . 68 ASN CB . 15232 1 587 . 1 1 68 68 ASN N N 15 113.480 0.200 . 1 . . . . 68 ASN N . 15232 1 588 . 1 1 69 69 ALA H H 1 6.715 0.020 . 1 . . . . 69 ALA H . 15232 1 589 . 1 1 69 69 ALA HA H 1 4.523 0.020 . 1 . . . . 69 ALA HA . 15232 1 590 . 1 1 69 69 ALA HB1 H 1 1.341 0.020 . 1 . . . . 69 ALA HB . 15232 1 591 . 1 1 69 69 ALA HB2 H 1 1.341 0.020 . 1 . . . . 69 ALA HB . 15232 1 592 . 1 1 69 69 ALA HB3 H 1 1.341 0.020 . 1 . . . . 69 ALA HB . 15232 1 593 . 1 1 69 69 ALA CA C 13 51.400 0.300 . 1 . . . . 69 ALA CA . 15232 1 594 . 1 1 69 69 ALA CB C 13 19.430 0.300 . 1 . . . . 69 ALA CB . 15232 1 595 . 1 1 69 69 ALA N N 15 121.210 0.200 . 1 . . . . 69 ALA N . 15232 1 596 . 1 1 70 70 LYS H H 1 10.153 0.020 . 1 . . . . 70 LYS H . 15232 1 597 . 1 1 70 70 LYS HA H 1 4.366 0.020 . 1 . . . . 70 LYS HA . 15232 1 598 . 1 1 70 70 LYS HB2 H 1 2.062 0.020 . 1 . . . . 70 LYS HB2 . 15232 1 599 . 1 1 70 70 LYS HB3 H 1 1.930 0.020 . 1 . . . . 70 LYS HB3 . 15232 1 600 . 1 1 70 70 LYS CA C 13 57.795 0.300 . 1 . . . . 70 LYS CA . 15232 1 601 . 1 1 70 70 LYS CB C 13 32.217 0.300 . 1 . . . . 70 LYS CB . 15232 1 602 . 1 1 70 70 LYS CD C 13 28.919 0.300 . 1 . . . . 70 LYS CD . 15232 1 603 . 1 1 70 70 LYS CG C 13 25.166 0.300 . 1 . . . . 70 LYS CG . 15232 1 604 . 1 1 70 70 LYS N N 15 125.679 0.200 . 1 . . . . 70 LYS N . 15232 1 605 . 1 1 71 71 LYS H H 1 8.960 0.020 . 1 . . . . 71 LYS H . 15232 1 606 . 1 1 71 71 LYS HA H 1 4.678 0.020 . 1 . . . . 71 LYS HA . 15232 1 607 . 1 1 71 71 LYS HB2 H 1 1.868 0.020 . 1 . . . . 71 LYS HB2 . 15232 1 608 . 1 1 71 71 LYS HB3 H 1 1.692 0.020 . 1 . . . . 71 LYS HB3 . 15232 1 609 . 1 1 71 71 LYS HD2 H 1 1.474 0.020 . 1 . . . . 71 LYS HD2 . 15232 1 610 . 1 1 71 71 LYS HG3 H 1 1.240 0.020 . 1 . . . . 71 LYS HG3 . 15232 1 611 . 1 1 71 71 LYS CA C 13 55.446 0.300 . 1 . . . . 71 LYS CA . 15232 1 612 . 1 1 71 71 LYS CB C 13 35.494 0.300 . 1 . . . . 71 LYS CB . 15232 1 613 . 1 1 71 71 LYS CD C 13 29.344 0.300 . 1 . . . . 71 LYS CD . 15232 1 614 . 1 1 71 71 LYS CE C 13 41.624 0.300 . 1 . . . . 71 LYS CE . 15232 1 615 . 1 1 71 71 LYS CG C 13 25.039 0.300 . 1 . . . . 71 LYS CG . 15232 1 616 . 1 1 71 71 LYS N N 15 121.784 0.200 . 1 . . . . 71 LYS N . 15232 1 617 . 1 1 72 72 ILE H H 1 9.030 0.020 . 1 . . . . 72 ILE H . 15232 1 618 . 1 1 72 72 ILE HA H 1 5.275 0.020 . 1 . . . . 72 ILE HA . 15232 1 619 . 1 1 72 72 ILE HB H 1 1.889 0.020 . 1 . . . . 72 ILE HB . 15232 1 620 . 1 1 72 72 ILE HG12 H 1 1.470 0.020 . 1 . . . . 72 ILE HG12 . 15232 1 621 . 1 1 72 72 ILE HG13 H 1 1.176 0.020 . 1 . . . . 72 ILE HG13 . 15232 1 622 . 1 1 72 72 ILE HG21 H 1 0.665 0.020 . 1 . . . . 72 ILE HG2 . 15232 1 623 . 1 1 72 72 ILE HG22 H 1 0.665 0.020 . 1 . . . . 72 ILE HG2 . 15232 1 624 . 1 1 72 72 ILE HG23 H 1 0.665 0.020 . 1 . . . . 72 ILE HG2 . 15232 1 625 . 1 1 72 72 ILE CA C 13 58.354 0.300 . 1 . . . . 72 ILE CA . 15232 1 626 . 1 1 72 72 ILE CB C 13 38.091 0.300 . 1 . . . . 72 ILE CB . 15232 1 627 . 1 1 72 72 ILE CD1 C 13 12.452 0.300 . 1 . . . . 72 ILE CD1 . 15232 1 628 . 1 1 72 72 ILE CG1 C 13 28.106 0.300 . 1 . . . . 72 ILE CG1 . 15232 1 629 . 1 1 72 72 ILE CG2 C 13 17.724 0.300 . 1 . . . . 72 ILE CG2 . 15232 1 630 . 1 1 72 72 ILE N N 15 129.209 0.200 . 1 . . . . 72 ILE N . 15232 1 631 . 1 1 73 73 GLU H H 1 8.808 0.020 . 1 . . . . 73 GLU H . 15232 1 632 . 1 1 73 73 GLU HA H 1 5.247 0.020 . 1 . . . . 73 GLU HA . 15232 1 633 . 1 1 73 73 GLU HB3 H 1 1.798 0.020 . 1 . . . . 73 GLU HB3 . 15232 1 634 . 1 1 73 73 GLU HG3 H 1 1.970 0.020 . 1 . . . . 73 GLU HG3 . 15232 1 635 . 1 1 73 73 GLU CA C 13 53.758 0.300 . 1 . . . . 73 GLU CA . 15232 1 636 . 1 1 73 73 GLU CB C 13 36.308 0.300 . 1 . . . . 73 GLU CB . 15232 1 637 . 1 1 73 73 GLU CG C 13 37.733 0.300 . 1 . . . . 73 GLU CG . 15232 1 638 . 1 1 73 73 GLU N N 15 122.981 0.200 . 1 . . . . 73 GLU N . 15232 1 639 . 1 1 74 74 VAL H H 1 9.479 0.020 . 1 . . . . 74 VAL H . 15232 1 640 . 1 1 74 74 VAL HA H 1 4.686 0.020 . 1 . . . . 74 VAL HA . 15232 1 641 . 1 1 74 74 VAL HB H 1 1.294 0.020 . 1 . . . . 74 VAL HB . 15232 1 642 . 1 1 74 74 VAL HG11 H 1 0.261 0.020 . 1 . . . . 74 VAL HG1 . 15232 1 643 . 1 1 74 74 VAL HG12 H 1 0.261 0.020 . 1 . . . . 74 VAL HG1 . 15232 1 644 . 1 1 74 74 VAL HG13 H 1 0.261 0.020 . 1 . . . . 74 VAL HG1 . 15232 1 645 . 1 1 74 74 VAL CA C 13 59.504 0.300 . 1 . . . . 74 VAL CA . 15232 1 646 . 1 1 74 74 VAL CB C 13 34.556 0.300 . 1 . . . . 74 VAL CB . 15232 1 647 . 1 1 74 74 VAL N N 15 117.328 0.200 . 1 . . . . 74 VAL N . 15232 1 648 . 1 1 75 75 GLU H H 1 8.889 0.020 . 1 . . . . 75 GLU H . 15232 1 649 . 1 1 75 75 GLU HA H 1 5.143 0.020 . 1 . . . . 75 GLU HA . 15232 1 650 . 1 1 75 75 GLU HB3 H 1 1.849 0.020 . 1 . . . . 75 GLU HB3 . 15232 1 651 . 1 1 75 75 GLU HG2 H 1 2.904 0.020 . 1 . . . . 75 GLU HG2 . 15232 1 652 . 1 1 75 75 GLU HG3 H 1 2.255 0.020 . 1 . . . . 75 GLU HG3 . 15232 1 653 . 1 1 75 75 GLU CA C 13 54.569 0.300 . 1 . . . . 75 GLU CA . 15232 1 654 . 1 1 75 75 GLU CB C 13 35.887 0.300 . 1 . . . . 75 GLU CB . 15232 1 655 . 1 1 75 75 GLU CG C 13 37.143 0.300 . 1 . . . . 75 GLU CG . 15232 1 656 . 1 1 75 75 GLU N N 15 126.817 0.200 . 1 . . . . 75 GLU N . 15232 1 657 . 1 1 76 76 PHE H H 1 8.907 0.020 . 1 . . . . 76 PHE H . 15232 1 658 . 1 1 76 76 PHE HA H 1 4.745 0.020 . 1 . . . . 76 PHE HA . 15232 1 659 . 1 1 76 76 PHE HB2 H 1 3.519 0.020 . 1 . . . . 76 PHE HB2 . 15232 1 660 . 1 1 76 76 PHE HB3 H 1 2.911 0.020 . 1 . . . . 76 PHE HB3 . 15232 1 661 . 1 1 76 76 PHE HD1 H 1 7.677 0.020 . 1 . . . . 76 PHE HD1 . 15232 1 662 . 1 1 76 76 PHE HE1 H 1 7.236 0.020 . 1 . . . . 76 PHE HE1 . 15232 1 663 . 1 1 76 76 PHE CA C 13 59.616 0.300 . 1 . . . . 76 PHE CA . 15232 1 664 . 1 1 76 76 PHE CB C 13 39.957 0.300 . 1 . . . . 76 PHE CB . 15232 1 665 . 1 1 76 76 PHE N N 15 126.561 0.200 . 1 . . . . 76 PHE N . 15232 1 666 . 1 1 77 77 ASP H H 1 9.461 0.020 . 1 . . . . 77 ASP H . 15232 1 667 . 1 1 77 77 ASP HA H 1 5.294 0.020 . 1 . . . . 77 ASP HA . 15232 1 668 . 1 1 77 77 ASP HB2 H 1 3.875 0.020 . 1 . . . . 77 ASP HB2 . 15232 1 669 . 1 1 77 77 ASP HB3 H 1 2.457 0.020 . 1 . . . . 77 ASP HB3 . 15232 1 670 . 1 1 77 77 ASP CA C 13 51.596 0.300 . 1 . . . . 77 ASP CA . 15232 1 671 . 1 1 77 77 ASP CB C 13 43.498 0.300 . 1 . . . . 77 ASP CB . 15232 1 672 . 1 1 77 77 ASP N N 15 123.556 0.200 . 1 . . . . 77 ASP N . 15232 1 673 . 1 1 78 78 LYS H H 1 10.573 0.020 . 1 . . . . 78 LYS H . 15232 1 674 . 1 1 78 78 LYS HA H 1 4.380 0.020 . 1 . . . . 78 LYS HA . 15232 1 675 . 1 1 78 78 LYS HB2 H 1 2.066 0.020 . 1 . . . . 78 LYS HB2 . 15232 1 676 . 1 1 78 78 LYS HB3 H 1 1.951 0.020 . 1 . . . . 78 LYS HB3 . 15232 1 677 . 1 1 78 78 LYS HD2 H 1 1.776 0.020 . 1 . . . . 78 LYS HD2 . 15232 1 678 . 1 1 78 78 LYS CA C 13 57.183 0.300 . 1 . . . . 78 LYS CA . 15232 1 679 . 1 1 78 78 LYS CB C 13 33.477 0.300 . 1 . . . . 78 LYS CB . 15232 1 680 . 1 1 78 78 LYS CD C 13 29.482 0.300 . 1 . . . . 78 LYS CD . 15232 1 681 . 1 1 78 78 LYS CG C 13 24.660 0.300 . 1 . . . . 78 LYS CG . 15232 1 682 . 1 1 78 78 LYS N N 15 119.101 0.200 . 1 . . . . 78 LYS N . 15232 1 683 . 1 1 79 79 GLY H H 1 8.200 0.020 . 1 . . . . 79 GLY H . 15232 1 684 . 1 1 79 79 GLY HA2 H 1 4.360 0.020 . 1 . . . . 79 GLY HA2 . 15232 1 685 . 1 1 79 79 GLY HA3 H 1 3.524 0.020 . 1 . . . . 79 GLY HA3 . 15232 1 686 . 1 1 79 79 GLY CA C 13 44.699 0.300 . 1 . . . . 79 GLY CA . 15232 1 687 . 1 1 79 79 GLY N N 15 112.008 0.200 . 1 . . . . 79 GLY N . 15232 1 688 . 1 1 81 81 ARG H H 1 8.750 0.020 . 1 . . . . 81 ARG H . 15232 1 689 . 1 1 81 81 ARG HA H 1 4.589 0.020 . 1 . . . . 81 ARG HA . 15232 1 690 . 1 1 81 81 ARG HB2 H 1 1.769 0.020 . 1 . . . . 81 ARG HB2 . 15232 1 691 . 1 1 81 81 ARG HB3 H 1 1.667 0.020 . 1 . . . . 81 ARG HB3 . 15232 1 692 . 1 1 81 81 ARG HD3 H 1 2.910 0.020 . 1 . . . . 81 ARG HD3 . 15232 1 693 . 1 1 81 81 ARG HG3 H 1 1.445 0.020 . 1 . . . . 81 ARG HG3 . 15232 1 694 . 1 1 81 81 ARG CA C 13 58.393 0.300 . 1 . . . . 81 ARG CA . 15232 1 695 . 1 1 81 81 ARG CB C 13 32.321 0.300 . 1 . . . . 81 ARG CB . 15232 1 696 . 1 1 81 81 ARG CD C 13 43.513 0.300 . 1 . . . . 81 ARG CD . 15232 1 697 . 1 1 81 81 ARG CG C 13 28.637 0.300 . 1 . . . . 81 ARG CG . 15232 1 698 . 1 1 81 81 ARG N N 15 123.292 0.200 . 1 . . . . 81 ARG N . 15232 1 699 . 1 1 82 82 THR H H 1 7.305 0.020 . 1 . . . . 82 THR H . 15232 1 700 . 1 1 82 82 THR HA H 1 5.555 0.020 . 1 . . . . 82 THR HA . 15232 1 701 . 1 1 82 82 THR HB H 1 3.879 0.020 . 1 . . . . 82 THR HB . 15232 1 702 . 1 1 82 82 THR HG21 H 1 0.946 0.020 . 1 . . . . 82 THR HG2 . 15232 1 703 . 1 1 82 82 THR HG22 H 1 0.946 0.020 . 1 . . . . 82 THR HG2 . 15232 1 704 . 1 1 82 82 THR HG23 H 1 0.946 0.020 . 1 . . . . 82 THR HG2 . 15232 1 705 . 1 1 82 82 THR CA C 13 58.061 0.300 . 1 . . . . 82 THR CA . 15232 1 706 . 1 1 82 82 THR CB C 13 72.611 0.300 . 1 . . . . 82 THR CB . 15232 1 707 . 1 1 82 82 THR N N 15 106.026 0.200 . 1 . . . . 82 THR N . 15232 1 708 . 1 1 83 83 ASP H H 1 8.643 0.020 . 1 . . . . 83 ASP H . 15232 1 709 . 1 1 83 83 ASP HA H 1 4.586 0.020 . 1 . . . . 83 ASP HA . 15232 1 710 . 1 1 83 83 ASP HB2 H 1 3.570 0.020 . 1 . . . . 83 ASP HB2 . 15232 1 711 . 1 1 83 83 ASP HB3 H 1 2.561 0.020 . 1 . . . . 83 ASP HB3 . 15232 1 712 . 1 1 83 83 ASP CA C 13 51.908 0.300 . 1 . . . . 83 ASP CA . 15232 1 713 . 1 1 83 83 ASP CB C 13 41.732 0.300 . 1 . . . . 83 ASP CB . 15232 1 714 . 1 1 83 83 ASP N N 15 120.898 0.200 . 1 . . . . 83 ASP N . 15232 1 715 . 1 1 84 84 LYS H H 1 8.333 0.020 . 1 . . . . 84 LYS H . 15232 1 716 . 1 1 84 84 LYS HA H 1 4.081 0.020 . 1 . . . . 84 LYS HA . 15232 1 717 . 1 1 84 84 LYS HB2 H 1 1.545 0.020 . 1 . . . . 84 LYS HB2 . 15232 1 718 . 1 1 84 84 LYS HB3 H 1 1.724 0.020 . 1 . . . . 84 LYS HB3 . 15232 1 719 . 1 1 84 84 LYS HD3 H 1 1.087 0.020 . 1 . . . . 84 LYS HD3 . 15232 1 720 . 1 1 84 84 LYS HG3 H 1 0.540 0.020 . 1 . . . . 84 LYS HG3 . 15232 1 721 . 1 1 84 84 LYS CA C 13 58.250 0.300 . 1 . . . . 84 LYS CA . 15232 1 722 . 1 1 84 84 LYS CB C 13 31.559 0.300 . 1 . . . . 84 LYS CB . 15232 1 723 . 1 1 84 84 LYS CD C 13 29.146 0.300 . 1 . . . . 84 LYS CD . 15232 1 724 . 1 1 84 84 LYS CE C 13 41.633 0.300 . 1 . . . . 84 LYS CE . 15232 1 725 . 1 1 84 84 LYS CG C 13 23.736 0.300 . 1 . . . . 84 LYS CG . 15232 1 726 . 1 1 84 84 LYS N N 15 116.919 0.200 . 1 . . . . 84 LYS N . 15232 1 727 . 1 1 85 85 TYR H H 1 7.995 0.020 . 1 . . . . 85 TYR H . 15232 1 728 . 1 1 85 85 TYR HA H 1 4.636 0.020 . 1 . . . . 85 TYR HA . 15232 1 729 . 1 1 85 85 TYR HB2 H 1 3.406 0.020 . 1 . . . . 85 TYR HB2 . 15232 1 730 . 1 1 85 85 TYR HB3 H 1 2.809 0.020 . 1 . . . . 85 TYR HB3 . 15232 1 731 . 1 1 85 85 TYR HD1 H 1 7.095 0.020 . 1 . . . . 85 TYR HD1 . 15232 1 732 . 1 1 85 85 TYR HE1 H 1 6.865 0.020 . 1 . . . . 85 TYR HE1 . 15232 1 733 . 1 1 85 85 TYR CA C 13 57.090 0.300 . 1 . . . . 85 TYR CA . 15232 1 734 . 1 1 85 85 TYR CB C 13 38.068 0.300 . 1 . . . . 85 TYR CB . 15232 1 735 . 1 1 85 85 TYR N N 15 119.114 0.200 . 1 . . . . 85 TYR N . 15232 1 736 . 1 1 86 86 GLY H H 1 8.129 0.020 . 1 . . . . 86 GLY H . 15232 1 737 . 1 1 86 86 GLY HA2 H 1 4.231 0.020 . 1 . . . . 86 GLY HA2 . 15232 1 738 . 1 1 86 86 GLY HA3 H 1 3.623 0.020 . 1 . . . . 86 GLY HA3 . 15232 1 739 . 1 1 86 86 GLY CA C 13 45.452 0.300 . 1 . . . . 86 GLY CA . 15232 1 740 . 1 1 86 86 GLY N N 15 108.423 0.200 . 1 . . . . 86 GLY N . 15232 1 741 . 1 1 87 87 ARG H H 1 8.560 0.020 . 1 . . . . 87 ARG H . 15232 1 742 . 1 1 87 87 ARG HA H 1 4.433 0.020 . 1 . . . . 87 ARG HA . 15232 1 743 . 1 1 87 87 ARG HB2 H 1 1.965 0.020 . 1 . . . . 87 ARG HB2 . 15232 1 744 . 1 1 87 87 ARG HB3 H 1 2.185 0.020 . 1 . . . . 87 ARG HB3 . 15232 1 745 . 1 1 87 87 ARG HG3 H 1 2.403 0.020 . 1 . . . . 87 ARG HG3 . 15232 1 746 . 1 1 87 87 ARG CA C 13 55.789 0.300 . 1 . . . . 87 ARG CA . 15232 1 747 . 1 1 87 87 ARG CB C 13 29.794 0.300 . 1 . . . . 87 ARG CB . 15232 1 748 . 1 1 87 87 ARG CD C 13 43.664 0.300 . 1 . . . . 87 ARG CD . 15232 1 749 . 1 1 87 87 ARG CG C 13 27.810 0.300 . 1 . . . . 87 ARG CG . 15232 1 750 . 1 1 87 87 ARG N N 15 121.795 0.200 . 1 . . . . 87 ARG N . 15232 1 751 . 1 1 88 88 GLY H H 1 8.729 0.020 . 1 . . . . 88 GLY H . 15232 1 752 . 1 1 88 88 GLY HA2 H 1 4.344 0.020 . 1 . . . . 88 GLY HA2 . 15232 1 753 . 1 1 88 88 GLY HA3 H 1 2.763 0.020 . 1 . . . . 88 GLY HA3 . 15232 1 754 . 1 1 88 88 GLY CA C 13 45.143 0.300 . 1 . . . . 88 GLY CA . 15232 1 755 . 1 1 88 88 GLY N N 15 108.450 0.200 . 1 . . . . 88 GLY N . 15232 1 756 . 1 1 89 89 LEU H H 1 8.312 0.020 . 1 . . . . 89 LEU H . 15232 1 757 . 1 1 89 89 LEU HA H 1 5.045 0.020 . 1 . . . . 89 LEU HA . 15232 1 758 . 1 1 89 89 LEU HB2 H 1 1.748 0.020 . 1 . . . . 89 LEU HB2 . 15232 1 759 . 1 1 89 89 LEU HB3 H 1 0.964 0.020 . 1 . . . . 89 LEU HB3 . 15232 1 760 . 1 1 89 89 LEU HD11 H 1 0.177 0.020 . 1 . . . . 89 LEU HD1 . 15232 1 761 . 1 1 89 89 LEU HD12 H 1 0.177 0.020 . 1 . . . . 89 LEU HD1 . 15232 1 762 . 1 1 89 89 LEU HD13 H 1 0.177 0.020 . 1 . . . . 89 LEU HD1 . 15232 1 763 . 1 1 89 89 LEU HD21 H 1 0.686 0.020 . 1 . . . . 89 LEU HD2 . 15232 1 764 . 1 1 89 89 LEU HD22 H 1 0.686 0.020 . 1 . . . . 89 LEU HD2 . 15232 1 765 . 1 1 89 89 LEU HD23 H 1 0.686 0.020 . 1 . . . . 89 LEU HD2 . 15232 1 766 . 1 1 89 89 LEU HG H 1 1.398 0.020 . 1 . . . . 89 LEU HG . 15232 1 767 . 1 1 89 89 LEU CA C 13 52.873 0.300 . 1 . . . . 89 LEU CA . 15232 1 768 . 1 1 89 89 LEU CB C 13 42.220 0.300 . 1 . . . . 89 LEU CB . 15232 1 769 . 1 1 89 89 LEU CD1 C 13 22.912 0.300 . 1 . . . . 89 LEU CD1 . 15232 1 770 . 1 1 89 89 LEU CG C 13 25.217 0.300 . 1 . . . . 89 LEU CG . 15232 1 771 . 1 1 89 89 LEU N N 15 125.357 0.200 . 1 . . . . 89 LEU N . 15232 1 772 . 1 1 90 90 ALA H H 1 7.711 0.020 . 1 . . . . 90 ALA H . 15232 1 773 . 1 1 90 90 ALA HA H 1 4.835 0.020 . 1 . . . . 90 ALA HA . 15232 1 774 . 1 1 90 90 ALA HB1 H 1 0.752 0.020 . 1 . . . . 90 ALA HB . 15232 1 775 . 1 1 90 90 ALA HB2 H 1 0.752 0.020 . 1 . . . . 90 ALA HB . 15232 1 776 . 1 1 90 90 ALA HB3 H 1 0.752 0.020 . 1 . . . . 90 ALA HB . 15232 1 777 . 1 1 90 90 ALA CA C 13 50.693 0.300 . 1 . . . . 90 ALA CA . 15232 1 778 . 1 1 90 90 ALA CB C 13 24.043 0.300 . 1 . . . . 90 ALA CB . 15232 1 779 . 1 1 90 90 ALA N N 15 120.608 0.200 . 1 . . . . 90 ALA N . 15232 1 780 . 1 1 91 91 TYR H H 1 9.022 0.020 . 1 . . . . 91 TYR H . 15232 1 781 . 1 1 91 91 TYR HA H 1 4.599 0.020 . 1 . . . . 91 TYR HA . 15232 1 782 . 1 1 91 91 TYR HB2 H 1 3.395 0.020 . 1 . . . . 91 TYR HB2 . 15232 1 783 . 1 1 91 91 TYR HB3 H 1 2.815 0.020 . 1 . . . . 91 TYR HB3 . 15232 1 784 . 1 1 91 91 TYR HD1 H 1 7.188 0.020 . 1 . . . . 91 TYR HD1 . 15232 1 785 . 1 1 91 91 TYR HE1 H 1 6.606 0.020 . 1 . . . . 91 TYR HE1 . 15232 1 786 . 1 1 91 91 TYR CA C 13 57.216 0.300 . 1 . . . . 91 TYR CA . 15232 1 787 . 1 1 91 91 TYR CB C 13 37.731 0.300 . 1 . . . . 91 TYR CB . 15232 1 788 . 1 1 91 91 TYR N N 15 122.672 0.200 . 1 . . . . 91 TYR N . 15232 1 789 . 1 1 92 92 ILE H H 1 8.007 0.020 . 1 . . . . 92 ILE H . 15232 1 790 . 1 1 92 92 ILE HA H 1 4.954 0.020 . 1 . . . . 92 ILE HA . 15232 1 791 . 1 1 92 92 ILE HB H 1 1.495 0.020 . 1 . . . . 92 ILE HB . 15232 1 792 . 1 1 92 92 ILE HG12 H 1 0.989 0.020 . 1 . . . . 92 ILE HG12 . 15232 1 793 . 1 1 92 92 ILE HG13 H 1 1.171 0.020 . 1 . . . . 92 ILE HG13 . 15232 1 794 . 1 1 92 92 ILE HG21 H 1 0.671 0.020 . 1 . . . . 92 ILE HG2 . 15232 1 795 . 1 1 92 92 ILE HG22 H 1 0.671 0.020 . 1 . . . . 92 ILE HG2 . 15232 1 796 . 1 1 92 92 ILE HG23 H 1 0.671 0.020 . 1 . . . . 92 ILE HG2 . 15232 1 797 . 1 1 92 92 ILE CA C 13 58.580 0.300 . 1 . . . . 92 ILE CA . 15232 1 798 . 1 1 92 92 ILE CB C 13 38.930 0.300 . 1 . . . . 92 ILE CB . 15232 1 799 . 1 1 92 92 ILE CD1 C 13 12.398 0.300 . 1 . . . . 92 ILE CD1 . 15232 1 800 . 1 1 92 92 ILE CG1 C 13 27.834 0.300 . 1 . . . . 92 ILE CG1 . 15232 1 801 . 1 1 92 92 ILE CG2 C 13 16.745 0.300 . 1 . . . . 92 ILE CG2 . 15232 1 802 . 1 1 92 92 ILE N N 15 122.682 0.200 . 1 . . . . 92 ILE N . 15232 1 803 . 1 1 94 94 ALA H H 1 9.306 0.020 . 1 . . . . 94 ALA H . 15232 1 804 . 1 1 94 94 ALA HA H 1 4.989 0.020 . 1 . . . . 94 ALA HA . 15232 1 805 . 1 1 94 94 ALA HB1 H 1 1.138 0.020 . 1 . . . . 94 ALA HB . 15232 1 806 . 1 1 94 94 ALA HB2 H 1 1.138 0.020 . 1 . . . . 94 ALA HB . 15232 1 807 . 1 1 94 94 ALA HB3 H 1 1.138 0.020 . 1 . . . . 94 ALA HB . 15232 1 808 . 1 1 94 94 ALA CA C 13 49.759 0.300 . 1 . . . . 94 ALA CA . 15232 1 809 . 1 1 94 94 ALA CB C 13 20.999 0.300 . 1 . . . . 94 ALA CB . 15232 1 810 . 1 1 94 94 ALA N N 15 125.954 0.200 . 1 . . . . 94 ALA N . 15232 1 811 . 1 1 95 95 ASP H H 1 9.772 0.020 . 1 . . . . 95 ASP H . 15232 1 812 . 1 1 95 95 ASP HA H 1 4.436 0.020 . 1 . . . . 95 ASP HA . 15232 1 813 . 1 1 95 95 ASP HB2 H 1 2.913 0.020 . 1 . . . . 95 ASP HB2 . 15232 1 814 . 1 1 95 95 ASP HB3 H 1 2.734 0.020 . 1 . . . . 95 ASP HB3 . 15232 1 815 . 1 1 95 95 ASP CA C 13 56.419 0.300 . 1 . . . . 95 ASP CA . 15232 1 816 . 1 1 95 95 ASP CB C 13 39.525 0.300 . 1 . . . . 95 ASP CB . 15232 1 817 . 1 1 95 95 ASP N N 15 127.739 0.200 . 1 . . . . 95 ASP N . 15232 1 818 . 1 1 96 96 GLY H H 1 9.408 0.020 . 1 . . . . 96 GLY H . 15232 1 819 . 1 1 96 96 GLY HA2 H 1 4.232 0.020 . 1 . . . . 96 GLY HA2 . 15232 1 820 . 1 1 96 96 GLY HA3 H 1 3.722 0.020 . 1 . . . . 96 GLY HA3 . 15232 1 821 . 1 1 96 96 GLY CA C 13 45.303 0.300 . 1 . . . . 96 GLY CA . 15232 1 822 . 1 1 96 96 GLY N N 15 103.109 0.200 . 1 . . . . 96 GLY N . 15232 1 823 . 1 1 97 97 LYS H H 1 7.887 0.020 . 1 . . . . 97 LYS H . 15232 1 824 . 1 1 97 97 LYS HA H 1 4.685 0.020 . 1 . . . . 97 LYS HA . 15232 1 825 . 1 1 97 97 LYS HB2 H 1 1.867 0.020 . 1 . . . . 97 LYS HB2 . 15232 1 826 . 1 1 97 97 LYS HB3 H 1 1.745 0.020 . 1 . . . . 97 LYS HB3 . 15232 1 827 . 1 1 97 97 LYS HD3 H 1 2.052 0.020 . 1 . . . . 97 LYS HD3 . 15232 1 828 . 1 1 97 97 LYS HE2 H 1 3.010 0.020 . 1 . . . . 97 LYS HE2 . 15232 1 829 . 1 1 97 97 LYS HG2 H 1 1.468 0.020 . 1 . . . . 97 LYS HG2 . 15232 1 830 . 1 1 97 97 LYS CA C 13 54.303 0.300 . 1 . . . . 97 LYS CA . 15232 1 831 . 1 1 97 97 LYS CB C 13 33.188 0.300 . 1 . . . . 97 LYS CB . 15232 1 832 . 1 1 97 97 LYS CD C 13 28.390 0.300 . 1 . . . . 97 LYS CD . 15232 1 833 . 1 1 97 97 LYS CG C 13 24.589 0.300 . 1 . . . . 97 LYS CG . 15232 1 834 . 1 1 97 97 LYS N N 15 121.488 0.200 . 1 . . . . 97 LYS N . 15232 1 835 . 1 1 98 98 MET H H 1 9.361 0.020 . 1 . . . . 98 MET H . 15232 1 836 . 1 1 98 98 MET HA H 1 3.831 0.020 . 1 . . . . 98 MET HA . 15232 1 837 . 1 1 98 98 MET HB2 H 1 2.107 0.020 . 1 . . . . 98 MET HB2 . 15232 1 838 . 1 1 98 98 MET HB3 H 1 1.952 0.020 . 1 . . . . 98 MET HB3 . 15232 1 839 . 1 1 98 98 MET HE1 H 1 0.679 0.020 . 1 . . . . 98 MET HE . 15232 1 840 . 1 1 98 98 MET HE2 H 1 0.679 0.020 . 1 . . . . 98 MET HE . 15232 1 841 . 1 1 98 98 MET HE3 H 1 0.679 0.020 . 1 . . . . 98 MET HE . 15232 1 842 . 1 1 98 98 MET CA C 13 56.201 0.300 . 1 . . . . 98 MET CA . 15232 1 843 . 1 1 98 98 MET CB C 13 34.616 0.300 . 1 . . . . 98 MET CB . 15232 1 844 . 1 1 98 98 MET CG C 13 28.461 0.300 . 1 . . . . 98 MET CG . 15232 1 845 . 1 1 98 98 MET N N 15 127.130 0.200 . 1 . . . . 98 MET N . 15232 1 846 . 1 1 101 101 GLU H H 1 6.152 0.020 . 1 . . . . 101 GLU H . 15232 1 847 . 1 1 101 101 GLU HA H 1 3.676 0.020 . 1 . . . . 101 GLU HA . 15232 1 848 . 1 1 101 101 GLU HB2 H 1 2.251 0.020 . 1 . . . . 101 GLU HB2 . 15232 1 849 . 1 1 101 101 GLU HG2 H 1 2.320 0.020 . 1 . . . . 101 GLU HG2 . 15232 1 850 . 1 1 101 101 GLU HG3 H 1 2.130 0.020 . 1 . . . . 101 GLU HG3 . 15232 1 851 . 1 1 101 101 GLU CA C 13 59.711 0.300 . 1 . . . . 101 GLU CA . 15232 1 852 . 1 1 101 101 GLU CB C 13 30.415 0.300 . 1 . . . . 101 GLU CB . 15232 1 853 . 1 1 101 101 GLU CG C 13 35.560 0.300 . 1 . . . . 101 GLU CG . 15232 1 854 . 1 1 101 101 GLU N N 15 112.878 0.200 . 1 . . . . 101 GLU N . 15232 1 855 . 1 1 102 102 ALA H H 1 7.775 0.020 . 1 . . . . 102 ALA H . 15232 1 856 . 1 1 102 102 ALA HA H 1 4.081 0.020 . 1 . . . . 102 ALA HA . 15232 1 857 . 1 1 102 102 ALA HB1 H 1 1.721 0.020 . 1 . . . . 102 ALA HB . 15232 1 858 . 1 1 102 102 ALA HB2 H 1 1.721 0.020 . 1 . . . . 102 ALA HB . 15232 1 859 . 1 1 102 102 ALA HB3 H 1 1.721 0.020 . 1 . . . . 102 ALA HB . 15232 1 860 . 1 1 102 102 ALA CA C 13 55.369 0.300 . 1 . . . . 102 ALA CA . 15232 1 861 . 1 1 102 102 ALA CB C 13 18.174 0.300 . 1 . . . . 102 ALA CB . 15232 1 862 . 1 1 102 102 ALA N N 15 122.663 0.200 . 1 . . . . 102 ALA N . 15232 1 863 . 1 1 103 103 LEU H H 1 8.079 0.020 . 1 . . . . 103 LEU H . 15232 1 864 . 1 1 103 103 LEU HA H 1 3.318 0.020 . 1 . . . . 103 LEU HA . 15232 1 865 . 1 1 103 103 LEU HB2 H 1 1.738 0.020 . 1 . . . . 103 LEU HB2 . 15232 1 866 . 1 1 103 103 LEU HB3 H 1 1.138 0.020 . 1 . . . . 103 LEU HB3 . 15232 1 867 . 1 1 103 103 LEU HD11 H 1 0.827 0.020 . 1 . . . . 103 LEU HD1 . 15232 1 868 . 1 1 103 103 LEU HD12 H 1 0.827 0.020 . 1 . . . . 103 LEU HD1 . 15232 1 869 . 1 1 103 103 LEU HD13 H 1 0.827 0.020 . 1 . . . . 103 LEU HD1 . 15232 1 870 . 1 1 103 103 LEU HG H 1 1.561 0.020 . 1 . . . . 103 LEU HG . 15232 1 871 . 1 1 103 103 LEU CA C 13 57.965 0.300 . 1 . . . . 103 LEU CA . 15232 1 872 . 1 1 103 103 LEU CB C 13 44.916 0.300 . 1 . . . . 103 LEU CB . 15232 1 873 . 1 1 103 103 LEU CG C 13 24.620 0.300 . 1 . . . . 103 LEU CG . 15232 1 874 . 1 1 103 103 LEU N N 15 116.466 0.200 . 1 . . . . 103 LEU N . 15232 1 875 . 1 1 104 104 VAL H H 1 6.873 0.020 . 1 . . . . 104 VAL H . 15232 1 876 . 1 1 104 104 VAL HA H 1 3.893 0.020 . 1 . . . . 104 VAL HA . 15232 1 877 . 1 1 104 104 VAL HB H 1 2.101 0.020 . 1 . . . . 104 VAL HB . 15232 1 878 . 1 1 104 104 VAL HG21 H 1 1.035 0.020 . 1 . . . . 104 VAL HG2 . 15232 1 879 . 1 1 104 104 VAL HG22 H 1 1.035 0.020 . 1 . . . . 104 VAL HG2 . 15232 1 880 . 1 1 104 104 VAL HG23 H 1 1.035 0.020 . 1 . . . . 104 VAL HG2 . 15232 1 881 . 1 1 104 104 VAL CA C 13 65.114 0.300 . 1 . . . . 104 VAL CA . 15232 1 882 . 1 1 104 104 VAL CB C 13 32.119 0.300 . 1 . . . . 104 VAL CB . 15232 1 883 . 1 1 104 104 VAL CG1 C 13 22.266 0.300 . 1 . . . . 104 VAL CG1 . 15232 1 884 . 1 1 104 104 VAL CG2 C 13 23.653 0.300 . 1 . . . . 104 VAL CG2 . 15232 1 885 . 1 1 104 104 VAL N N 15 117.025 0.200 . 1 . . . . 104 VAL N . 15232 1 886 . 1 1 105 105 ARG H H 1 9.219 0.020 . 1 . . . . 105 ARG H . 15232 1 887 . 1 1 105 105 ARG HA H 1 4.127 0.020 . 1 . . . . 105 ARG HA . 15232 1 888 . 1 1 105 105 ARG HB2 H 1 2.051 0.020 . 1 . . . . 105 ARG HB2 . 15232 1 889 . 1 1 105 105 ARG CA C 13 56.923 0.300 . 1 . . . . 105 ARG CA . 15232 1 890 . 1 1 105 105 ARG CB C 13 28.364 0.300 . 1 . . . . 105 ARG CB . 15232 1 891 . 1 1 105 105 ARG CG C 13 27.382 0.300 . 1 . . . . 105 ARG CG . 15232 1 892 . 1 1 105 105 ARG N N 15 123.272 0.200 . 1 . . . . 105 ARG N . 15232 1 893 . 1 1 106 106 GLN H H 1 7.171 0.020 . 1 . . . . 106 GLN H . 15232 1 894 . 1 1 106 106 GLN HA H 1 4.333 0.020 . 1 . . . . 106 GLN HA . 15232 1 895 . 1 1 106 106 GLN HB2 H 1 2.050 0.020 . 1 . . . . 106 GLN HB2 . 15232 1 896 . 1 1 106 106 GLN HB3 H 1 1.494 0.020 . 1 . . . . 106 GLN HB3 . 15232 1 897 . 1 1 106 106 GLN HG2 H 1 2.403 0.020 . 1 . . . . 106 GLN HG2 . 15232 1 898 . 1 1 106 106 GLN CA C 13 53.885 0.300 . 1 . . . . 106 GLN CA . 15232 1 899 . 1 1 106 106 GLN CB C 13 28.522 0.300 . 1 . . . . 106 GLN CB . 15232 1 900 . 1 1 106 106 GLN CG C 13 33.745 0.300 . 1 . . . . 106 GLN CG . 15232 1 901 . 1 1 106 106 GLN N N 15 112.010 0.200 . 1 . . . . 106 GLN N . 15232 1 902 . 1 1 107 107 GLY H H 1 8.176 0.020 . 1 . . . . 107 GLY H . 15232 1 903 . 1 1 107 107 GLY CA C 13 46.515 0.300 . 1 . . . . 107 GLY CA . 15232 1 904 . 1 1 107 107 GLY N N 15 107.226 0.200 . 1 . . . . 107 GLY N . 15232 1 905 . 1 1 108 108 LEU H H 1 7.752 0.020 . 1 . . . . 108 LEU H . 15232 1 906 . 1 1 108 108 LEU HA H 1 4.372 0.020 . 1 . . . . 108 LEU HA . 15232 1 907 . 1 1 108 108 LEU HB2 H 1 2.052 0.020 . 1 . . . . 108 LEU HB2 . 15232 1 908 . 1 1 108 108 LEU HB3 H 1 1.343 0.020 . 1 . . . . 108 LEU HB3 . 15232 1 909 . 1 1 108 108 LEU HD11 H 1 0.480 0.020 . 1 . . . . 108 LEU HD1 . 15232 1 910 . 1 1 108 108 LEU HD12 H 1 0.480 0.020 . 1 . . . . 108 LEU HD1 . 15232 1 911 . 1 1 108 108 LEU HD13 H 1 0.480 0.020 . 1 . . . . 108 LEU HD1 . 15232 1 912 . 1 1 108 108 LEU HD21 H 1 0.836 0.020 . 1 . . . . 108 LEU HD2 . 15232 1 913 . 1 1 108 108 LEU HD22 H 1 0.836 0.020 . 1 . . . . 108 LEU HD2 . 15232 1 914 . 1 1 108 108 LEU HD23 H 1 0.836 0.020 . 1 . . . . 108 LEU HD2 . 15232 1 915 . 1 1 108 108 LEU CA C 13 53.480 0.300 . 1 . . . . 108 LEU CA . 15232 1 916 . 1 1 108 108 LEU CB C 13 43.440 0.300 . 1 . . . . 108 LEU CB . 15232 1 917 . 1 1 108 108 LEU CD1 C 13 18.636 0.300 . 1 . . . . 108 LEU CD1 . 15232 1 918 . 1 1 108 108 LEU CD2 C 13 24.659 0.300 . 1 . . . . 108 LEU CD2 . 15232 1 919 . 1 1 108 108 LEU CG C 13 25.797 0.300 . 1 . . . . 108 LEU CG . 15232 1 920 . 1 1 108 108 LEU N N 15 114.352 0.200 . 1 . . . . 108 LEU N . 15232 1 921 . 1 1 109 109 ALA H H 1 7.192 0.020 . 1 . . . . 109 ALA H . 15232 1 922 . 1 1 109 109 ALA HA H 1 4.398 0.020 . 1 . . . . 109 ALA HA . 15232 1 923 . 1 1 109 109 ALA HB1 H 1 1.070 0.020 . 1 . . . . 109 ALA HB . 15232 1 924 . 1 1 109 109 ALA HB2 H 1 1.070 0.020 . 1 . . . . 109 ALA HB . 15232 1 925 . 1 1 109 109 ALA HB3 H 1 1.070 0.020 . 1 . . . . 109 ALA HB . 15232 1 926 . 1 1 109 109 ALA CA C 13 50.348 0.300 . 1 . . . . 109 ALA CA . 15232 1 927 . 1 1 109 109 ALA CB C 13 24.274 0.300 . 1 . . . . 109 ALA CB . 15232 1 928 . 1 1 109 109 ALA N N 15 116.435 0.200 . 1 . . . . 109 ALA N . 15232 1 929 . 1 1 110 110 LYS H H 1 8.097 0.020 . 1 . . . . 110 LYS H . 15232 1 930 . 1 1 110 110 LYS HA H 1 5.091 0.020 . 1 . . . . 110 LYS HA . 15232 1 931 . 1 1 110 110 LYS HB2 H 1 1.940 0.020 . 1 . . . . 110 LYS HB2 . 15232 1 932 . 1 1 110 110 LYS HB3 H 1 1.844 0.020 . 1 . . . . 110 LYS HB3 . 15232 1 933 . 1 1 110 110 LYS HD3 H 1 1.631 0.020 . 1 . . . . 110 LYS HD3 . 15232 1 934 . 1 1 110 110 LYS HG3 H 1 1.238 0.020 . 1 . . . . 110 LYS HG3 . 15232 1 935 . 1 1 110 110 LYS CA C 13 54.302 0.300 . 1 . . . . 110 LYS CA . 15232 1 936 . 1 1 110 110 LYS CB C 13 35.367 0.300 . 1 . . . . 110 LYS CB . 15232 1 937 . 1 1 110 110 LYS CD C 13 29.547 0.300 . 1 . . . . 110 LYS CD . 15232 1 938 . 1 1 110 110 LYS N N 15 118.818 0.200 . 1 . . . . 110 LYS N . 15232 1 939 . 1 1 111 111 VAL H H 1 9.028 0.020 . 1 . . . . 111 VAL H . 15232 1 940 . 1 1 111 111 VAL HA H 1 4.628 0.020 . 1 . . . . 111 VAL HA . 15232 1 941 . 1 1 111 111 VAL HB H 1 1.999 0.020 . 1 . . . . 111 VAL HB . 15232 1 942 . 1 1 111 111 VAL HG21 H 1 0.969 0.020 . 1 . . . . 111 VAL HG2 . 15232 1 943 . 1 1 111 111 VAL HG22 H 1 0.969 0.020 . 1 . . . . 111 VAL HG2 . 15232 1 944 . 1 1 111 111 VAL HG23 H 1 0.969 0.020 . 1 . . . . 111 VAL HG2 . 15232 1 945 . 1 1 111 111 VAL CA C 13 62.902 0.300 . 1 . . . . 111 VAL CA . 15232 1 946 . 1 1 111 111 VAL CB C 13 31.350 0.300 . 1 . . . . 111 VAL CB . 15232 1 947 . 1 1 111 111 VAL CG1 C 13 20.875 0.300 . 1 . . . . 111 VAL CG1 . 15232 1 948 . 1 1 111 111 VAL CG2 C 13 24.819 0.300 . 1 . . . . 111 VAL CG2 . 15232 1 949 . 1 1 111 111 VAL N N 15 122.090 0.200 . 1 . . . . 111 VAL N . 15232 1 950 . 1 1 114 114 VAL H H 1 7.843 0.020 . 1 . . . . 114 VAL H . 15232 1 951 . 1 1 114 114 VAL HA H 1 3.877 0.020 . 1 . . . . 114 VAL HA . 15232 1 952 . 1 1 114 114 VAL HB H 1 1.702 0.020 . 1 . . . . 114 VAL HB . 15232 1 953 . 1 1 114 114 VAL HG11 H 1 0.684 0.020 . 1 . . . . 114 VAL HG1 . 15232 1 954 . 1 1 114 114 VAL HG12 H 1 0.684 0.020 . 1 . . . . 114 VAL HG1 . 15232 1 955 . 1 1 114 114 VAL HG13 H 1 0.684 0.020 . 1 . . . . 114 VAL HG1 . 15232 1 956 . 1 1 114 114 VAL N N 15 124.442 0.200 . 1 . . . . 114 VAL N . 15232 1 957 . 1 1 116 116 LYS H H 1 8.634 0.020 . 1 . . . . 116 LYS H . 15232 1 958 . 1 1 116 116 LYS HA H 1 3.928 0.020 . 1 . . . . 116 LYS HA . 15232 1 959 . 1 1 116 116 LYS HB3 H 1 1.747 0.020 . 1 . . . . 116 LYS HB3 . 15232 1 960 . 1 1 116 116 LYS HD3 H 1 1.577 0.020 . 1 . . . . 116 LYS HD3 . 15232 1 961 . 1 1 116 116 LYS HG2 H 1 1.312 0.020 . 1 . . . . 116 LYS HG2 . 15232 1 962 . 1 1 116 116 LYS HG3 H 1 1.231 0.020 . 1 . . . . 116 LYS HG3 . 15232 1 963 . 1 1 116 116 LYS CA C 13 57.893 0.300 . 1 . . . . 116 LYS CA . 15232 1 964 . 1 1 116 116 LYS CB C 13 32.035 0.300 . 1 . . . . 116 LYS CB . 15232 1 965 . 1 1 116 116 LYS CD C 13 28.814 0.300 . 1 . . . . 116 LYS CD . 15232 1 966 . 1 1 116 116 LYS CE C 13 41.837 0.300 . 1 . . . . 116 LYS CE . 15232 1 967 . 1 1 116 116 LYS CG C 13 24.378 0.300 . 1 . . . . 116 LYS CG . 15232 1 968 . 1 1 116 116 LYS N N 15 124.460 0.200 . 1 . . . . 116 LYS N . 15232 1 969 . 1 1 117 117 GLY H H 1 8.692 0.020 . 1 . . . . 117 GLY H . 15232 1 970 . 1 1 117 117 GLY HA2 H 1 4.228 0.020 . 1 . . . . 117 GLY HA2 . 15232 1 971 . 1 1 117 117 GLY HA3 H 1 3.731 0.020 . 1 . . . . 117 GLY HA3 . 15232 1 972 . 1 1 117 117 GLY CA C 13 45.379 0.300 . 1 . . . . 117 GLY CA . 15232 1 973 . 1 1 117 117 GLY N N 15 111.371 0.200 . 1 . . . . 117 GLY N . 15232 1 974 . 1 1 118 118 ASN H H 1 8.092 0.020 . 1 . . . . 118 ASN H . 15232 1 975 . 1 1 118 118 ASN HA H 1 5.249 0.020 . 1 . . . . 118 ASN HA . 15232 1 976 . 1 1 118 118 ASN HB2 H 1 3.040 0.020 . 1 . . . . 118 ASN HB2 . 15232 1 977 . 1 1 118 118 ASN HB3 H 1 3.166 0.020 . 1 . . . . 118 ASN HB3 . 15232 1 978 . 1 1 118 118 ASN CA C 13 51.293 0.300 . 1 . . . . 118 ASN CA . 15232 1 979 . 1 1 118 118 ASN CB C 13 38.082 0.300 . 1 . . . . 118 ASN CB . 15232 1 980 . 1 1 118 118 ASN N N 15 120.964 0.200 . 1 . . . . 118 ASN N . 15232 1 981 . 1 1 119 119 ASN H H 1 7.733 0.020 . 1 . . . . 119 ASN H . 15232 1 982 . 1 1 119 119 ASN HA H 1 4.924 0.020 . 1 . . . . 119 ASN HA . 15232 1 983 . 1 1 119 119 ASN HB2 H 1 3.218 0.020 . 1 . . . . 119 ASN HB2 . 15232 1 984 . 1 1 119 119 ASN HB3 H 1 2.285 0.020 . 1 . . . . 119 ASN HB3 . 15232 1 985 . 1 1 119 119 ASN CA C 13 51.861 0.300 . 1 . . . . 119 ASN CA . 15232 1 986 . 1 1 119 119 ASN CB C 13 39.100 0.300 . 1 . . . . 119 ASN CB . 15232 1 987 . 1 1 119 119 ASN N N 15 116.635 0.200 . 1 . . . . 119 ASN N . 15232 1 988 . 1 1 122 122 GLU H H 1 7.545 0.020 . 1 . . . . 122 GLU H . 15232 1 989 . 1 1 122 122 GLU HA H 1 3.749 0.020 . 1 . . . . 122 GLU HA . 15232 1 990 . 1 1 122 122 GLU HB2 H 1 1.909 0.020 . 1 . . . . 122 GLU HB2 . 15232 1 991 . 1 1 122 122 GLU HB3 H 1 2.208 0.020 . 1 . . . . 122 GLU HB3 . 15232 1 992 . 1 1 122 122 GLU HG3 H 1 2.129 0.020 . 1 . . . . 122 GLU HG3 . 15232 1 993 . 1 1 122 122 GLU CA C 13 61.456 0.300 . 1 . . . . 122 GLU CA . 15232 1 994 . 1 1 122 122 GLU CB C 13 30.047 0.300 . 1 . . . . 122 GLU CB . 15232 1 995 . 1 1 122 122 GLU CG C 13 35.805 0.300 . 1 . . . . 122 GLU CG . 15232 1 996 . 1 1 122 122 GLU N N 15 120.896 0.200 . 1 . . . . 122 GLU N . 15232 1 997 . 1 1 123 123 GLN H H 1 8.926 0.020 . 1 . . . . 123 GLN H . 15232 1 998 . 1 1 123 123 GLN HA H 1 3.980 0.020 . 1 . . . . 123 GLN HA . 15232 1 999 . 1 1 123 123 GLN HB2 H 1 2.127 0.020 . 1 . . . . 123 GLN HB2 . 15232 1 1000 . 1 1 123 123 GLN CA C 13 59.684 0.300 . 1 . . . . 123 GLN CA . 15232 1 1001 . 1 1 123 123 GLN CB C 13 27.436 0.300 . 1 . . . . 123 GLN CB . 15232 1 1002 . 1 1 123 123 GLN CG C 13 34.019 0.300 . 1 . . . . 123 GLN CG . 15232 1 1003 . 1 1 123 123 GLN N N 15 117.946 0.200 . 1 . . . . 123 GLN N . 15232 1 1004 . 1 1 124 124 LEU H H 1 7.964 0.020 . 1 . . . . 124 LEU H . 15232 1 1005 . 1 1 124 124 LEU HA H 1 4.115 0.020 . 1 . . . . 124 LEU HA . 15232 1 1006 . 1 1 124 124 LEU HB2 H 1 1.799 0.020 . 1 . . . . 124 LEU HB2 . 15232 1 1007 . 1 1 124 124 LEU HD11 H 1 0.744 0.020 . 1 . . . . 124 LEU HD1 . 15232 1 1008 . 1 1 124 124 LEU HD12 H 1 0.744 0.020 . 1 . . . . 124 LEU HD1 . 15232 1 1009 . 1 1 124 124 LEU HD13 H 1 0.744 0.020 . 1 . . . . 124 LEU HD1 . 15232 1 1010 . 1 1 124 124 LEU HG H 1 1.500 0.020 . 1 . . . . 124 LEU HG . 15232 1 1011 . 1 1 124 124 LEU CA C 13 58.347 0.300 . 1 . . . . 124 LEU CA . 15232 1 1012 . 1 1 124 124 LEU CB C 13 42.103 0.300 . 1 . . . . 124 LEU CB . 15232 1 1013 . 1 1 124 124 LEU CD1 C 13 24.203 0.300 . 1 . . . . 124 LEU CD1 . 15232 1 1014 . 1 1 124 124 LEU N N 15 122.098 0.200 . 1 . . . . 124 LEU N . 15232 1 1015 . 1 1 125 125 LEU H H 1 8.021 0.020 . 1 . . . . 125 LEU H . 15232 1 1016 . 1 1 125 125 LEU HA H 1 4.040 0.020 . 1 . . . . 125 LEU HA . 15232 1 1017 . 1 1 125 125 LEU HB2 H 1 1.847 0.020 . 1 . . . . 125 LEU HB2 . 15232 1 1018 . 1 1 125 125 LEU HB3 H 1 1.642 0.020 . 1 . . . . 125 LEU HB3 . 15232 1 1019 . 1 1 125 125 LEU HD11 H 1 0.816 0.020 . 1 . . . . 125 LEU HD1 . 15232 1 1020 . 1 1 125 125 LEU HD12 H 1 0.816 0.020 . 1 . . . . 125 LEU HD1 . 15232 1 1021 . 1 1 125 125 LEU HD13 H 1 0.816 0.020 . 1 . . . . 125 LEU HD1 . 15232 1 1022 . 1 1 125 125 LEU HD21 H 1 0.938 0.020 . 1 . . . . 125 LEU HD2 . 15232 1 1023 . 1 1 125 125 LEU HD22 H 1 0.938 0.020 . 1 . . . . 125 LEU HD2 . 15232 1 1024 . 1 1 125 125 LEU HD23 H 1 0.938 0.020 . 1 . . . . 125 LEU HD2 . 15232 1 1025 . 1 1 125 125 LEU CA C 13 59.105 0.300 . 1 . . . . 125 LEU CA . 15232 1 1026 . 1 1 125 125 LEU CB C 13 40.994 0.300 . 1 . . . . 125 LEU CB . 15232 1 1027 . 1 1 125 125 LEU CD1 C 13 24.085 0.300 . 1 . . . . 125 LEU CD1 . 15232 1 1028 . 1 1 125 125 LEU CD2 C 13 25.692 0.300 . 1 . . . . 125 LEU CD2 . 15232 1 1029 . 1 1 125 125 LEU CG C 13 29.801 0.300 . 1 . . . . 125 LEU CG . 15232 1 1030 . 1 1 125 125 LEU N N 15 119.606 0.200 . 1 . . . . 125 LEU N . 15232 1 1031 . 1 1 127 127 LYS H H 1 8.129 0.020 . 1 . . . . 127 LYS H . 15232 1 1032 . 1 1 127 127 LYS HA H 1 4.179 0.020 . 1 . . . . 127 LYS HA . 15232 1 1033 . 1 1 127 127 LYS HB2 H 1 2.052 0.020 . 1 . . . . 127 LYS HB2 . 15232 1 1034 . 1 1 127 127 LYS HD2 H 1 1.698 0.020 . 1 . . . . 127 LYS HD2 . 15232 1 1035 . 1 1 127 127 LYS HG2 H 1 1.453 0.020 . 1 . . . . 127 LYS HG2 . 15232 1 1036 . 1 1 127 127 LYS CA C 13 59.930 0.300 . 1 . . . . 127 LYS CA . 15232 1 1037 . 1 1 127 127 LYS CB C 13 31.820 0.300 . 1 . . . . 127 LYS CB . 15232 1 1038 . 1 1 127 127 LYS CD C 13 29.094 0.300 . 1 . . . . 127 LYS CD . 15232 1 1039 . 1 1 127 127 LYS CE C 13 41.869 0.300 . 1 . . . . 127 LYS CE . 15232 1 1040 . 1 1 127 127 LYS CG C 13 25.181 0.300 . 1 . . . . 127 LYS CG . 15232 1 1041 . 1 1 127 127 LYS N N 15 122.693 0.200 . 1 . . . . 127 LYS N . 15232 1 1042 . 1 1 128 128 SER H H 1 7.811 0.020 . 1 . . . . 128 SER H . 15232 1 1043 . 1 1 128 128 SER HA H 1 4.339 0.020 . 1 . . . . 128 SER HA . 15232 1 1044 . 1 1 128 128 SER HB2 H 1 4.081 0.020 . 1 . . . . 128 SER HB2 . 15232 1 1045 . 1 1 128 128 SER CA C 13 63.499 0.300 . 1 . . . . 128 SER CA . 15232 1 1046 . 1 1 128 128 SER CB C 13 62.268 0.300 . 1 . . . . 128 SER CB . 15232 1 1047 . 1 1 128 128 SER N N 15 118.234 0.200 . 1 . . . . 128 SER N . 15232 1 1048 . 1 1 131 131 GLN H H 1 7.562 0.020 . 1 . . . . 131 GLN H . 15232 1 1049 . 1 1 131 131 GLN HA H 1 3.978 0.020 . 1 . . . . 131 GLN HA . 15232 1 1050 . 1 1 131 131 GLN HB2 H 1 2.209 0.020 . 1 . . . . 131 GLN HB2 . 15232 1 1051 . 1 1 131 131 GLN HB3 H 1 1.952 0.020 . 1 . . . . 131 GLN HB3 . 15232 1 1052 . 1 1 131 131 GLN HG2 H 1 2.410 0.020 . 1 . . . . 131 GLN HG2 . 15232 1 1053 . 1 1 131 131 GLN CA C 13 58.666 0.300 . 1 . . . . 131 GLN CA . 15232 1 1054 . 1 1 131 131 GLN CB C 13 28.122 0.300 . 1 . . . . 131 GLN CB . 15232 1 1055 . 1 1 131 131 GLN CG C 13 33.541 0.300 . 1 . . . . 131 GLN CG . 15232 1 1056 . 1 1 131 131 GLN N N 15 118.837 0.200 . 1 . . . . 131 GLN N . 15232 1 1057 . 1 1 132 132 ALA H H 1 7.996 0.020 . 1 . . . . 132 ALA H . 15232 1 1058 . 1 1 132 132 ALA HA H 1 3.978 0.020 . 1 . . . . 132 ALA HA . 15232 1 1059 . 1 1 132 132 ALA HB1 H 1 1.750 0.020 . 1 . . . . 132 ALA HB . 15232 1 1060 . 1 1 132 132 ALA HB2 H 1 1.750 0.020 . 1 . . . . 132 ALA HB . 15232 1 1061 . 1 1 132 132 ALA HB3 H 1 1.750 0.020 . 1 . . . . 132 ALA HB . 15232 1 1062 . 1 1 132 132 ALA CA C 13 55.704 0.300 . 1 . . . . 132 ALA CA . 15232 1 1063 . 1 1 132 132 ALA CB C 13 18.399 0.300 . 1 . . . . 132 ALA CB . 15232 1 1064 . 1 1 132 132 ALA N N 15 123.260 0.200 . 1 . . . . 132 ALA N . 15232 1 1065 . 1 1 133 133 LYS H H 1 8.161 0.020 . 1 . . . . 133 LYS H . 15232 1 1066 . 1 1 133 133 LYS HA H 1 3.422 0.020 . 1 . . . . 133 LYS HA . 15232 1 1067 . 1 1 133 133 LYS HB2 H 1 1.243 0.020 . 1 . . . . 133 LYS HB2 . 15232 1 1068 . 1 1 133 133 LYS HB3 H 1 0.658 0.020 . 1 . . . . 133 LYS HB3 . 15232 1 1069 . 1 1 133 133 LYS HD3 H 1 1.016 0.020 . 1 . . . . 133 LYS HD3 . 15232 1 1070 . 1 1 133 133 LYS HG2 H 1 0.245 0.020 . 1 . . . . 133 LYS HG2 . 15232 1 1071 . 1 1 133 133 LYS HG3 H 1 0.495 0.020 . 1 . . . . 133 LYS HG3 . 15232 1 1072 . 1 1 133 133 LYS CA C 13 59.456 0.300 . 1 . . . . 133 LYS CA . 15232 1 1073 . 1 1 133 133 LYS CB C 13 32.334 0.300 . 1 . . . . 133 LYS CB . 15232 1 1074 . 1 1 133 133 LYS CD C 13 29.487 0.300 . 1 . . . . 133 LYS CD . 15232 1 1075 . 1 1 133 133 LYS CE C 13 41.229 0.300 . 1 . . . . 133 LYS CE . 15232 1 1076 . 1 1 133 133 LYS CG C 13 24.280 0.300 . 1 . . . . 133 LYS CG . 15232 1 1077 . 1 1 133 133 LYS N N 15 117.616 0.200 . 1 . . . . 133 LYS N . 15232 1 1078 . 1 1 134 134 LYS H H 1 7.871 0.020 . 1 . . . . 134 LYS H . 15232 1 1079 . 1 1 134 134 LYS HA H 1 3.977 0.020 . 1 . . . . 134 LYS HA . 15232 1 1080 . 1 1 134 134 LYS HB2 H 1 1.951 0.020 . 1 . . . . 134 LYS HB2 . 15232 1 1081 . 1 1 134 134 LYS HD3 H 1 1.695 0.020 . 1 . . . . 134 LYS HD3 . 15232 1 1082 . 1 1 134 134 LYS HG2 H 1 1.494 0.020 . 1 . . . . 134 LYS HG2 . 15232 1 1083 . 1 1 134 134 LYS CA C 13 59.220 0.300 . 1 . . . . 134 LYS CA . 15232 1 1084 . 1 1 134 134 LYS CB C 13 32.245 0.300 . 1 . . . . 134 LYS CB . 15232 1 1085 . 1 1 134 134 LYS CD C 13 28.992 0.300 . 1 . . . . 134 LYS CD . 15232 1 1086 . 1 1 134 134 LYS CE C 13 41.941 0.300 . 1 . . . . 134 LYS CE . 15232 1 1087 . 1 1 134 134 LYS CG C 13 24.600 0.300 . 1 . . . . 134 LYS CG . 15232 1 1088 . 1 1 134 134 LYS N N 15 122.686 0.200 . 1 . . . . 134 LYS N . 15232 1 1089 . 1 1 135 135 GLU H H 1 7.685 0.020 . 1 . . . . 135 GLU H . 15232 1 1090 . 1 1 135 135 GLU HA H 1 4.034 0.020 . 1 . . . . 135 GLU HA . 15232 1 1091 . 1 1 135 135 GLU HB2 H 1 2.052 0.020 . 1 . . . . 135 GLU HB2 . 15232 1 1092 . 1 1 135 135 GLU HG2 H 1 2.543 0.020 . 1 . . . . 135 GLU HG2 . 15232 1 1093 . 1 1 135 135 GLU HG3 H 1 2.295 0.020 . 1 . . . . 135 GLU HG3 . 15232 1 1094 . 1 1 135 135 GLU CA C 13 56.594 0.300 . 1 . . . . 135 GLU CA . 15232 1 1095 . 1 1 135 135 GLU CB C 13 30.032 0.300 . 1 . . . . 135 GLU CB . 15232 1 1096 . 1 1 135 135 GLU CG C 13 36.892 0.300 . 1 . . . . 135 GLU CG . 15232 1 1097 . 1 1 135 135 GLU N N 15 116.471 0.200 . 1 . . . . 135 GLU N . 15232 1 1098 . 1 1 136 136 LYS H H 1 7.876 0.020 . 1 . . . . 136 LYS H . 15232 1 1099 . 1 1 136 136 LYS HA H 1 3.574 0.020 . 1 . . . . 136 LYS HA . 15232 1 1100 . 1 1 136 136 LYS HB2 H 1 2.100 0.020 . 1 . . . . 136 LYS HB2 . 15232 1 1101 . 1 1 136 136 LYS HB3 H 1 1.799 0.020 . 1 . . . . 136 LYS HB3 . 15232 1 1102 . 1 1 136 136 LYS HD3 H 1 1.748 0.020 . 1 . . . . 136 LYS HD3 . 15232 1 1103 . 1 1 136 136 LYS HG3 H 1 1.441 0.020 . 1 . . . . 136 LYS HG3 . 15232 1 1104 . 1 1 136 136 LYS CA C 13 56.791 0.300 . 1 . . . . 136 LYS CA . 15232 1 1105 . 1 1 136 136 LYS CB C 13 29.234 0.300 . 1 . . . . 136 LYS CB . 15232 1 1106 . 1 1 136 136 LYS CG C 13 25.075 0.300 . 1 . . . . 136 LYS CG . 15232 1 1107 . 1 1 136 136 LYS N N 15 117.040 0.200 . 1 . . . . 136 LYS N . 15232 1 1108 . 1 1 138 138 ASN H H 1 9.250 0.020 . 1 . . . . 138 ASN H . 15232 1 1109 . 1 1 138 138 ASN HA H 1 4.075 0.020 . 1 . . . . 138 ASN HA . 15232 1 1110 . 1 1 138 138 ASN HB2 H 1 2.910 0.020 . 1 . . . . 138 ASN HB2 . 15232 1 1111 . 1 1 138 138 ASN HB3 H 1 1.901 0.020 . 1 . . . . 138 ASN HB3 . 15232 1 1112 . 1 1 138 138 ASN CA C 13 56.536 0.300 . 1 . . . . 138 ASN CA . 15232 1 1113 . 1 1 138 138 ASN CB C 13 38.989 0.300 . 1 . . . . 138 ASN CB . 15232 1 1114 . 1 1 138 138 ASN N N 15 119.703 0.200 . 1 . . . . 138 ASN N . 15232 1 1115 . 1 1 139 139 ILE H H 1 8.471 0.020 . 1 . . . . 139 ILE H . 15232 1 1116 . 1 1 139 139 ILE HA H 1 3.219 0.020 . 1 . . . . 139 ILE HA . 15232 1 1117 . 1 1 139 139 ILE HB H 1 1.067 0.020 . 1 . . . . 139 ILE HB . 15232 1 1118 . 1 1 139 139 ILE HG21 H 1 0.111 0.020 . 9 . . . . 139 ILE HG2 . 15232 1 1119 . 1 1 139 139 ILE HG22 H 1 0.111 0.020 . 9 . . . . 139 ILE HG2 . 15232 1 1120 . 1 1 139 139 ILE HG23 H 1 0.111 0.020 . 9 . . . . 139 ILE HG2 . 15232 1 1121 . 1 1 139 139 ILE CA C 13 65.453 0.300 . 1 . . . . 139 ILE CA . 15232 1 1122 . 1 1 139 139 ILE CB C 13 36.917 0.300 . 1 . . . . 139 ILE CB . 15232 1 1123 . 1 1 139 139 ILE CD1 C 13 13.740 0.300 . 1 . . . . 139 ILE CD1 . 15232 1 1124 . 1 1 139 139 ILE CG1 C 13 25.060 0.300 . 1 . . . . 139 ILE CG1 . 15232 1 1125 . 1 1 139 139 ILE CG2 C 13 15.543 0.300 . 1 . . . . 139 ILE CG2 . 15232 1 1126 . 1 1 139 139 ILE N N 15 124.460 0.200 . 1 . . . . 139 ILE N . 15232 1 1127 . 1 1 140 140 TRP H H 1 7.900 0.020 . 1 . . . . 140 TRP H . 15232 1 1128 . 1 1 140 140 TRP HA H 1 4.895 0.020 . 1 . . . . 140 TRP HA . 15232 1 1129 . 1 1 140 140 TRP HB2 H 1 2.864 0.020 . 1 . . . . 140 TRP HB2 . 15232 1 1130 . 1 1 140 140 TRP HB3 H 1 3.711 0.020 . 1 . . . . 140 TRP HB3 . 15232 1 1131 . 1 1 140 140 TRP HD1 H 1 7.006 0.020 . 1 . . . . 140 TRP HD1 . 15232 1 1132 . 1 1 140 140 TRP HE3 H 1 7.705 0.020 . 1 . . . . 140 TRP HE3 . 15232 1 1133 . 1 1 140 140 TRP HH2 H 1 7.162 0.020 . 1 . . . . 140 TRP HH2 . 15232 1 1134 . 1 1 140 140 TRP HZ2 H 1 7.543 0.020 . 1 . . . . 140 TRP HZ2 . 15232 1 1135 . 1 1 140 140 TRP HZ3 H 1 7.102 0.020 . 1 . . . . 140 TRP HZ3 . 15232 1 1136 . 1 1 140 140 TRP CA C 13 54.854 0.300 . 1 . . . . 140 TRP CA . 15232 1 1137 . 1 1 140 140 TRP CB C 13 30.101 0.300 . 1 . . . . 140 TRP CB . 15232 1 1138 . 1 1 140 140 TRP N N 15 120.320 0.200 . 1 . . . . 140 TRP N . 15232 1 1139 . 1 1 141 141 SER H H 1 7.982 0.020 . 1 . . . . 141 SER H . 15232 1 1140 . 1 1 141 141 SER HA H 1 4.180 0.020 . 1 . . . . 141 SER HA . 15232 1 1141 . 1 1 141 141 SER CA C 13 59.716 0.300 . 1 . . . . 141 SER CA . 15232 1 1142 . 1 1 141 141 SER CB C 13 64.487 0.300 . 1 . . . . 141 SER CB . 15232 1 1143 . 1 1 141 141 SER N N 15 116.160 0.200 . 1 . . . . 141 SER N . 15232 1 1144 . 1 1 142 142 GLU H H 1 8.205 0.020 . 1 . . . . 142 GLU H . 15232 1 1145 . 1 1 142 142 GLU HA H 1 4.432 0.020 . 1 . . . . 142 GLU HA . 15232 1 1146 . 1 1 142 142 GLU HB3 H 1 1.949 0.020 . 1 . . . . 142 GLU HB3 . 15232 1 1147 . 1 1 142 142 GLU HG2 H 1 2.392 0.020 . 1 . . . . 142 GLU HG2 . 15232 1 1148 . 1 1 142 142 GLU HG3 H 1 2.161 0.020 . 1 . . . . 142 GLU HG3 . 15232 1 1149 . 1 1 142 142 GLU CA C 13 56.279 0.300 . 1 . . . . 142 GLU CA . 15232 1 1150 . 1 1 142 142 GLU CB C 13 30.392 0.300 . 1 . . . . 142 GLU CB . 15232 1 1151 . 1 1 142 142 GLU CG C 13 36.023 0.300 . 1 . . . . 142 GLU CG . 15232 1 1152 . 1 1 142 142 GLU N N 15 121.504 0.200 . 1 . . . . 142 GLU N . 15232 1 1153 . 1 1 144 144 ASN H H 1 8.425 0.020 . 1 . . . . 144 ASN H . 15232 1 1154 . 1 1 144 144 ASN HA H 1 4.768 0.020 . 1 . . . . 144 ASN HA . 15232 1 1155 . 1 1 144 144 ASN HB2 H 1 2.810 0.020 . 1 . . . . 144 ASN HB2 . 15232 1 1156 . 1 1 144 144 ASN CA C 13 53.183 0.300 . 1 . . . . 144 ASN CA . 15232 1 1157 . 1 1 144 144 ASN CB C 13 39.172 0.300 . 1 . . . . 144 ASN CB . 15232 1 1158 . 1 1 144 144 ASN N N 15 119.428 0.200 . 1 . . . . 144 ASN N . 15232 1 1159 . 1 1 146 146 ASP H H 1 8.385 0.020 . 1 . . . . 146 ASP H . 15232 1 1160 . 1 1 146 146 ASP HA H 1 4.689 0.020 . 1 . . . . 146 ASP HA . 15232 1 1161 . 1 1 146 146 ASP HB3 H 1 2.713 0.020 . 1 . . . . 146 ASP HB3 . 15232 1 1162 . 1 1 146 146 ASP CA C 13 54.336 0.300 . 1 . . . . 146 ASP CA . 15232 1 1163 . 1 1 146 146 ASP CB C 13 41.167 0.300 . 1 . . . . 146 ASP CB . 15232 1 1164 . 1 1 146 146 ASP N N 15 119.224 0.200 . 1 . . . . 146 ASP N . 15232 1 stop_ save_