data_25979 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25979 _Entry.Title ; protein complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-02-25 _Entry.Accession_date 2016-03-10 _Entry.Last_release_date 2016-03-10 _Entry.Original_release_date 2016-03-10 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1.1.99 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Xiuxiu Lu . . . . 25979 2 Kylie Walters . . . . 25979 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25979 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'protein binding' . 25979 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 25979 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 545 25979 '15N chemical shifts' 128 25979 '1H chemical shifts' 836 25979 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 3 . . 2018-03-14 2016-02-25 update author 'update assignments, etc.' 25979 2 . . 2017-10-11 2016-02-25 update BMRB 'update entry citation' 25979 1 . . 2017-06-19 2016-02-25 original author 'original release' 25979 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2NBK 'BMRB Entry Tracking System' 25979 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25979 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 28598414 _Citation.Full_citation . _Citation.Title ; Structure of the Rpn13-Rpn2 complex provides insights for Rpn13 and Uch37 as anticancer targets. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 8 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 15540 _Citation.Page_last 15540 _Citation.Year 2017 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Xiuxiu Lu X. . . . 25979 1 2 Urszula Nowicka U. . . . 25979 1 3 Vinidhra Sridharan V. . . . 25979 1 4 Fen Liu F. . . . 25979 1 5 Leah Randles L. . . . 25979 1 6 David Hymel D. . . . 25979 1 7 Marzena Dyba M. . . . 25979 1 8 Sergey Tarasov S. G. . . 25979 1 9 Nadya Tarasova N. I. . . 25979 1 10 'Xue Zhi' Zhao X. Z. . . 25979 1 11 Jun Hamazaki J. . . . 25979 1 12 Shigeo Murata S. . . . 25979 1 13 Terrence Burke T. R. Jr . 25979 1 14 Kylie Walters K. J. . . 25979 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25979 _Assembly.ID 1 _Assembly.Name 'ADRM1-RPN2 complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 entity_1 1 $entity_1 A . yes native no no . . . 25979 1 2 entity_2 2 $entity_2 B . yes native no no . . . 25979 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 25979 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; NKYLVEFRAGKMSLKGTTVT PDKRKGLVYIQQTDDSLIHF CWKDRTSGNVEDDLIIFPDD CEFKRVPQCPSGRVYVLKFK AGSKRLFFWMQEPKTDQDEE HCRKVNEYLNN ; _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 111 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13104.049 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 20 ASN . 25979 1 2 21 LYS . 25979 1 3 22 TYR . 25979 1 4 23 LEU . 25979 1 5 24 VAL . 25979 1 6 25 GLU . 25979 1 7 26 PHE . 25979 1 8 27 ARG . 25979 1 9 28 ALA . 25979 1 10 29 GLY . 25979 1 11 30 LYS . 25979 1 12 31 MET . 25979 1 13 32 SER . 25979 1 14 33 LEU . 25979 1 15 34 LYS . 25979 1 16 35 GLY . 25979 1 17 36 THR . 25979 1 18 37 THR . 25979 1 19 38 VAL . 25979 1 20 39 THR . 25979 1 21 40 PRO . 25979 1 22 41 ASP . 25979 1 23 42 LYS . 25979 1 24 43 ARG . 25979 1 25 44 LYS . 25979 1 26 45 GLY . 25979 1 27 46 LEU . 25979 1 28 47 VAL . 25979 1 29 48 TYR . 25979 1 30 49 ILE . 25979 1 31 50 GLN . 25979 1 32 51 GLN . 25979 1 33 52 THR . 25979 1 34 53 ASP . 25979 1 35 54 ASP . 25979 1 36 55 SER . 25979 1 37 56 LEU . 25979 1 38 57 ILE . 25979 1 39 58 HIS . 25979 1 40 59 PHE . 25979 1 41 60 CYS . 25979 1 42 61 TRP . 25979 1 43 62 LYS . 25979 1 44 63 ASP . 25979 1 45 64 ARG . 25979 1 46 65 THR . 25979 1 47 66 SER . 25979 1 48 67 GLY . 25979 1 49 68 ASN . 25979 1 50 69 VAL . 25979 1 51 70 GLU . 25979 1 52 71 ASP . 25979 1 53 72 ASP . 25979 1 54 73 LEU . 25979 1 55 74 ILE . 25979 1 56 75 ILE . 25979 1 57 76 PHE . 25979 1 58 77 PRO . 25979 1 59 78 ASP . 25979 1 60 79 ASP . 25979 1 61 80 CYS . 25979 1 62 81 GLU . 25979 1 63 82 PHE . 25979 1 64 83 LYS . 25979 1 65 84 ARG . 25979 1 66 85 VAL . 25979 1 67 86 PRO . 25979 1 68 87 GLN . 25979 1 69 88 CYS . 25979 1 70 89 PRO . 25979 1 71 90 SER . 25979 1 72 91 GLY . 25979 1 73 92 ARG . 25979 1 74 93 VAL . 25979 1 75 94 TYR . 25979 1 76 95 VAL . 25979 1 77 96 LEU . 25979 1 78 97 LYS . 25979 1 79 98 PHE . 25979 1 80 99 LYS . 25979 1 81 100 ALA . 25979 1 82 101 GLY . 25979 1 83 102 SER . 25979 1 84 103 LYS . 25979 1 85 104 ARG . 25979 1 86 105 LEU . 25979 1 87 106 PHE . 25979 1 88 107 PHE . 25979 1 89 108 TRP . 25979 1 90 109 MET . 25979 1 91 110 GLN . 25979 1 92 111 GLU . 25979 1 93 112 PRO . 25979 1 94 113 LYS . 25979 1 95 114 THR . 25979 1 96 115 ASP . 25979 1 97 116 GLN . 25979 1 98 117 ASP . 25979 1 99 118 GLU . 25979 1 100 119 GLU . 25979 1 101 120 HIS . 25979 1 102 121 CYS . 25979 1 103 122 ARG . 25979 1 104 123 LYS . 25979 1 105 124 VAL . 25979 1 106 125 ASN . 25979 1 107 126 GLU . 25979 1 108 127 TYR . 25979 1 109 128 LEU . 25979 1 110 129 ASN . 25979 1 111 130 ASN . 25979 1 112 131 PRO . 25979 1 113 132 PRO . 25979 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 . ASN 1 1 25979 1 . LYS 2 2 25979 1 . TYR 3 3 25979 1 . LEU 4 4 25979 1 . VAL 5 5 25979 1 . GLU 6 6 25979 1 . PHE 7 7 25979 1 . ARG 8 8 25979 1 . ALA 9 9 25979 1 . GLY 10 10 25979 1 . LYS 11 11 25979 1 . MET 12 12 25979 1 . SER 13 13 25979 1 . LEU 14 14 25979 1 . LYS 15 15 25979 1 . GLY 16 16 25979 1 . THR 17 17 25979 1 . THR 18 18 25979 1 . VAL 19 19 25979 1 . THR 20 20 25979 1 . PRO 21 21 25979 1 . ASP 22 22 25979 1 . LYS 23 23 25979 1 . ARG 24 24 25979 1 . LYS 25 25 25979 1 . GLY 26 26 25979 1 . LEU 27 27 25979 1 . VAL 28 28 25979 1 . TYR 29 29 25979 1 . ILE 30 30 25979 1 . GLN 31 31 25979 1 . GLN 32 32 25979 1 . THR 33 33 25979 1 . ASP 34 34 25979 1 . ASP 35 35 25979 1 . SER 36 36 25979 1 . LEU 37 37 25979 1 . ILE 38 38 25979 1 . HIS 39 39 25979 1 . PHE 40 40 25979 1 . CYS 41 41 25979 1 . TRP 42 42 25979 1 . LYS 43 43 25979 1 . ASP 44 44 25979 1 . ARG 45 45 25979 1 . THR 46 46 25979 1 . SER 47 47 25979 1 . GLY 48 48 25979 1 . ASN 49 49 25979 1 . VAL 50 50 25979 1 . GLU 51 51 25979 1 . ASP 52 52 25979 1 . ASP 53 53 25979 1 . LEU 54 54 25979 1 . ILE 55 55 25979 1 . ILE 56 56 25979 1 . PHE 57 57 25979 1 . PRO 58 58 25979 1 . ASP 59 59 25979 1 . ASP 60 60 25979 1 . CYS 61 61 25979 1 . GLU 62 62 25979 1 . PHE 63 63 25979 1 . LYS 64 64 25979 1 . ARG 65 65 25979 1 . VAL 66 66 25979 1 . PRO 67 67 25979 1 . GLN 68 68 25979 1 . CYS 69 69 25979 1 . PRO 70 70 25979 1 . SER 71 71 25979 1 . GLY 72 72 25979 1 . ARG 73 73 25979 1 . VAL 74 74 25979 1 . TYR 75 75 25979 1 . VAL 76 76 25979 1 . LEU 77 77 25979 1 . LYS 78 78 25979 1 . PHE 79 79 25979 1 . LYS 80 80 25979 1 . ALA 81 81 25979 1 . GLY 82 82 25979 1 . SER 83 83 25979 1 . LYS 84 84 25979 1 . ARG 85 85 25979 1 . LEU 86 86 25979 1 . PHE 87 87 25979 1 . PHE 88 88 25979 1 . TRP 89 89 25979 1 . MET 90 90 25979 1 . GLN 91 91 25979 1 . GLU 92 92 25979 1 . PRO 93 93 25979 1 . LYS 94 94 25979 1 . THR 95 95 25979 1 . ASP 96 96 25979 1 . GLN 97 97 25979 1 . ASP 98 98 25979 1 . GLU 99 99 25979 1 . GLU 100 100 25979 1 . HIS 101 101 25979 1 . CYS 102 102 25979 1 . ARG 103 103 25979 1 . LYS 104 104 25979 1 . VAL 105 105 25979 1 . ASN 106 106 25979 1 . GLU 107 107 25979 1 . TYR 108 108 25979 1 . LEU 109 109 25979 1 . ASN 110 110 25979 1 . ASN 111 111 25979 1 . PRO 112 112 25979 1 . PRO 113 113 25979 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 25979 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; QEPEPPEPFEYIDD ; _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 14 _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 1704.760 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 940 GLN . 25979 2 2 941 GLU . 25979 2 3 942 PRO . 25979 2 4 943 GLU . 25979 2 5 944 PRO . 25979 2 6 945 PRO . 25979 2 7 946 GLU . 25979 2 8 947 PRO . 25979 2 9 948 PHE . 25979 2 10 949 GLU . 25979 2 11 950 TYR . 25979 2 12 951 ILE . 25979 2 13 952 ASP . 25979 2 14 953 ASP . 25979 2 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 . GLN 1 1 25979 2 . GLU 2 2 25979 2 . PRO 3 3 25979 2 . GLU 4 4 25979 2 . PRO 5 5 25979 2 . PRO 6 6 25979 2 . GLU 7 7 25979 2 . PRO 8 8 25979 2 . PHE 9 9 25979 2 . GLU 10 10 25979 2 . TYR 11 11 25979 2 . ILE 12 12 25979 2 . ASP 13 13 25979 2 . ASP 14 14 25979 2 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 25979 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25979 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25979 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 25979 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . pRSET . . . 25979 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . pRSET . . . 25979 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25979 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . protein 0.7 . . mM . . . . 25979 1 2 entity_2 '[U-13C; U-15N]' . . 2 $entity_2 . protein 0.7 . . mM . . . . 25979 1 3 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25979 1 4 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 25979 1 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25979 1 6 'sodium azide' 'natural abundance' . . . . . . 0.1 . . % . . . . 25979 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25979 1 8 D2O [U-2H] . . . . . . 10 . . % . . . . 25979 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25979 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . protein 0.7 . . mM . . . . 25979 2 2 entity_2 '[U-13C; U-15N]' . . 2 $entity_2 . protein 0.7 . . mM . . . . 25979 2 3 'potassium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25979 2 4 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 25979 2 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25979 2 6 'sodium azide' 'natural abundance' . . . . . . 0.1 . . % . . . . 25979 2 7 D2O [U-2H] . . . . . . 100 . . % . . . . 25979 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25979 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . M 25979 1 pH 6.5 . pH 25979 1 pressure 1 . atm 25979 1 temperature 298.2 . K 25979 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 25979 _Software.ID 1 _Software.Type . _Software.Name XEASY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 25979 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25979 1 'data analysis' 25979 1 'peak picking' 25979 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25979 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25979 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25979 2 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 25979 _Software.ID 3 _Software.Type . _Software.Name X-PLOR_NIH _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 25979 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25979 3 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25979 _Software.ID 4 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25979 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25979 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 25979 _Software.ID 5 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 25979 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25979 5 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 25979 _Software.ID 6 _Software.Type . _Software.Name ProcheckNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 25979 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25979 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_nmrv800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmrv800 _NMR_spectrometer.Entry_ID 25979 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_nmrb600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmrb600 _NMR_spectrometer.Entry_ID 25979 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_nmrb700 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmrb700 _NMR_spectrometer.Entry_ID 25979 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_nmrb850 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmrb850 _NMR_spectrometer.Entry_ID 25979 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 25979 _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 nmrv800 Bruker Avance . 800 . . . 25979 1 2 nmrb600 Bruker Avance . 600 . . . 25979 1 3 nmrb700 Bruker Avance . 700 . . . 25979 1 4 nmrb850 Bruker Avance . 850 . . . 25979 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 25979 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $nmrb850 . . . . . . . . . . . . . . . . 25979 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $nmrv800 . . . . . . . . . . . . . . . . 25979 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $nmrv800 . . . . . . . . . . . . . . . . 25979 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $nmrb600 . . . . . . . . . . . . . . . . 25979 1 5 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $nmrv800 . . . . . . . . . . . . . . . . 25979 1 6 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 4 $nmrb850 . . . . . . . . . . . . . . . . 25979 1 7 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 4 $nmrb850 . . . . . . . . . . . . . . . . 25979 1 8 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $nmrb700 . . . . . . . . . . . . . . . . 25979 1 9 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $nmrb600 . . . . . . . . . . . . . . . . 25979 1 10 '3D half-filtered NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $nmrb700 . . . . . . . . . . . . . . . . 25979 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 25979 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 25979 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 25979 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 25979 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 25979 _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 2 '3D HNCACB' 1 $sample_1 isotropic 25979 1 3 '3D CBCA(CO)NH' 1 $sample_1 isotropic 25979 1 4 '3D HNCO' 1 $sample_1 isotropic 25979 1 5 '3D 1H-15N NOESY' 1 $sample_1 isotropic 25979 1 6 '3D 1H-13C NOESY aliphatic' 2 $sample_2 isotropic 25979 1 9 '3D HN(CA)CO' 1 $sample_1 isotropic 25979 1 10 '3D half-filtered NOESY' 2 $sample_2 isotropic 25979 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XEASY . . 25979 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASN HA H 1 4.509 0.012 . 1 . . . . A 20 ASN HA . 25979 1 2 . 1 1 1 1 ASN HB2 H 1 2.498 0.008 . 2 . . . . A 20 ASN HB2 . 25979 1 3 . 1 1 1 1 ASN HD21 H 1 6.800 0.002 . 2 . . . . A 20 ASN HD21 . 25979 1 4 . 1 1 1 1 ASN HD22 H 1 7.399 0.003 . 2 . . . . A 20 ASN HD22 . 25979 1 5 . 1 1 1 1 ASN C C 13 174.264 0.000 . 1 . . . . A 20 ASN C . 25979 1 6 . 1 1 1 1 ASN CA C 13 52.908 0.000 . 1 . . . . A 20 ASN CA . 25979 1 7 . 1 1 1 1 ASN CB C 13 38.679 0.000 . 1 . . . . A 20 ASN CB . 25979 1 8 . 1 1 1 1 ASN N N 15 120.374 0.000 . 1 . . . . A 20 ASN N . 25979 1 9 . 1 1 1 1 ASN ND2 N 15 112.514 0.000 . 1 . . . . A 20 ASN ND2 . 25979 1 10 . 1 1 2 2 LYS H H 1 7.970 0.000 . 1 . . . . A 21 LYS H . 25979 1 11 . 1 1 2 2 LYS HA H 1 4.042 0.006 . 1 . . . . A 21 LYS HA . 25979 1 12 . 1 1 2 2 LYS HB2 H 1 1.586 0.007 . 2 . . . . A 21 LYS HB2 . 25979 1 13 . 1 1 2 2 LYS HB3 H 1 1.480 0.003 . 2 . . . . A 21 LYS HB3 . 25979 1 14 . 1 1 2 2 LYS HG2 H 1 1.15 0.007 . 2 . . . . A 21 LYS HG2 . 25979 1 15 . 1 1 2 2 LYS HD2 H 1 1.504 0.004 . 2 . . . . A 21 LYS HD2 . 25979 1 16 . 1 1 2 2 LYS HE2 H 1 2.842 0.009 . 2 . . . . A 21 LYS HE2 . 25979 1 17 . 1 1 2 2 LYS C C 13 175.817 0.000 . 1 . . . . A 21 LYS C . 25979 1 18 . 1 1 2 2 LYS CA C 13 55.848 0.000 . 1 . . . . A 21 LYS CA . 25979 1 19 . 1 1 2 2 LYS CB C 13 32.784 0.000 . 1 . . . . A 21 LYS CB . 25979 1 20 . 1 1 2 2 LYS CG C 13 24.191 0.000 . 1 . . . . A 21 LYS CG . 25979 1 21 . 1 1 2 2 LYS CD C 13 28.865 0.000 . 1 . . . . A 21 LYS CD . 25979 1 22 . 1 1 2 2 LYS CE C 13 41.575 0.000 . 1 . . . . A 21 LYS CE . 25979 1 23 . 1 1 2 2 LYS N N 15 120.843 0.000 . 1 . . . . A 21 LYS N . 25979 1 24 . 1 1 3 3 TYR H H 1 8.145 0.000 . 1 . . . . A 22 TYR H . 25979 1 25 . 1 1 3 3 TYR HA H 1 4.917 0.007 . 1 . . . . A 22 TYR HA . 25979 1 26 . 1 1 3 3 TYR HB2 H 1 3.104 0.007 . 2 . . . . A 22 TYR HB2 . 25979 1 27 . 1 1 3 3 TYR HB3 H 1 2.624 0.005 . 2 . . . . A 22 TYR HB3 . 25979 1 28 . 1 1 3 3 TYR HD1 H 1 6.637 0.004 . 3 . . . . A 22 TYR HD1 . 25979 1 29 . 1 1 3 3 TYR HE1 H 1 6.015 0.002 . 3 . . . . A 22 TYR HE1 . 25979 1 30 . 1 1 3 3 TYR C C 13 176.354 0.000 . 1 . . . . A 22 TYR C . 25979 1 31 . 1 1 3 3 TYR CA C 13 54.831 0.000 . 1 . . . . A 22 TYR CA . 25979 1 32 . 1 1 3 3 TYR CB C 13 37.546 0.000 . 1 . . . . A 22 TYR CB . 25979 1 33 . 1 1 3 3 TYR CD1 C 13 131.381 0.000 . 3 . . . . A 22 TYR CD1 . 25979 1 34 . 1 1 3 3 TYR CE1 C 13 117.389 0.000 . 3 . . . . A 22 TYR CE1 . 25979 1 35 . 1 1 3 3 TYR N N 15 122.249 0.000 . 1 . . . . A 22 TYR N . 25979 1 36 . 1 1 4 4 LEU H H 1 8.61 0.000 . 1 . . . . A 23 LEU H . 25979 1 37 . 1 1 4 4 LEU HA H 1 3.927 0.005 . 1 . . . . A 23 LEU HA . 25979 1 38 . 1 1 4 4 LEU HB2 H 1 1.016 0.004 . 2 . . . . A 23 LEU HB2 . 25979 1 39 . 1 1 4 4 LEU HB3 H 1 0.497 0.006 . 2 . . . . A 23 LEU HB3 . 25979 1 40 . 1 1 4 4 LEU HG H 1 1.576 0.000 . 1 . . . . A 23 LEU HG . 25979 1 41 . 1 1 4 4 LEU HD11 H 1 0.509 0.008 . 2 . . . . A 23 LEU HD11 . 25979 1 42 . 1 1 4 4 LEU HD12 H 1 0.509 0.008 . 2 . . . . A 23 LEU HD12 . 25979 1 43 . 1 1 4 4 LEU HD13 H 1 0.509 0.008 . 2 . . . . A 23 LEU HD13 . 25979 1 44 . 1 1 4 4 LEU HD21 H 1 0.588 0.009 . 2 . . . . A 23 LEU HD21 . 25979 1 45 . 1 1 4 4 LEU HD22 H 1 0.588 0.009 . 2 . . . . A 23 LEU HD22 . 25979 1 46 . 1 1 4 4 LEU HD23 H 1 0.588 0.009 . 2 . . . . A 23 LEU HD23 . 25979 1 47 . 1 1 4 4 LEU C C 13 176.957 0.000 . 1 . . . . A 23 LEU C . 25979 1 48 . 1 1 4 4 LEU CA C 13 57.099 0.000 . 1 . . . . A 23 LEU CA . 25979 1 49 . 1 1 4 4 LEU CB C 13 41.378 0.000 . 1 . . . . A 23 LEU CB . 25979 1 50 . 1 1 4 4 LEU CG C 13 26.487 0.000 . 1 . . . . A 23 LEU CG . 25979 1 51 . 1 1 4 4 LEU CD1 C 13 25.608 0.037 . 2 . . . . A 23 LEU CD1 . 25979 1 52 . 1 1 4 4 LEU CD2 C 13 22.034 0.018 . 2 . . . . A 23 LEU CD2 . 25979 1 53 . 1 1 4 4 LEU N N 15 123.177 0.000 . 1 . . . . A 23 LEU N . 25979 1 54 . 1 1 5 5 VAL H H 1 7.073 0.000 . 1 . . . . A 24 VAL H . 25979 1 55 . 1 1 5 5 VAL HA H 1 4.390 0.000 . 1 . . . . A 24 VAL HA . 25979 1 56 . 1 1 5 5 VAL HB H 1 2.148 0.001 . 1 . . . . A 24 VAL HB . 25979 1 57 . 1 1 5 5 VAL HG11 H 1 1.131 0.007 . 2 . . . . A 24 VAL HG11 . 25979 1 58 . 1 1 5 5 VAL HG12 H 1 1.131 0.007 . 2 . . . . A 24 VAL HG12 . 25979 1 59 . 1 1 5 5 VAL HG13 H 1 1.131 0.007 . 2 . . . . A 24 VAL HG13 . 25979 1 60 . 1 1 5 5 VAL HG21 H 1 0.865 0.000 . 2 . . . . A 24 VAL HG21 . 25979 1 61 . 1 1 5 5 VAL HG22 H 1 0.865 0.000 . 2 . . . . A 24 VAL HG22 . 25979 1 62 . 1 1 5 5 VAL HG23 H 1 0.865 0.000 . 2 . . . . A 24 VAL HG23 . 25979 1 63 . 1 1 5 5 VAL C C 13 171.829 0.000 . 1 . . . . A 24 VAL C . 25979 1 64 . 1 1 5 5 VAL CA C 13 60.327 0.000 . 1 . . . . A 24 VAL CA . 25979 1 65 . 1 1 5 5 VAL CB C 13 34.573 0.000 . 1 . . . . A 24 VAL CB . 25979 1 66 . 1 1 5 5 VAL CG1 C 13 22.551 0.000 . 2 . . . . A 24 VAL CG1 . 25979 1 67 . 1 1 5 5 VAL CG2 C 13 20.236 0.000 . 2 . . . . A 24 VAL CG2 . 25979 1 68 . 1 1 5 5 VAL N N 15 112.163 0.000 . 1 . . . . A 24 VAL N . 25979 1 69 . 1 1 6 6 GLU H H 1 8.092 0.000 . 1 . . . . A 25 GLU H . 25979 1 70 . 1 1 6 6 GLU HA H 1 5.272 0.007 . 1 . . . . A 25 GLU HA . 25979 1 71 . 1 1 6 6 GLU HB2 H 1 1.916 0.000 . 2 . . . . A 25 GLU HB2 . 25979 1 72 . 1 1 6 6 GLU HB3 H 1 1.798 0.000 . 2 . . . . A 25 GLU HB3 . 25979 1 73 . 1 1 6 6 GLU HG2 H 1 2.007 0.007 . 2 . . . . A 25 GLU HG2 . 25979 1 74 . 1 1 6 6 GLU HG3 H 1 1.913 0.000 . 2 . . . . A 25 GLU HG3 . 25979 1 75 . 1 1 6 6 GLU C C 13 174.085 0.000 . 1 . . . . A 25 GLU C . 25979 1 76 . 1 1 6 6 GLU CA C 13 54.748 0.000 . 1 . . . . A 25 GLU CA . 25979 1 77 . 1 1 6 6 GLU CB C 13 33.318 0.000 . 1 . . . . A 25 GLU CB . 25979 1 78 . 1 1 6 6 GLU CG C 13 35.507 0.000 . 1 . . . . A 25 GLU CG . 25979 1 79 . 1 1 6 6 GLU N N 15 123.421 0.000 . 1 . . . . A 25 GLU N . 25979 1 80 . 1 1 7 7 PHE H H 1 8.269 0.000 . 1 . . . . A 26 PHE H . 25979 1 81 . 1 1 7 7 PHE HA H 1 4.532 0.000 . 1 . . . . A 26 PHE HA . 25979 1 82 . 1 1 7 7 PHE HB2 H 1 2.495 0.000 . 2 . . . . A 26 PHE HB2 . 25979 1 83 . 1 1 7 7 PHE HB3 H 1 2.315 0.000 . 2 . . . . A 26 PHE HB3 . 25979 1 84 . 1 1 7 7 PHE HD1 H 1 6.524 0.002 . 3 . . . . A 26 PHE HD1 . 25979 1 85 . 1 1 7 7 PHE HE1 H 1 6.600 0.002 . 3 . . . . A 26 PHE HE1 . 25979 1 86 . 1 1 7 7 PHE HZ H 1 6.918 0.000 . 1 . . . . A 26 PHE HZ . 25979 1 87 . 1 1 7 7 PHE C C 13 173.199 0.000 . 1 . . . . A 26 PHE C . 25979 1 88 . 1 1 7 7 PHE CA C 13 56.173 0.000 . 1 . . . . A 26 PHE CA . 25979 1 89 . 1 1 7 7 PHE CB C 13 38.648 0.000 . 1 . . . . A 26 PHE CB . 25979 1 90 . 1 1 7 7 PHE CD1 C 13 127.653 0.000 . 3 . . . . A 26 PHE CD1 . 25979 1 91 . 1 1 7 7 PHE CE1 C 13 128.970 0.000 . 3 . . . . A 26 PHE CE1 . 25979 1 92 . 1 1 7 7 PHE N N 15 115.209 0.000 . 1 . . . . A 26 PHE N . 25979 1 93 . 1 1 8 8 ARG H H 1 9.997 0.000 . 1 . . . . A 27 ARG H . 25979 1 94 . 1 1 8 8 ARG HA H 1 4.515 0.004 . 1 . . . . A 27 ARG HA . 25979 1 95 . 1 1 8 8 ARG HB2 H 1 1.819 0.011 . 2 . . . . A 27 ARG HB2 . 25979 1 96 . 1 1 8 8 ARG HB3 H 1 1.544 0.006 . 2 . . . . A 27 ARG HB3 . 25979 1 97 . 1 1 8 8 ARG HG2 H 1 1.823 0.004 . 2 . . . . A 27 ARG HG2 . 25979 1 98 . 1 1 8 8 ARG HG3 H 1 1.353 0.009 . 2 . . . . A 27 ARG HG3 . 25979 1 99 . 1 1 8 8 ARG HD2 H 1 3.175 0.008 . 2 . . . . A 27 ARG HD2 . 25979 1 100 . 1 1 8 8 ARG HD3 H 1 2.938 0.005 . 2 . . . . A 27 ARG HD3 . 25979 1 101 . 1 1 8 8 ARG C C 13 176.124 0.000 . 1 . . . . A 27 ARG C . 25979 1 102 . 1 1 8 8 ARG CA C 13 56.742 0.000 . 1 . . . . A 27 ARG CA . 25979 1 103 . 1 1 8 8 ARG CB C 13 31.210 0.000 . 1 . . . . A 27 ARG CB . 25979 1 104 . 1 1 8 8 ARG CG C 13 27.635 0.000 . 1 . . . . A 27 ARG CG . 25979 1 105 . 1 1 8 8 ARG CD C 13 43.871 0.000 . 1 . . . . A 27 ARG CD . 25979 1 106 . 1 1 8 8 ARG N N 15 121.068 0.000 . 1 . . . . A 27 ARG N . 25979 1 107 . 1 1 9 9 ALA H H 1 7.994 0.000 . 1 . . . . A 28 ALA H . 25979 1 108 . 1 1 9 9 ALA HA H 1 4.673 0.000 . 1 . . . . A 28 ALA HA . 25979 1 109 . 1 1 9 9 ALA HB1 H 1 1.597 0.000 . 1 . . . . A 28 ALA HB1 . 25979 1 110 . 1 1 9 9 ALA HB2 H 1 1.597 0.000 . 1 . . . . A 28 ALA HB2 . 25979 1 111 . 1 1 9 9 ALA HB3 H 1 1.597 0.000 . 1 . . . . A 28 ALA HB3 . 25979 1 112 . 1 1 9 9 ALA C C 13 176.046 0.000 . 1 . . . . A 28 ALA C . 25979 1 113 . 1 1 9 9 ALA CA C 13 52.719 0.000 . 1 . . . . A 28 ALA CA . 25979 1 114 . 1 1 9 9 ALA CB C 13 22.050 0.000 . 1 . . . . A 28 ALA CB . 25979 1 115 . 1 1 9 9 ALA N N 15 125.989 0.000 . 1 . . . . A 28 ALA N . 25979 1 116 . 1 1 10 10 GLY H H 1 8.704 0.000 . 1 . . . . A 29 GLY H . 25979 1 117 . 1 1 10 10 GLY HA2 H 1 4.521 0.000 . 2 . . . . A 29 GLY HA2 . 25979 1 118 . 1 1 10 10 GLY HA3 H 1 2.822 0.007 . 2 . . . . A 29 GLY HA3 . 25979 1 119 . 1 1 10 10 GLY C C 13 173.573 0.000 . 1 . . . . A 29 GLY C . 25979 1 120 . 1 1 10 10 GLY CA C 13 42.887 0.000 . 1 . . . . A 29 GLY CA . 25979 1 121 . 1 1 10 10 GLY N N 15 108.882 0.000 . 1 . . . . A 29 GLY N . 25979 1 122 . 1 1 11 11 LYS H H 1 9.442 0.000 . 1 . . . . A 30 LYS H . 25979 1 123 . 1 1 11 11 LYS HA H 1 4.835 0.004 . 1 . . . . A 30 LYS HA . 25979 1 124 . 1 1 11 11 LYS HB2 H 1 1.113 0.009 . 2 . . . . A 30 LYS HB2 . 25979 1 125 . 1 1 11 11 LYS HG2 H 1 0.525 0.010 . 2 . . . . A 30 LYS HG2 . 25979 1 126 . 1 1 11 11 LYS HG3 H 1 -0.065 0.015 . 2 . . . . A 30 LYS HG3 . 25979 1 127 . 1 1 11 11 LYS HD2 H 1 0.777 0.034 . 2 . . . . A 30 LYS HD2 . 25979 1 128 . 1 1 11 11 LYS HD3 H 1 0.678 0.010 . 2 . . . . A 30 LYS HD3 . 25979 1 129 . 1 1 11 11 LYS HE2 H 1 1.603 0.000 . 2 . . . . A 30 LYS HE2 . 25979 1 130 . 1 1 11 11 LYS HE3 H 1 2.106 0.000 . 2 . . . . A 30 LYS HE3 . 25979 1 131 . 1 1 11 11 LYS C C 13 176.700 0.000 . 1 . . . . A 30 LYS C . 25979 1 132 . 1 1 11 11 LYS CA C 13 55.848 0.000 . 1 . . . . A 30 LYS CA . 25979 1 133 . 1 1 11 11 LYS CB C 13 34.495 0.000 . 1 . . . . A 30 LYS CB . 25979 1 134 . 1 1 11 11 LYS CG C 13 24.519 0.000 . 1 . . . . A 30 LYS CG . 25979 1 135 . 1 1 11 11 LYS CD C 13 28.966 0.010 . 1 . . . . A 30 LYS CD . 25979 1 136 . 1 1 11 11 LYS CE C 13 39.766 0.061 . 1 . . . . A 30 LYS CE . 25979 1 137 . 1 1 11 11 LYS N N 15 118.724 0.000 . 1 . . . . A 30 LYS N . 25979 1 138 . 1 1 12 12 MET H H 1 7.307 0.000 . 1 . . . . A 31 MET H . 25979 1 139 . 1 1 12 12 MET HA H 1 4.776 0.000 . 1 . . . . A 31 MET HA . 25979 1 140 . 1 1 12 12 MET HB2 H 1 1.814 0.006 . 2 . . . . A 31 MET HB2 . 25979 1 141 . 1 1 12 12 MET HB3 H 1 1.373 0.009 . 2 . . . . A 31 MET HB3 . 25979 1 142 . 1 1 12 12 MET HG2 H 1 2.442 0.006 . 2 . . . . A 31 MET HG2 . 25979 1 143 . 1 1 12 12 MET HG3 H 1 2.375 0.019 . 2 . . . . A 31 MET HG3 . 25979 1 144 . 1 1 12 12 MET HE1 H 1 1.671 0.007 . 1 . . . . A 31 MET HE1 . 25979 1 145 . 1 1 12 12 MET HE2 H 1 1.671 0.007 . 1 . . . . A 31 MET HE2 . 25979 1 146 . 1 1 12 12 MET HE3 H 1 1.671 0.007 . 1 . . . . A 31 MET HE3 . 25979 1 147 . 1 1 12 12 MET C C 13 173.863 0.000 . 1 . . . . A 31 MET C . 25979 1 148 . 1 1 12 12 MET CA C 13 54.127 0.000 . 1 . . . . A 31 MET CA . 25979 1 149 . 1 1 12 12 MET CB C 13 36.089 0.000 . 1 . . . . A 31 MET CB . 25979 1 150 . 1 1 12 12 MET CG C 13 33.539 0.000 . 1 . . . . A 31 MET CG . 25979 1 151 . 1 1 12 12 MET CE C 13 18.283 0.000 . 1 . . . . A 31 MET CE . 25979 1 152 . 1 1 12 12 MET N N 15 114.037 0.000 . 1 . . . . A 31 MET N . 25979 1 153 . 1 1 13 13 SER H H 1 8.760 0.000 . 1 . . . . A 32 SER H . 25979 1 154 . 1 1 13 13 SER HA H 1 4.764 0.000 . 1 . . . . A 32 SER HA . 25979 1 155 . 1 1 13 13 SER HB2 H 1 3.687 0.002 . 2 . . . . A 32 SER HB2 . 25979 1 156 . 1 1 13 13 SER HB3 H 1 3.647 0.002 . 2 . . . . A 32 SER HB3 . 25979 1 157 . 1 1 13 13 SER C C 13 171.650 0.000 . 1 . . . . A 32 SER C . 25979 1 158 . 1 1 13 13 SER CA C 13 56.873 0.000 . 1 . . . . A 32 SER CA . 25979 1 159 . 1 1 13 13 SER CB C 13 64.760 0.000 . 1 . . . . A 32 SER CB . 25979 1 160 . 1 1 13 13 SER N N 15 115.443 0.000 . 1 . . . . A 32 SER N . 25979 1 161 . 1 1 14 14 LEU H H 1 8.574 0.000 . 1 . . . . A 33 LEU H . 25979 1 162 . 1 1 14 14 LEU HA H 1 4.629 0.000 . 1 . . . . A 33 LEU HA . 25979 1 163 . 1 1 14 14 LEU HB2 H 1 1.823 0.000 . 2 . . . . A 33 LEU HB2 . 25979 1 164 . 1 1 14 14 LEU HB3 H 1 1.136 0.000 . 2 . . . . A 33 LEU HB3 . 25979 1 165 . 1 1 14 14 LEU HG H 1 1.228 0.000 . 1 . . . . A 33 LEU HG . 25979 1 166 . 1 1 14 14 LEU HD11 H 1 0.942 0.006 . 2 . . . . A 33 LEU HD11 . 25979 1 167 . 1 1 14 14 LEU HD12 H 1 0.942 0.006 . 2 . . . . A 33 LEU HD12 . 25979 1 168 . 1 1 14 14 LEU HD13 H 1 0.942 0.006 . 2 . . . . A 33 LEU HD13 . 25979 1 169 . 1 1 14 14 LEU HD21 H 1 0.542 0.000 . 2 . . . . A 33 LEU HD21 . 25979 1 170 . 1 1 14 14 LEU HD22 H 1 0.542 0.000 . 2 . . . . A 33 LEU HD22 . 25979 1 171 . 1 1 14 14 LEU HD23 H 1 0.542 0.000 . 2 . . . . A 33 LEU HD23 . 25979 1 172 . 1 1 14 14 LEU C C 13 175.682 0.000 . 1 . . . . A 33 LEU C . 25979 1 173 . 1 1 14 14 LEU CA C 13 53.971 0.000 . 1 . . . . A 33 LEU CA . 25979 1 174 . 1 1 14 14 LEU CB C 13 43.935 0.000 . 1 . . . . A 33 LEU CB . 25979 1 175 . 1 1 14 14 LEU CG C 13 27.650 0.000 . 1 . . . . A 33 LEU CG . 25979 1 176 . 1 1 14 14 LEU CD1 C 13 26.082 0.000 . 2 . . . . A 33 LEU CD1 . 25979 1 177 . 1 1 14 14 LEU CD2 C 13 23.704 0.000 . 2 . . . . A 33 LEU CD2 . 25979 1 178 . 1 1 14 14 LEU N N 15 125.989 0.000 . 1 . . . . A 33 LEU N . 25979 1 179 . 1 1 15 15 LYS H H 1 8.593 0.000 . 1 . . . . A 34 LYS H . 25979 1 180 . 1 1 15 15 LYS HA H 1 4.440 0.000 . 1 . . . . A 34 LYS HA . 25979 1 181 . 1 1 15 15 LYS HB2 H 1 1.775 0.000 . 2 . . . . A 34 LYS HB2 . 25979 1 182 . 1 1 15 15 LYS HB3 H 1 1.628 0.000 . 2 . . . . A 34 LYS HB3 . 25979 1 183 . 1 1 15 15 LYS HG2 H 1 1.343 0.003 . 2 . . . . A 34 LYS HG2 . 25979 1 184 . 1 1 15 15 LYS HG3 H 1 1.259 0.007 . 2 . . . . A 34 LYS HG3 . 25979 1 185 . 1 1 15 15 LYS HD2 H 1 1.652 0.002 . 2 . . . . A 34 LYS HD2 . 25979 1 186 . 1 1 15 15 LYS HE2 H 1 2.926 0.000 . 2 . . . . A 34 LYS HE2 . 25979 1 187 . 1 1 15 15 LYS C C 13 176.114 0.000 . 1 . . . . A 34 LYS C . 25979 1 188 . 1 1 15 15 LYS CA C 13 55.853 0.000 . 1 . . . . A 34 LYS CA . 25979 1 189 . 1 1 15 15 LYS CB C 13 33.635 0.000 . 1 . . . . A 34 LYS CB . 25979 1 190 . 1 1 15 15 LYS CG C 13 24.619 0.000 . 1 . . . . A 34 LYS CG . 25979 1 191 . 1 1 15 15 LYS CD C 13 28.865 0.000 . 1 . . . . A 34 LYS CD . 25979 1 192 . 1 1 15 15 LYS CE C 13 41.821 0.000 . 1 . . . . A 34 LYS CE . 25979 1 193 . 1 1 15 15 LYS N N 15 129.738 0.000 . 1 . . . . A 34 LYS N . 25979 1 194 . 1 1 16 16 GLY H H 1 8.992 0.000 . 1 . . . . A 35 GLY H . 25979 1 195 . 1 1 16 16 GLY HA2 H 1 4.184 0.000 . 2 . . . . A 35 GLY HA2 . 25979 1 196 . 1 1 16 16 GLY HA3 H 1 3.606 0.000 . 2 . . . . A 35 GLY HA3 . 25979 1 197 . 1 1 16 16 GLY C C 13 174.026 0.000 . 1 . . . . A 35 GLY C . 25979 1 198 . 1 1 16 16 GLY CA C 13 46.646 0.000 . 1 . . . . A 35 GLY CA . 25979 1 199 . 1 1 16 16 GLY N N 15 117.552 0.000 . 1 . . . . A 35 GLY N . 25979 1 200 . 1 1 17 17 THR H H 1 8.775 0.000 . 1 . . . . A 36 THR H . 25979 1 201 . 1 1 17 17 THR HA H 1 4.455 0.000 . 1 . . . . A 36 THR HA . 25979 1 202 . 1 1 17 17 THR HB H 1 4.637 0.000 . 1 . . . . A 36 THR HB . 25979 1 203 . 1 1 17 17 THR HG21 H 1 1.153 0.000 . 1 . . . . A 36 THR HG21 . 25979 1 204 . 1 1 17 17 THR HG22 H 1 1.153 0.000 . 1 . . . . A 36 THR HG22 . 25979 1 205 . 1 1 17 17 THR HG23 H 1 1.153 0.000 . 1 . . . . A 36 THR HG23 . 25979 1 206 . 1 1 17 17 THR C C 13 173.018 0.000 . 1 . . . . A 36 THR C . 25979 1 207 . 1 1 17 17 THR CA C 13 61.501 0.000 . 1 . . . . A 36 THR CA . 25979 1 208 . 1 1 17 17 THR CB C 13 69.035 0.000 . 1 . . . . A 36 THR CB . 25979 1 209 . 1 1 17 17 THR CG2 C 13 21.432 0.000 . 1 . . . . A 36 THR CG2 . 25979 1 210 . 1 1 17 17 THR N N 15 118.490 0.000 . 1 . . . . A 36 THR N . 25979 1 211 . 1 1 18 18 THR H H 1 8.047 0.000 . 1 . . . . A 37 THR H . 25979 1 212 . 1 1 18 18 THR HA H 1 4.446 0.005 . 1 . . . . A 37 THR HA . 25979 1 213 . 1 1 18 18 THR HB H 1 3.891 0.004 . 1 . . . . A 37 THR HB . 25979 1 214 . 1 1 18 18 THR HG21 H 1 0.923 0.007 . 1 . . . . A 37 THR HG21 . 25979 1 215 . 1 1 18 18 THR HG22 H 1 0.923 0.007 . 1 . . . . A 37 THR HG22 . 25979 1 216 . 1 1 18 18 THR HG23 H 1 0.923 0.007 . 1 . . . . A 37 THR HG23 . 25979 1 217 . 1 1 18 18 THR C C 13 173.594 0.000 . 1 . . . . A 37 THR C . 25979 1 218 . 1 1 18 18 THR CA C 13 62.697 0.000 . 1 . . . . A 37 THR CA . 25979 1 219 . 1 1 18 18 THR CB C 13 69.926 0.000 . 1 . . . . A 37 THR CB . 25979 1 220 . 1 1 18 18 THR CG2 C 13 21.649 0.000 . 1 . . . . A 37 THR CG2 . 25979 1 221 . 1 1 18 18 THR N N 15 119.896 0.000 . 1 . . . . A 37 THR N . 25979 1 222 . 1 1 19 19 VAL H H 1 8.908 0.000 . 1 . . . . A 38 VAL H . 25979 1 223 . 1 1 19 19 VAL HA H 1 4.228 0.000 . 1 . . . . A 38 VAL HA . 25979 1 224 . 1 1 19 19 VAL HB H 1 0.103 0.006 . 1 . . . . A 38 VAL HB . 25979 1 225 . 1 1 19 19 VAL HG11 H 1 -0.169 0.000 . 2 . . . . A 38 VAL HG11 . 25979 1 226 . 1 1 19 19 VAL HG12 H 1 -0.169 0.000 . 2 . . . . A 38 VAL HG12 . 25979 1 227 . 1 1 19 19 VAL HG13 H 1 -0.169 0.000 . 2 . . . . A 38 VAL HG13 . 25979 1 228 . 1 1 19 19 VAL HG21 H 1 -0.432 0.000 . 2 . . . . A 38 VAL HG21 . 25979 1 229 . 1 1 19 19 VAL HG22 H 1 -0.432 0.000 . 2 . . . . A 38 VAL HG22 . 25979 1 230 . 1 1 19 19 VAL HG23 H 1 -0.432 0.000 . 2 . . . . A 38 VAL HG23 . 25979 1 231 . 1 1 19 19 VAL C C 13 174.948 0.000 . 1 . . . . A 38 VAL C . 25979 1 232 . 1 1 19 19 VAL CA C 13 60.554 0.000 . 1 . . . . A 38 VAL CA . 25979 1 233 . 1 1 19 19 VAL CB C 13 30.182 0.000 . 1 . . . . A 38 VAL CB . 25979 1 234 . 1 1 19 19 VAL CG1 C 13 23.402 0.000 . 2 . . . . A 38 VAL CG1 . 25979 1 235 . 1 1 19 19 VAL CG2 C 13 22.257 0.000 . 2 . . . . A 38 VAL CG2 . 25979 1 236 . 1 1 19 19 VAL N N 15 132.082 0.000 . 1 . . . . A 38 VAL N . 25979 1 237 . 1 1 20 20 THR H H 1 8.483 0.000 . 1 . . . . A 39 THR H . 25979 1 238 . 1 1 20 20 THR HA H 1 4.556 0.000 . 1 . . . . A 39 THR HA . 25979 1 239 . 1 1 20 20 THR HB H 1 3.830 0.000 . 1 . . . . A 39 THR HB . 25979 1 240 . 1 1 20 20 THR HG21 H 1 1.174 0.000 . 1 . . . . A 39 THR HG21 . 25979 1 241 . 1 1 20 20 THR HG22 H 1 1.174 0.000 . 1 . . . . A 39 THR HG22 . 25979 1 242 . 1 1 20 20 THR HG23 H 1 1.174 0.000 . 1 . . . . A 39 THR HG23 . 25979 1 243 . 1 1 20 20 THR C C 13 173.522 0.000 . 1 . . . . A 39 THR C . 25979 1 244 . 1 1 20 20 THR CA C 13 58.641 0.000 . 1 . . . . A 39 THR CA . 25979 1 245 . 1 1 20 20 THR CB C 13 70.638 0.000 . 1 . . . . A 39 THR CB . 25979 1 246 . 1 1 20 20 THR CG2 C 13 20.751 0.000 . 1 . . . . A 39 THR CG2 . 25979 1 247 . 1 1 20 20 THR N N 15 119.761 0.000 . 1 . . . . A 39 THR N . 25979 1 248 . 1 1 21 21 PRO HA H 1 4.311 0.000 . 1 . . . . A 40 PRO HA . 25979 1 249 . 1 1 21 21 PRO HB2 H 1 1.416 0.000 . 2 . . . . A 40 PRO HB2 . 25979 1 250 . 1 1 21 21 PRO HB3 H 1 1.329 0.004 . 2 . . . . A 40 PRO HB3 . 25979 1 251 . 1 1 21 21 PRO HG2 H 1 2.247 0.000 . 2 . . . . A 40 PRO HG2 . 25979 1 252 . 1 1 21 21 PRO HG3 H 1 1.941 0.000 . 2 . . . . A 40 PRO HG3 . 25979 1 253 . 1 1 21 21 PRO HD2 H 1 3.822 0.000 . 2 . . . . A 40 PRO HD2 . 25979 1 254 . 1 1 21 21 PRO HD3 H 1 3.140 0.000 . 2 . . . . A 40 PRO HD3 . 25979 1 255 . 1 1 21 21 PRO C C 13 174.741 0.000 . 1 . . . . A 40 PRO C . 25979 1 256 . 1 1 21 21 PRO CA C 13 63.649 0.000 . 1 . . . . A 40 PRO CA . 25979 1 257 . 1 1 21 21 PRO CB C 13 31.755 0.000 . 1 . . . . A 40 PRO CB . 25979 1 258 . 1 1 21 21 PRO CG C 13 26.323 0.000 . 1 . . . . A 40 PRO CG . 25979 1 259 . 1 1 21 21 PRO CD C 13 50.741 0.000 . 1 . . . . A 40 PRO CD . 25979 1 260 . 1 1 22 22 ASP H H 1 8.727 0.000 . 1 . . . . A 41 ASP H . 25979 1 261 . 1 1 22 22 ASP HA H 1 4.855 0.000 . 1 . . . . A 41 ASP HA . 25979 1 262 . 1 1 22 22 ASP HB2 H 1 3.001 0.000 . 2 . . . . A 41 ASP HB2 . 25979 1 263 . 1 1 22 22 ASP HB3 H 1 2.330 0.000 . 2 . . . . A 41 ASP HB3 . 25979 1 264 . 1 1 22 22 ASP C C 13 177.425 0.000 . 1 . . . . A 41 ASP C . 25979 1 265 . 1 1 22 22 ASP CA C 13 53.110 0.000 . 1 . . . . A 41 ASP CA . 25979 1 266 . 1 1 22 22 ASP CB C 13 42.555 0.000 . 1 . . . . A 41 ASP CB . 25979 1 267 . 1 1 22 22 ASP N N 15 123.890 0.000 . 1 . . . . A 41 ASP N . 25979 1 268 . 1 1 23 23 LYS H H 1 8.888 0.000 . 1 . . . . A 42 LYS H . 25979 1 269 . 1 1 23 23 LYS HA H 1 4.472 0.003 . 1 . . . . A 42 LYS HA . 25979 1 270 . 1 1 23 23 LYS HB2 H 1 2.134 0.003 . 2 . . . . A 42 LYS HB2 . 25979 1 271 . 1 1 23 23 LYS HB3 H 1 1.923 0.009 . 2 . . . . A 42 LYS HB3 . 25979 1 272 . 1 1 23 23 LYS HG2 H 1 1.559 0.000 . 2 . . . . A 42 LYS HG2 . 25979 1 273 . 1 1 23 23 LYS HG3 H 1 1.380 0.003 . 2 . . . . A 42 LYS HG3 . 25979 1 274 . 1 1 23 23 LYS HD2 H 1 1.754 0.000 . 2 . . . . A 42 LYS HD2 . 25979 1 275 . 1 1 23 23 LYS HE2 H 1 3.005 0.000 . 2 . . . . A 42 LYS HE2 . 25979 1 276 . 1 1 23 23 LYS HE3 H 1 2.976 0.001 . 2 . . . . A 42 LYS HE3 . 25979 1 277 . 1 1 23 23 LYS C C 13 176.877 0.000 . 1 . . . . A 42 LYS C . 25979 1 278 . 1 1 23 23 LYS CA C 13 58.567 0.000 . 1 . . . . A 42 LYS CA . 25979 1 279 . 1 1 23 23 LYS CB C 13 32.696 0.000 . 1 . . . . A 42 LYS CB . 25979 1 280 . 1 1 23 23 LYS CG C 13 25.667 0.000 . 1 . . . . A 42 LYS CG . 25979 1 281 . 1 1 23 23 LYS CD C 13 29.275 0.000 . 1 . . . . A 42 LYS CD . 25979 1 282 . 1 1 23 23 LYS CE C 13 41.656 0.000 . 1 . . . . A 42 LYS CE . 25979 1 283 . 1 1 23 23 LYS N N 15 124.583 0.000 . 1 . . . . A 42 LYS N . 25979 1 284 . 1 1 24 24 ARG H H 1 8.375 0.000 . 1 . . . . A 43 ARG H . 25979 1 285 . 1 1 24 24 ARG HA H 1 4.292 0.005 . 1 . . . . A 43 ARG HA . 25979 1 286 . 1 1 24 24 ARG HB2 H 1 2.301 0.005 . 2 . . . . A 43 ARG HB2 . 25979 1 287 . 1 1 24 24 ARG HB3 H 1 1.973 0.012 . 2 . . . . A 43 ARG HB3 . 25979 1 288 . 1 1 24 24 ARG HG2 H 1 2.124 0.002 . 2 . . . . A 43 ARG HG2 . 25979 1 289 . 1 1 24 24 ARG HG3 H 1 2.078 0.002 . 2 . . . . A 43 ARG HG3 . 25979 1 290 . 1 1 24 24 ARG HD2 H 1 3.579 0.005 . 2 . . . . A 43 ARG HD2 . 25979 1 291 . 1 1 24 24 ARG HD3 H 1 3.482 0.009 . 2 . . . . A 43 ARG HD3 . 25979 1 292 . 1 1 24 24 ARG HE H 1 8.100 0.008 . 1 . . . . A 43 ARG HE . 25979 1 293 . 1 1 24 24 ARG C C 13 178.908 0.000 . 1 . . . . A 43 ARG C . 25979 1 294 . 1 1 24 24 ARG CA C 13 57.960 0.000 . 1 . . . . A 43 ARG CA . 25979 1 295 . 1 1 24 24 ARG CB C 13 30.910 0.000 . 1 . . . . A 43 ARG CB . 25979 1 296 . 1 1 24 24 ARG CG C 13 26.897 0.000 . 1 . . . . A 43 ARG CG . 25979 1 297 . 1 1 24 24 ARG CD C 13 43.707 0.000 . 1 . . . . A 43 ARG CD . 25979 1 298 . 1 1 24 24 ARG N N 15 118.256 0.000 . 1 . . . . A 43 ARG N . 25979 1 299 . 1 1 24 24 ARG NE N 15 83.062 0.000 . 1 . . . . A 43 ARG NE . 25979 1 300 . 1 1 25 25 LYS H H 1 8.712 0.000 . 1 . . . . A 44 LYS H . 25979 1 301 . 1 1 25 25 LYS HA H 1 4.315 0.000 . 1 . . . . A 44 LYS HA . 25979 1 302 . 1 1 25 25 LYS HB2 H 1 1.736 0.000 . 2 . . . . A 44 LYS HB2 . 25979 1 303 . 1 1 25 25 LYS HB3 H 1 1.414 0.000 . 2 . . . . A 44 LYS HB3 . 25979 1 304 . 1 1 25 25 LYS HG2 H 1 1.698 0.006 . 2 . . . . A 44 LYS HG2 . 25979 1 305 . 1 1 25 25 LYS HG3 H 1 1.516 0.003 . 2 . . . . A 44 LYS HG3 . 25979 1 306 . 1 1 25 25 LYS HD2 H 1 1.619 0.004 . 2 . . . . A 44 LYS HD2 . 25979 1 307 . 1 1 25 25 LYS HE2 H 1 2.990 0.003 . 2 . . . . A 44 LYS HE2 . 25979 1 308 . 1 1 25 25 LYS C C 13 176.964 0.000 . 1 . . . . A 44 LYS C . 25979 1 309 . 1 1 25 25 LYS CA C 13 56.473 0.000 . 1 . . . . A 44 LYS CA . 25979 1 310 . 1 1 25 25 LYS CB C 13 32.832 0.000 . 1 . . . . A 44 LYS CB . 25979 1 311 . 1 1 25 25 LYS CG C 13 25.257 0.000 . 1 . . . . A 44 LYS CG . 25979 1 312 . 1 1 25 25 LYS CD C 13 29.193 0.000 . 1 . . . . A 44 LYS CD . 25979 1 313 . 1 1 25 25 LYS CE C 13 41.840 0.000 . 1 . . . . A 44 LYS CE . 25979 1 314 . 1 1 25 25 LYS N N 15 122.708 0.000 . 1 . . . . A 44 LYS N . 25979 1 315 . 1 1 26 26 GLY H H 1 9.366 0.000 . 1 . . . . A 45 GLY H . 25979 1 316 . 1 1 26 26 GLY HA2 H 1 4.866 0.000 . 2 . . . . A 45 GLY HA2 . 25979 1 317 . 1 1 26 26 GLY HA3 H 1 4.165 0.000 . 2 . . . . A 45 GLY HA3 . 25979 1 318 . 1 1 26 26 GLY C C 13 174.357 0.000 . 1 . . . . A 45 GLY C . 25979 1 319 . 1 1 26 26 GLY CA C 13 45.482 0.000 . 1 . . . . A 45 GLY CA . 25979 1 320 . 1 1 26 26 GLY N N 15 113.100 0.000 . 1 . . . . A 45 GLY N . 25979 1 321 . 1 1 27 27 LEU H H 1 8.092 0.000 . 1 . . . . A 46 LEU H . 25979 1 322 . 1 1 27 27 LEU HA H 1 4.644 0.000 . 1 . . . . A 46 LEU HA . 25979 1 323 . 1 1 27 27 LEU HB2 H 1 1.431 0.000 . 2 . . . . A 46 LEU HB2 . 25979 1 324 . 1 1 27 27 LEU HB3 H 1 0.779 0.000 . 2 . . . . A 46 LEU HB3 . 25979 1 325 . 1 1 27 27 LEU HG H 1 1.128 0.000 . 1 . . . . A 46 LEU HG . 25979 1 326 . 1 1 27 27 LEU HD11 H 1 0.573 0.008 . 2 . . . . A 46 LEU HD11 . 25979 1 327 . 1 1 27 27 LEU HD12 H 1 0.573 0.008 . 2 . . . . A 46 LEU HD12 . 25979 1 328 . 1 1 27 27 LEU HD13 H 1 0.573 0.008 . 2 . . . . A 46 LEU HD13 . 25979 1 329 . 1 1 27 27 LEU HD21 H 1 0.616 0.010 . 2 . . . . A 46 LEU HD21 . 25979 1 330 . 1 1 27 27 LEU HD22 H 1 0.616 0.010 . 2 . . . . A 46 LEU HD22 . 25979 1 331 . 1 1 27 27 LEU HD23 H 1 0.616 0.010 . 2 . . . . A 46 LEU HD23 . 25979 1 332 . 1 1 27 27 LEU C C 13 174.255 0.000 . 1 . . . . A 46 LEU C . 25979 1 333 . 1 1 27 27 LEU CA C 13 54.362 0.000 . 1 . . . . A 46 LEU CA . 25979 1 334 . 1 1 27 27 LEU CB C 13 47.635 0.000 . 1 . . . . A 46 LEU CB . 25979 1 335 . 1 1 27 27 LEU CG C 13 26.323 0.000 . 1 . . . . A 46 LEU CG . 25979 1 336 . 1 1 27 27 LEU CD1 C 13 25.831 0.000 . 2 . . . . A 46 LEU CD1 . 25979 1 337 . 1 1 27 27 LEU CD2 C 13 24.191 0.000 . 2 . . . . A 46 LEU CD2 . 25979 1 338 . 1 1 27 27 LEU N N 15 125.754 0.000 . 1 . . . . A 46 LEU N . 25979 1 339 . 1 1 28 28 VAL H H 1 8.451 0.000 . 1 . . . . A 47 VAL H . 25979 1 340 . 1 1 28 28 VAL HA H 1 4.378 0.005 . 1 . . . . A 47 VAL HA . 25979 1 341 . 1 1 28 28 VAL HB H 1 0.068 0.000 . 1 . . . . A 47 VAL HB . 25979 1 342 . 1 1 28 28 VAL HG11 H 1 0.323 0.007 . 2 . . . . A 47 VAL HG11 . 25979 1 343 . 1 1 28 28 VAL HG12 H 1 0.323 0.007 . 2 . . . . A 47 VAL HG12 . 25979 1 344 . 1 1 28 28 VAL HG13 H 1 0.323 0.007 . 2 . . . . A 47 VAL HG13 . 25979 1 345 . 1 1 28 28 VAL HG21 H 1 -0.521 0.000 . 2 . . . . A 47 VAL HG21 . 25979 1 346 . 1 1 28 28 VAL HG22 H 1 -0.521 0.000 . 2 . . . . A 47 VAL HG22 . 25979 1 347 . 1 1 28 28 VAL HG23 H 1 -0.521 0.000 . 2 . . . . A 47 VAL HG23 . 25979 1 348 . 1 1 28 28 VAL C C 13 174.516 0.000 . 1 . . . . A 47 VAL C . 25979 1 349 . 1 1 28 28 VAL CA C 13 59.511 0.000 . 1 . . . . A 47 VAL CA . 25979 1 350 . 1 1 28 28 VAL CB C 13 31.914 0.000 . 1 . . . . A 47 VAL CB . 25979 1 351 . 1 1 28 28 VAL CG1 C 13 24.367 0.000 . 2 . . . . A 47 VAL CG1 . 25979 1 352 . 1 1 28 28 VAL CG2 C 13 21.735 0.000 . 2 . . . . A 47 VAL CG2 . 25979 1 353 . 1 1 28 28 VAL N N 15 126.223 0.000 . 1 . . . . A 47 VAL N . 25979 1 354 . 1 1 29 29 TYR H H 1 7.647 0.000 . 1 . . . . A 48 TYR H . 25979 1 355 . 1 1 29 29 TYR HA H 1 4.731 0.007 . 1 . . . . A 48 TYR HA . 25979 1 356 . 1 1 29 29 TYR HB2 H 1 2.351 0.008 . 2 . . . . A 48 TYR HB2 . 25979 1 357 . 1 1 29 29 TYR HB3 H 1 2.190 0.009 . 2 . . . . A 48 TYR HB3 . 25979 1 358 . 1 1 29 29 TYR HD2 H 1 5.820 0.000 . 3 . . . . A 48 TYR HD2 . 25979 1 359 . 1 1 29 29 TYR HE2 H 1 6.108 0.000 . 3 . . . . A 48 TYR HE2 . 25979 1 360 . 1 1 29 29 TYR C C 13 172.039 0.000 . 1 . . . . A 48 TYR C . 25979 1 361 . 1 1 29 29 TYR CA C 13 55.259 0.000 . 1 . . . . A 48 TYR CA . 25979 1 362 . 1 1 29 29 TYR CB C 13 40.283 0.000 . 1 . . . . A 48 TYR CB . 25979 1 363 . 1 1 29 29 TYR CD2 C 13 132.585 0.000 . 3 . . . . A 48 TYR CD2 . 25979 1 364 . 1 1 29 29 TYR CE2 C 13 116.957 0.000 . 3 . . . . A 48 TYR CE2 . 25979 1 365 . 1 1 29 29 TYR N N 15 118.490 0.000 . 1 . . . . A 48 TYR N . 25979 1 366 . 1 1 30 30 ILE H H 1 7.536 0.000 . 1 . . . . A 49 ILE H . 25979 1 367 . 1 1 30 30 ILE HA H 1 5.138 0.000 . 1 . . . . A 49 ILE HA . 25979 1 368 . 1 1 30 30 ILE HB H 1 1.407 0.000 . 1 . . . . A 49 ILE HB . 25979 1 369 . 1 1 30 30 ILE HG12 H 1 1.218 0.006 . 2 . . . . A 49 ILE HG12 . 25979 1 370 . 1 1 30 30 ILE HG13 H 1 0.958 0.005 . 2 . . . . A 49 ILE HG13 . 25979 1 371 . 1 1 30 30 ILE HG21 H 1 0.771 0.000 . 1 . . . . A 49 ILE HG21 . 25979 1 372 . 1 1 30 30 ILE HG22 H 1 0.771 0.000 . 1 . . . . A 49 ILE HG22 . 25979 1 373 . 1 1 30 30 ILE HG23 H 1 0.771 0.000 . 1 . . . . A 49 ILE HG23 . 25979 1 374 . 1 1 30 30 ILE HD11 H 1 0.805 0.007 . 1 . . . . A 49 ILE HD11 . 25979 1 375 . 1 1 30 30 ILE HD12 H 1 0.805 0.007 . 1 . . . . A 49 ILE HD12 . 25979 1 376 . 1 1 30 30 ILE HD13 H 1 0.805 0.007 . 1 . . . . A 49 ILE HD13 . 25979 1 377 . 1 1 30 30 ILE C C 13 174.746 0.000 . 1 . . . . A 49 ILE C . 25979 1 378 . 1 1 30 30 ILE CA C 13 58.116 0.000 . 1 . . . . A 49 ILE CA . 25979 1 379 . 1 1 30 30 ILE CB C 13 39.736 0.000 . 1 . . . . A 49 ILE CB . 25979 1 380 . 1 1 30 30 ILE CG1 C 13 28.127 0.000 . 1 . . . . A 49 ILE CG1 . 25979 1 381 . 1 1 30 30 ILE CG2 C 13 18.050 0.000 . 1 . . . . A 49 ILE CG2 . 25979 1 382 . 1 1 30 30 ILE CD1 C 13 14.915 0.000 . 1 . . . . A 49 ILE CD1 . 25979 1 383 . 1 1 30 30 ILE N N 15 116.146 0.000 . 1 . . . . A 49 ILE N . 25979 1 384 . 1 1 31 31 GLN H H 1 9.021 0.000 . 1 . . . . A 50 GLN H . 25979 1 385 . 1 1 31 31 GLN HA H 1 5.024 0.000 . 1 . . . . A 50 GLN HA . 25979 1 386 . 1 1 31 31 GLN HB2 H 1 2.314 0.000 . 2 . . . . A 50 GLN HB2 . 25979 1 387 . 1 1 31 31 GLN HB3 H 1 1.908 0.000 . 2 . . . . A 50 GLN HB3 . 25979 1 388 . 1 1 31 31 GLN HE21 H 1 6.742 0.003 . 2 . . . . A 50 GLN HE21 . 25979 1 389 . 1 1 31 31 GLN HE22 H 1 7.222 0.001 . 2 . . . . A 50 GLN HE22 . 25979 1 390 . 1 1 31 31 GLN C C 13 173.032 0.000 . 1 . . . . A 50 GLN C . 25979 1 391 . 1 1 31 31 GLN CA C 13 53.267 0.000 . 1 . . . . A 50 GLN CA . 25979 1 392 . 1 1 31 31 GLN CB C 13 33.478 0.000 . 1 . . . . A 50 GLN CB . 25979 1 393 . 1 1 31 31 GLN CG C 13 33.211 0.000 . 1 . . . . A 50 GLN CG . 25979 1 394 . 1 1 31 31 GLN N N 15 127.640 0.000 . 1 . . . . A 50 GLN N . 25979 1 395 . 1 1 31 31 GLN NE2 N 15 110.281 0.000 . 1 . . . . A 50 GLN NE2 . 25979 1 396 . 1 1 32 32 GLN H H 1 9.136 0.000 . 1 . . . . A 51 GLN H . 25979 1 397 . 1 1 32 32 GLN HA H 1 5.732 0.000 . 1 . . . . A 51 GLN HA . 25979 1 398 . 1 1 32 32 GLN HB2 H 1 2.192 0.000 . 2 . . . . A 51 GLN HB2 . 25979 1 399 . 1 1 32 32 GLN HB3 H 1 1.502 0.000 . 2 . . . . A 51 GLN HB3 . 25979 1 400 . 1 1 32 32 GLN HG2 H 1 2.347 0.007 . 2 . . . . A 51 GLN HG2 . 25979 1 401 . 1 1 32 32 GLN HG3 H 1 2.086 0.009 . 2 . . . . A 51 GLN HG3 . 25979 1 402 . 1 1 32 32 GLN HE21 H 1 7.082 0.003 . 2 . . . . A 51 GLN HE21 . 25979 1 403 . 1 1 32 32 GLN HE22 H 1 7.364 0.003 . 2 . . . . A 51 GLN HE22 . 25979 1 404 . 1 1 32 32 GLN C C 13 176.748 0.000 . 1 . . . . A 51 GLN C . 25979 1 405 . 1 1 32 32 GLN CA C 13 53.561 0.000 . 1 . . . . A 51 GLN CA . 25979 1 406 . 1 1 32 32 GLN CB C 13 30.633 0.000 . 1 . . . . A 51 GLN CB . 25979 1 407 . 1 1 32 32 GLN CG C 13 33.375 0.000 . 1 . . . . A 51 GLN CG . 25979 1 408 . 1 1 32 32 GLN N N 15 127.875 0.000 . 1 . . . . A 51 GLN N . 25979 1 409 . 1 1 32 32 GLN NE2 N 15 109.970 0.000 . 1 . . . . A 51 GLN NE2 . 25979 1 410 . 1 1 33 33 THR H H 1 9.051 0.000 . 1 . . . . A 52 THR H . 25979 1 411 . 1 1 33 33 THR HA H 1 4.427 0.000 . 1 . . . . A 52 THR HA . 25979 1 412 . 1 1 33 33 THR HB H 1 4.574 0.000 . 1 . . . . A 52 THR HB . 25979 1 413 . 1 1 33 33 THR HG21 H 1 0.813 0.000 . 1 . . . . A 52 THR HG21 . 25979 1 414 . 1 1 33 33 THR HG22 H 1 0.813 0.000 . 1 . . . . A 52 THR HG22 . 25979 1 415 . 1 1 33 33 THR HG23 H 1 0.813 0.000 . 1 . . . . A 52 THR HG23 . 25979 1 416 . 1 1 33 33 THR C C 13 177.108 0.000 . 1 . . . . A 52 THR C . 25979 1 417 . 1 1 33 33 THR CA C 13 61.557 0.000 . 1 . . . . A 52 THR CA . 25979 1 418 . 1 1 33 33 THR CB C 13 69.457 0.000 . 1 . . . . A 52 THR CB . 25979 1 419 . 1 1 33 33 THR CG2 C 13 23.371 0.000 . 1 . . . . A 52 THR CG2 . 25979 1 420 . 1 1 33 33 THR N N 15 118.483 0.000 . 1 . . . . A 52 THR N . 25979 1 421 . 1 1 34 34 ASP H H 1 8.806 0.000 . 1 . . . . A 53 ASP H . 25979 1 422 . 1 1 34 34 ASP HA H 1 4.325 0.006 . 1 . . . . A 53 ASP HA . 25979 1 423 . 1 1 34 34 ASP HB2 H 1 2.698 0.000 . 2 . . . . A 53 ASP HB2 . 25979 1 424 . 1 1 34 34 ASP C C 13 175.754 0.000 . 1 . . . . A 53 ASP C . 25979 1 425 . 1 1 34 34 ASP CA C 13 57.334 0.000 . 1 . . . . A 53 ASP CA . 25979 1 426 . 1 1 34 34 ASP CB C 13 39.397 0.000 . 1 . . . . A 53 ASP CB . 25979 1 427 . 1 1 34 34 ASP N N 15 120.599 0.000 . 1 . . . . A 53 ASP N . 25979 1 428 . 1 1 35 35 ASP H H 1 7.878 0.000 . 1 . . . . A 54 ASP H . 25979 1 429 . 1 1 35 35 ASP HA H 1 4.486 0.007 . 1 . . . . A 54 ASP HA . 25979 1 430 . 1 1 35 35 ASP HB2 H 1 3.072 0.000 . 2 . . . . A 54 ASP HB2 . 25979 1 431 . 1 1 35 35 ASP HB3 H 1 2.651 0.000 . 2 . . . . A 54 ASP HB3 . 25979 1 432 . 1 1 35 35 ASP C C 13 176.402 0.000 . 1 . . . . A 54 ASP C . 25979 1 433 . 1 1 35 35 ASP CA C 13 53.580 0.000 . 1 . . . . A 54 ASP CA . 25979 1 434 . 1 1 35 35 ASP CB C 13 39.899 0.000 . 1 . . . . A 54 ASP CB . 25979 1 435 . 1 1 35 35 ASP N N 15 118.256 0.000 . 1 . . . . A 54 ASP N . 25979 1 436 . 1 1 36 36 SER H H 1 8.467 0.000 . 1 . . . . A 55 SER H . 25979 1 437 . 1 1 36 36 SER HA H 1 4.004 0.000 . 1 . . . . A 55 SER HA . 25979 1 438 . 1 1 36 36 SER HB2 H 1 4.320 0.006 . 2 . . . . A 55 SER HB2 . 25979 1 439 . 1 1 36 36 SER HB3 H 1 4.040 0.006 . 2 . . . . A 55 SER HB3 . 25979 1 440 . 1 1 36 36 SER C C 13 173.680 0.000 . 1 . . . . A 55 SER C . 25979 1 441 . 1 1 36 36 SER CA C 13 61.545 0.000 . 1 . . . . A 55 SER CA . 25979 1 442 . 1 1 36 36 SER CB C 13 62.875 0.000 . 1 . . . . A 55 SER CB . 25979 1 443 . 1 1 36 36 SER N N 15 112.163 0.000 . 1 . . . . A 55 SER N . 25979 1 444 . 1 1 37 37 LEU H H 1 7.948 0.000 . 1 . . . . A 56 LEU H . 25979 1 445 . 1 1 37 37 LEU HA H 1 4.164 0.008 . 1 . . . . A 56 LEU HA . 25979 1 446 . 1 1 37 37 LEU HB2 H 1 1.815 0.006 . 2 . . . . A 56 LEU HB2 . 25979 1 447 . 1 1 37 37 LEU HB3 H 1 0.984 0.013 . 2 . . . . A 56 LEU HB3 . 25979 1 448 . 1 1 37 37 LEU HG H 1 1.410 0.000 . 1 . . . . A 56 LEU HG . 25979 1 449 . 1 1 37 37 LEU HD11 H 1 0.891 0.009 . 2 . . . . A 56 LEU HD11 . 25979 1 450 . 1 1 37 37 LEU HD12 H 1 0.891 0.009 . 2 . . . . A 56 LEU HD12 . 25979 1 451 . 1 1 37 37 LEU HD13 H 1 0.891 0.009 . 2 . . . . A 56 LEU HD13 . 25979 1 452 . 1 1 37 37 LEU HD21 H 1 0.863 0.002 . 2 . . . . A 56 LEU HD21 . 25979 1 453 . 1 1 37 37 LEU HD22 H 1 0.863 0.002 . 2 . . . . A 56 LEU HD22 . 25979 1 454 . 1 1 37 37 LEU HD23 H 1 0.863 0.002 . 2 . . . . A 56 LEU HD23 . 25979 1 455 . 1 1 37 37 LEU C C 13 174.818 0.000 . 1 . . . . A 56 LEU C . 25979 1 456 . 1 1 37 37 LEU CA C 13 55.378 0.000 . 1 . . . . A 56 LEU CA . 25979 1 457 . 1 1 37 37 LEU CB C 13 40.987 0.000 . 1 . . . . A 56 LEU CB . 25979 1 458 . 1 1 37 37 LEU CG C 13 27.143 0.000 . 1 . . . . A 56 LEU CG . 25979 1 459 . 1 1 37 37 LEU CD1 C 13 25.257 0.000 . 2 . . . . A 56 LEU CD1 . 25979 1 460 . 1 1 37 37 LEU CD2 C 13 22.305 0.000 . 2 . . . . A 56 LEU CD2 . 25979 1 461 . 1 1 37 37 LEU N N 15 123.656 0.000 . 1 . . . . A 56 LEU N . 25979 1 462 . 1 1 38 38 ILE H H 1 8.346 0.000 . 1 . . . . A 57 ILE H . 25979 1 463 . 1 1 38 38 ILE HA H 1 4.541 0.011 . 1 . . . . A 57 ILE HA . 25979 1 464 . 1 1 38 38 ILE HB H 1 2.207 0.007 . 1 . . . . A 57 ILE HB . 25979 1 465 . 1 1 38 38 ILE HG12 H 1 1.722 0.005 . 2 . . . . A 57 ILE HG12 . 25979 1 466 . 1 1 38 38 ILE HG13 H 1 1.581 0.006 . 2 . . . . A 57 ILE HG13 . 25979 1 467 . 1 1 38 38 ILE HG21 H 1 0.694 0.000 . 1 . . . . A 57 ILE HG21 . 25979 1 468 . 1 1 38 38 ILE HG22 H 1 0.694 0.000 . 1 . . . . A 57 ILE HG22 . 25979 1 469 . 1 1 38 38 ILE HG23 H 1 0.694 0.000 . 1 . . . . A 57 ILE HG23 . 25979 1 470 . 1 1 38 38 ILE HD11 H 1 0.654 0.000 . 1 . . . . A 57 ILE HD11 . 25979 1 471 . 1 1 38 38 ILE HD12 H 1 0.654 0.000 . 1 . . . . A 57 ILE HD12 . 25979 1 472 . 1 1 38 38 ILE HD13 H 1 0.654 0.000 . 1 . . . . A 57 ILE HD13 . 25979 1 473 . 1 1 38 38 ILE C C 13 174.329 0.000 . 1 . . . . A 57 ILE C . 25979 1 474 . 1 1 38 38 ILE CA C 13 57.870 0.000 . 1 . . . . A 57 ILE CA . 25979 1 475 . 1 1 38 38 ILE CB C 13 36.189 0.000 . 1 . . . . A 57 ILE CB . 25979 1 476 . 1 1 38 38 ILE CG1 C 13 25.585 0.000 . 1 . . . . A 57 ILE CG1 . 25979 1 477 . 1 1 38 38 ILE CG2 C 13 17.386 0.000 . 1 . . . . A 57 ILE CG2 . 25979 1 478 . 1 1 38 38 ILE CD1 C 13 9.696 0.000 . 1 . . . . A 57 ILE CD1 . 25979 1 479 . 1 1 38 38 ILE N N 15 121.536 0.000 . 1 . . . . A 57 ILE N . 25979 1 480 . 1 1 39 39 HIS H H 1 8.948 0.000 . 1 . . . . A 58 HIS H . 25979 1 481 . 1 1 39 39 HIS HA H 1 5.262 0.000 . 1 . . . . A 58 HIS HA . 25979 1 482 . 1 1 39 39 HIS HB2 H 1 2.874 0.004 . 2 . . . . A 58 HIS HB2 . 25979 1 483 . 1 1 39 39 HIS HB3 H 1 2.905 0.001 . 2 . . . . A 58 HIS HB3 . 25979 1 484 . 1 1 39 39 HIS HD2 H 1 7.186 0.002 . 1 . . . . A 58 HIS HD2 . 25979 1 485 . 1 1 39 39 HIS HE1 H 1 8.345 0.003 . 1 . . . . A 58 HIS HE1 . 25979 1 486 . 1 1 39 39 HIS C C 13 173.565 0.000 . 1 . . . . A 58 HIS C . 25979 1 487 . 1 1 39 39 HIS CA C 13 52.794 0.000 . 1 . . . . A 58 HIS CA . 25979 1 488 . 1 1 39 39 HIS CB C 13 29.904 0.000 . 1 . . . . A 58 HIS CB . 25979 1 489 . 1 1 39 39 HIS CD2 C 13 119.360 0.000 . 1 . . . . A 58 HIS CD2 . 25979 1 490 . 1 1 39 39 HIS CE1 C 13 133.887 0.000 . 1 . . . . A 58 HIS CE1 . 25979 1 491 . 1 1 39 39 HIS N N 15 123.421 0.000 . 1 . . . . A 58 HIS N . 25979 1 492 . 1 1 40 40 PHE H H 1 9.652 0.000 . 1 . . . . A 59 PHE H . 25979 1 493 . 1 1 40 40 PHE HA H 1 4.517 0.000 . 1 . . . . A 59 PHE HA . 25979 1 494 . 1 1 40 40 PHE HB2 H 1 3.194 0.010 . 2 . . . . A 59 PHE HB2 . 25979 1 495 . 1 1 40 40 PHE HB3 H 1 2.395 0.006 . 2 . . . . A 59 PHE HB3 . 25979 1 496 . 1 1 40 40 PHE HD1 H 1 6.757 0.004 . 3 . . . . A 59 PHE HD1 . 25979 1 497 . 1 1 40 40 PHE HE1 H 1 6.559 0.080 . 3 . . . . A 59 PHE HE1 . 25979 1 498 . 1 1 40 40 PHE HZ H 1 6.182 0.006 . 1 . . . . A 59 PHE HZ . 25979 1 499 . 1 1 40 40 PHE C C 13 174.473 0.000 . 1 . . . . A 59 PHE C . 25979 1 500 . 1 1 40 40 PHE CA C 13 57.412 0.000 . 1 . . . . A 59 PHE CA . 25979 1 501 . 1 1 40 40 PHE CB C 13 41.847 0.000 . 1 . . . . A 59 PHE CB . 25979 1 502 . 1 1 40 40 PHE CD1 C 13 130.948 0.000 . 3 . . . . A 59 PHE CD1 . 25979 1 503 . 1 1 40 40 PHE CE1 C 13 130.126 0.000 . 3 . . . . A 59 PHE CE1 . 25979 1 504 . 1 1 40 40 PHE CZ C 13 129.472 0.000 . 1 . . . . A 59 PHE CZ . 25979 1 505 . 1 1 40 40 PHE N N 15 127.160 0.000 . 1 . . . . A 59 PHE N . 25979 1 506 . 1 1 41 41 CYS H H 1 8.141 0.000 . 1 . . . . A 60 CYS H . 25979 1 507 . 1 1 41 41 CYS HA H 1 5.201 0.000 . 1 . . . . A 60 CYS HA . 25979 1 508 . 1 1 41 41 CYS HB2 H 1 2.070 0.000 . 2 . . . . A 60 CYS HB2 . 25979 1 509 . 1 1 41 41 CYS HB3 H 1 0.412 0.000 . 2 . . . . A 60 CYS HB3 . 25979 1 510 . 1 1 41 41 CYS C C 13 172.212 0.000 . 1 . . . . A 60 CYS C . 25979 1 511 . 1 1 41 41 CYS CA C 13 55.413 0.000 . 1 . . . . A 60 CYS CA . 25979 1 512 . 1 1 41 41 CYS CB C 13 31.523 0.000 . 1 . . . . A 60 CYS CB . 25979 1 513 . 1 1 41 41 CYS N N 15 125.051 0.000 . 1 . . . . A 60 CYS N . 25979 1 514 . 1 1 42 42 TRP H H 1 8.267 0.000 . 1 . . . . A 61 TRP H . 25979 1 515 . 1 1 42 42 TRP HA H 1 5.213 0.000 . 1 . . . . A 61 TRP HA . 25979 1 516 . 1 1 42 42 TRP HB2 H 1 3.912 0.006 . 2 . . . . A 61 TRP HB2 . 25979 1 517 . 1 1 42 42 TRP HB3 H 1 2.754 0.008 . 2 . . . . A 61 TRP HB3 . 25979 1 518 . 1 1 42 42 TRP HD1 H 1 6.975 0.001 . 1 . . . . A 61 TRP HD1 . 25979 1 519 . 1 1 42 42 TRP HE1 H 1 10.164 0.000 . 1 . . . . A 61 TRP HE1 . 25979 1 520 . 1 1 42 42 TRP HE3 H 1 7.558 0.002 . 1 . . . . A 61 TRP HE3 . 25979 1 521 . 1 1 42 42 TRP HZ2 H 1 7.238 0.007 . 1 . . . . A 61 TRP HZ2 . 25979 1 522 . 1 1 42 42 TRP HZ3 H 1 6.870 0.002 . 1 . . . . A 61 TRP HZ3 . 25979 1 523 . 1 1 42 42 TRP HH2 H 1 6.784 0.002 . 1 . . . . A 61 TRP HH2 . 25979 1 524 . 1 1 42 42 TRP C C 13 174.833 0.000 . 1 . . . . A 61 TRP C . 25979 1 525 . 1 1 42 42 TRP CA C 13 57.537 0.000 . 1 . . . . A 61 TRP CA . 25979 1 526 . 1 1 42 42 TRP CB C 13 32.116 0.000 . 1 . . . . A 61 TRP CB . 25979 1 527 . 1 1 42 42 TRP CD1 C 13 126.903 0.000 . 1 . . . . A 61 TRP CD1 . 25979 1 528 . 1 1 42 42 TRP CE3 C 13 120.582 0.000 . 1 . . . . A 61 TRP CE3 . 25979 1 529 . 1 1 42 42 TRP CZ2 C 13 114.733 0.000 . 1 . . . . A 61 TRP CZ2 . 25979 1 530 . 1 1 42 42 TRP CZ3 C 13 121.102 0.000 . 1 . . . . A 61 TRP CZ3 . 25979 1 531 . 1 1 42 42 TRP CH2 C 13 122.381 0.000 . 1 . . . . A 61 TRP CH2 . 25979 1 532 . 1 1 42 42 TRP N N 15 118.302 0.000 . 1 . . . . A 61 TRP N . 25979 1 533 . 1 1 42 42 TRP NE1 N 15 127.136 0.000 . 1 . . . . A 61 TRP NE1 . 25979 1 534 . 1 1 43 43 LYS H H 1 8.386 0.000 . 1 . . . . A 62 LYS H . 25979 1 535 . 1 1 43 43 LYS HA H 1 4.810 0.000 . 1 . . . . A 62 LYS HA . 25979 1 536 . 1 1 43 43 LYS HB2 H 1 1.414 0.000 . 2 . . . . A 62 LYS HB2 . 25979 1 537 . 1 1 43 43 LYS HG2 H 1 0.833 0.002 . 2 . . . . A 62 LYS HG2 . 25979 1 538 . 1 1 43 43 LYS HG3 H 1 0.782 0.003 . 2 . . . . A 62 LYS HG3 . 25979 1 539 . 1 1 43 43 LYS HD2 H 1 1.354 0.002 . 2 . . . . A 62 LYS HD2 . 25979 1 540 . 1 1 43 43 LYS HE2 H 1 2.576 0.003 . 2 . . . . A 62 LYS HE2 . 25979 1 541 . 1 1 43 43 LYS HE3 H 1 2.545 0.004 . 2 . . . . A 62 LYS HE3 . 25979 1 542 . 1 1 43 43 LYS C C 13 171.808 0.000 . 1 . . . . A 62 LYS C . 25979 1 543 . 1 1 43 43 LYS CA C 13 52.455 0.000 . 1 . . . . A 62 LYS CA . 25979 1 544 . 1 1 43 43 LYS CB C 13 37.816 0.000 . 1 . . . . A 62 LYS CB . 25979 1 545 . 1 1 43 43 LYS CG C 13 23.945 0.000 . 1 . . . . A 62 LYS CG . 25979 1 546 . 1 1 43 43 LYS CD C 13 29.275 0.000 . 1 . . . . A 62 LYS CD . 25979 1 547 . 1 1 43 43 LYS CE C 13 41.496 0.000 . 1 . . . . A 62 LYS CE . 25979 1 548 . 1 1 43 43 LYS N N 15 126.926 0.000 . 1 . . . . A 62 LYS N . 25979 1 549 . 1 1 44 44 ASP H H 1 7.735 0.000 . 1 . . . . A 63 ASP H . 25979 1 550 . 1 1 44 44 ASP HA H 1 4.000 0.004 . 1 . . . . A 63 ASP HA . 25979 1 551 . 1 1 44 44 ASP HB2 H 1 3.077 0.000 . 2 . . . . A 63 ASP HB2 . 25979 1 552 . 1 1 44 44 ASP HB3 H 1 2.533 0.000 . 2 . . . . A 63 ASP HB3 . 25979 1 553 . 1 1 44 44 ASP C C 13 177.597 0.000 . 1 . . . . A 63 ASP C . 25979 1 554 . 1 1 44 44 ASP CA C 13 52.956 0.000 . 1 . . . . A 63 ASP CA . 25979 1 555 . 1 1 44 44 ASP CB C 13 42.238 0.000 . 1 . . . . A 63 ASP CB . 25979 1 556 . 1 1 44 44 ASP N N 15 123.411 0.000 . 1 . . . . A 63 ASP N . 25979 1 557 . 1 1 45 45 ARG H H 1 8.637 0.000 . 1 . . . . A 64 ARG H . 25979 1 558 . 1 1 45 45 ARG HA H 1 3.787 0.005 . 1 . . . . A 64 ARG HA . 25979 1 559 . 1 1 45 45 ARG HB2 H 1 1.688 0.008 . 2 . . . . A 64 ARG HB2 . 25979 1 560 . 1 1 45 45 ARG HB3 H 1 1.401 0.009 . 2 . . . . A 64 ARG HB3 . 25979 1 561 . 1 1 45 45 ARG HG2 H 1 1.496 0.000 . 2 . . . . A 64 ARG HG2 . 25979 1 562 . 1 1 45 45 ARG HG3 H 1 1.045 0.000 . 2 . . . . A 64 ARG HG3 . 25979 1 563 . 1 1 45 45 ARG HD2 H 1 3.141 0.069 . 2 . . . . A 64 ARG HD2 . 25979 1 564 . 1 1 45 45 ARG HD3 H 1 3.023 0.095 . 2 . . . . A 64 ARG HD3 . 25979 1 565 . 1 1 45 45 ARG C C 13 177.525 0.000 . 1 . . . . A 64 ARG C . 25979 1 566 . 1 1 45 45 ARG CA C 13 59.055 0.000 . 1 . . . . A 64 ARG CA . 25979 1 567 . 1 1 45 45 ARG CB C 13 31.445 0.000 . 1 . . . . A 64 ARG CB . 25979 1 568 . 1 1 45 45 ARG CG C 13 30.177 0.000 . 1 . . . . A 64 ARG CG . 25979 1 569 . 1 1 45 45 ARG CD C 13 43.943 0.000 . 1 . . . . A 64 ARG CD . 25979 1 570 . 1 1 45 45 ARG N N 15 125.520 0.000 . 1 . . . . A 64 ARG N . 25979 1 571 . 1 1 46 46 THR H H 1 8.963 0.000 . 1 . . . . A 65 THR H . 25979 1 572 . 1 1 46 46 THR HA H 1 4.111 0.000 . 1 . . . . A 65 THR HA . 25979 1 573 . 1 1 46 46 THR HB H 1 4.361 0.000 . 1 . . . . A 65 THR HB . 25979 1 574 . 1 1 46 46 THR HG21 H 1 1.259 0.000 . 1 . . . . A 65 THR HG21 . 25979 1 575 . 1 1 46 46 THR HG22 H 1 1.259 0.000 . 1 . . . . A 65 THR HG22 . 25979 1 576 . 1 1 46 46 THR HG23 H 1 1.259 0.000 . 1 . . . . A 65 THR HG23 . 25979 1 577 . 1 1 46 46 THR C C 13 175.394 0.000 . 1 . . . . A 65 THR C . 25979 1 578 . 1 1 46 46 THR CA C 13 65.390 0.000 . 1 . . . . A 65 THR CA . 25979 1 579 . 1 1 46 46 THR CB C 13 67.971 0.000 . 1 . . . . A 65 THR CB . 25979 1 580 . 1 1 46 46 THR CG2 C 13 21.321 0.000 . 1 . . . . A 65 THR CG2 . 25979 1 581 . 1 1 46 46 THR N N 15 116.615 0.000 . 1 . . . . A 65 THR N . 25979 1 582 . 1 1 47 47 SER H H 1 7.955 0.000 . 1 . . . . A 66 SER H . 25979 1 583 . 1 1 47 47 SER HA H 1 4.401 0.000 . 1 . . . . A 66 SER HA . 25979 1 584 . 1 1 47 47 SER HB2 H 1 3.813 0.003 . 2 . . . . A 66 SER HB2 . 25979 1 585 . 1 1 47 47 SER HB3 H 1 3.970 0.004 . 2 . . . . A 66 SER HB3 . 25979 1 586 . 1 1 47 47 SER C C 13 175.783 0.000 . 1 . . . . A 66 SER C . 25979 1 587 . 1 1 47 47 SER CA C 13 58.507 0.000 . 1 . . . . A 66 SER CA . 25979 1 588 . 1 1 47 47 SER CB C 13 64.921 0.000 . 1 . . . . A 66 SER CB . 25979 1 589 . 1 1 47 47 SER N N 15 115.209 0.000 . 1 . . . . A 66 SER N . 25979 1 590 . 1 1 48 48 GLY H H 1 8.070 0.000 . 1 . . . . A 67 GLY H . 25979 1 591 . 1 1 48 48 GLY HA2 H 1 4.156 0.004 . 2 . . . . A 67 GLY HA2 . 25979 1 592 . 1 1 48 48 GLY HA3 H 1 3.525 0.010 . 2 . . . . A 67 GLY HA3 . 25979 1 593 . 1 1 48 48 GLY C C 13 173.536 0.000 . 1 . . . . A 67 GLY C . 25979 1 594 . 1 1 48 48 GLY CA C 13 45.525 0.000 . 1 . . . . A 67 GLY CA . 25979 1 595 . 1 1 48 48 GLY N N 15 111.766 0.000 . 1 . . . . A 67 GLY N . 25979 1 596 . 1 1 49 49 ASN H H 1 7.913 0.000 . 1 . . . . A 68 ASN H . 25979 1 597 . 1 1 49 49 ASN HA H 1 4.570 0.000 . 1 . . . . A 68 ASN HA . 25979 1 598 . 1 1 49 49 ASN HB2 H 1 2.698 0.000 . 2 . . . . A 68 ASN HB2 . 25979 1 599 . 1 1 49 49 ASN HD21 H 1 7.010 0.004 . 2 . . . . A 68 ASN HD21 . 25979 1 600 . 1 1 49 49 ASN HD22 H 1 7.608 0.011 . 2 . . . . A 68 ASN HD22 . 25979 1 601 . 1 1 49 49 ASN C C 13 174.905 0.000 . 1 . . . . A 68 ASN C . 25979 1 602 . 1 1 49 49 ASN CA C 13 53.814 0.000 . 1 . . . . A 68 ASN CA . 25979 1 603 . 1 1 49 49 ASN CB C 13 38.941 0.000 . 1 . . . . A 68 ASN CB . 25979 1 604 . 1 1 49 49 ASN N N 15 118.234 0.000 . 1 . . . . A 68 ASN N . 25979 1 605 . 1 1 49 49 ASN ND2 N 15 112.108 0.000 . 1 . . . . A 68 ASN ND2 . 25979 1 606 . 1 1 50 50 VAL H H 1 8.786 0.000 . 1 . . . . A 69 VAL H . 25979 1 607 . 1 1 50 50 VAL HA H 1 4.016 0.000 . 1 . . . . A 69 VAL HA . 25979 1 608 . 1 1 50 50 VAL HB H 1 2.091 0.000 . 1 . . . . A 69 VAL HB . 25979 1 609 . 1 1 50 50 VAL HG11 H 1 1.033 0.000 . 2 . . . . A 69 VAL HG11 . 25979 1 610 . 1 1 50 50 VAL HG12 H 1 1.033 0.000 . 2 . . . . A 69 VAL HG12 . 25979 1 611 . 1 1 50 50 VAL HG13 H 1 1.033 0.000 . 2 . . . . A 69 VAL HG13 . 25979 1 612 . 1 1 50 50 VAL HG21 H 1 0.888 0.000 . 2 . . . . A 69 VAL HG21 . 25979 1 613 . 1 1 50 50 VAL HG22 H 1 0.888 0.000 . 2 . . . . A 69 VAL HG22 . 25979 1 614 . 1 1 50 50 VAL HG23 H 1 0.888 0.000 . 2 . . . . A 69 VAL HG23 . 25979 1 615 . 1 1 50 50 VAL C C 13 175.481 0.000 . 1 . . . . A 69 VAL C . 25979 1 616 . 1 1 50 50 VAL CA C 13 63.356 0.000 . 1 . . . . A 69 VAL CA . 25979 1 617 . 1 1 50 50 VAL CB C 13 30.792 0.000 . 1 . . . . A 69 VAL CB . 25979 1 618 . 1 1 50 50 VAL CG1 C 13 21.649 0.000 . 2 . . . . A 69 VAL CG1 . 25979 1 619 . 1 1 50 50 VAL CG2 C 13 21.239 0.000 . 2 . . . . A 69 VAL CG2 . 25979 1 620 . 1 1 50 50 VAL N N 15 126.692 0.000 . 1 . . . . A 69 VAL N . 25979 1 621 . 1 1 51 51 GLU H H 1 8.202 0.000 . 1 . . . . A 70 GLU H . 25979 1 622 . 1 1 51 51 GLU HA H 1 4.457 0.000 . 1 . . . . A 70 GLU HA . 25979 1 623 . 1 1 51 51 GLU HB2 H 1 2.452 0.000 . 2 . . . . A 70 GLU HB2 . 25979 1 624 . 1 1 51 51 GLU HB3 H 1 2.318 0.000 . 2 . . . . A 70 GLU HB3 . 25979 1 625 . 1 1 51 51 GLU HG2 H 1 2.498 0.000 . 2 . . . . A 70 GLU HG2 . 25979 1 626 . 1 1 51 51 GLU HG3 H 1 2.335 0.000 . 2 . . . . A 70 GLU HG3 . 25979 1 627 . 1 1 51 51 GLU C C 13 175.178 0.000 . 1 . . . . A 70 GLU C . 25979 1 628 . 1 1 51 51 GLU CA C 13 57.952 0.000 . 1 . . . . A 70 GLU CA . 25979 1 629 . 1 1 51 51 GLU CB C 13 32.696 0.000 . 1 . . . . A 70 GLU CB . 25979 1 630 . 1 1 51 51 GLU CG C 13 37.786 0.000 . 1 . . . . A 70 GLU CG . 25979 1 631 . 1 1 51 51 GLU N N 15 129.504 0.000 . 1 . . . . A 70 GLU N . 25979 1 632 . 1 1 52 52 ASP H H 1 8.030 0.000 . 1 . . . . A 71 ASP H . 25979 1 633 . 1 1 52 52 ASP HA H 1 5.112 0.000 . 1 . . . . A 71 ASP HA . 25979 1 634 . 1 1 52 52 ASP HB2 H 1 2.739 0.000 . 2 . . . . A 71 ASP HB2 . 25979 1 635 . 1 1 52 52 ASP HB3 H 1 2.492 0.000 . 2 . . . . A 71 ASP HB3 . 25979 1 636 . 1 1 52 52 ASP C C 13 173.608 0.000 . 1 . . . . A 71 ASP C . 25979 1 637 . 1 1 52 52 ASP CA C 13 53.312 0.000 . 1 . . . . A 71 ASP CA . 25979 1 638 . 1 1 52 52 ASP CB C 13 43.887 0.000 . 1 . . . . A 71 ASP CB . 25979 1 639 . 1 1 52 52 ASP N N 15 116.849 0.000 . 1 . . . . A 71 ASP N . 25979 1 640 . 1 1 53 53 ASP H H 1 8.442 0.000 . 1 . . . . A 72 ASP H . 25979 1 641 . 1 1 53 53 ASP HA H 1 4.985 0.000 . 1 . . . . A 72 ASP HA . 25979 1 642 . 1 1 53 53 ASP HB2 H 1 2.732 0.000 . 2 . . . . A 72 ASP HB2 . 25979 1 643 . 1 1 53 53 ASP HB3 H 1 2.425 0.000 . 2 . . . . A 72 ASP HB3 . 25979 1 644 . 1 1 53 53 ASP C C 13 174.789 0.000 . 1 . . . . A 72 ASP C . 25979 1 645 . 1 1 53 53 ASP CA C 13 54.015 0.000 . 1 . . . . A 72 ASP CA . 25979 1 646 . 1 1 53 53 ASP CB C 13 41.030 0.000 . 1 . . . . A 72 ASP CB . 25979 1 647 . 1 1 53 53 ASP N N 15 121.302 0.000 . 1 . . . . A 72 ASP N . 25979 1 648 . 1 1 54 54 LEU H H 1 9.150 0.000 . 1 . . . . A 73 LEU H . 25979 1 649 . 1 1 54 54 LEU HA H 1 4.730 0.005 . 1 . . . . A 73 LEU HA . 25979 1 650 . 1 1 54 54 LEU HB2 H 1 2.003 0.005 . 2 . . . . A 73 LEU HB2 . 25979 1 651 . 1 1 54 54 LEU HB3 H 1 1.548 0.003 . 2 . . . . A 73 LEU HB3 . 25979 1 652 . 1 1 54 54 LEU HG H 1 1.838 0.000 . 1 . . . . A 73 LEU HG . 25979 1 653 . 1 1 54 54 LEU HD11 H 1 0.976 0.003 . 2 . . . . A 73 LEU HD11 . 25979 1 654 . 1 1 54 54 LEU HD12 H 1 0.976 0.003 . 2 . . . . A 73 LEU HD12 . 25979 1 655 . 1 1 54 54 LEU HD13 H 1 0.976 0.003 . 2 . . . . A 73 LEU HD13 . 25979 1 656 . 1 1 54 54 LEU HD21 H 1 1.007 0.008 . 2 . . . . A 73 LEU HD21 . 25979 1 657 . 1 1 54 54 LEU HD22 H 1 1.007 0.008 . 2 . . . . A 73 LEU HD22 . 25979 1 658 . 1 1 54 54 LEU HD23 H 1 1.007 0.008 . 2 . . . . A 73 LEU HD23 . 25979 1 659 . 1 1 54 54 LEU C C 13 175.653 0.000 . 1 . . . . A 73 LEU C . 25979 1 660 . 1 1 54 54 LEU CA C 13 53.736 0.000 . 1 . . . . A 73 LEU CA . 25979 1 661 . 1 1 54 54 LEU CB C 13 44.272 0.000 . 1 . . . . A 73 LEU CB . 25979 1 662 . 1 1 54 54 LEU CG C 13 27.713 0.000 . 1 . . . . A 73 LEU CG . 25979 1 663 . 1 1 54 54 LEU CD1 C 13 24.601 0.000 . 2 . . . . A 73 LEU CD1 . 25979 1 664 . 1 1 54 54 LEU CD2 C 13 26.241 0.000 . 2 . . . . A 73 LEU CD2 . 25979 1 665 . 1 1 54 54 LEU N N 15 126.565 0.000 . 1 . . . . A 73 LEU N . 25979 1 666 . 1 1 55 55 ILE H H 1 8.267 0.000 . 1 . . . . A 74 ILE H . 25979 1 667 . 1 1 55 55 ILE HA H 1 4.357 0.000 . 1 . . . . A 74 ILE HA . 25979 1 668 . 1 1 55 55 ILE HB H 1 1.560 0.000 . 1 . . . . A 74 ILE HB . 25979 1 669 . 1 1 55 55 ILE HG12 H 1 -0.034 0.000 . 2 . . . . A 74 ILE HG12 . 25979 1 670 . 1 1 55 55 ILE HG13 H 1 1.221 0.006 . 2 . . . . A 74 ILE HG13 . 25979 1 671 . 1 1 55 55 ILE HG21 H 1 0.493 0.000 . 1 . . . . A 74 ILE HG21 . 25979 1 672 . 1 1 55 55 ILE HG22 H 1 0.493 0.000 . 1 . . . . A 74 ILE HG22 . 25979 1 673 . 1 1 55 55 ILE HG23 H 1 0.493 0.000 . 1 . . . . A 74 ILE HG23 . 25979 1 674 . 1 1 55 55 ILE HD11 H 1 0.643 0.000 . 1 . . . . A 74 ILE HD11 . 25979 1 675 . 1 1 55 55 ILE HD12 H 1 0.643 0.000 . 1 . . . . A 74 ILE HD12 . 25979 1 676 . 1 1 55 55 ILE HD13 H 1 0.643 0.000 . 1 . . . . A 74 ILE HD13 . 25979 1 677 . 1 1 55 55 ILE C C 13 176.157 0.000 . 1 . . . . A 74 ILE C . 25979 1 678 . 1 1 55 55 ILE CA C 13 61.118 0.000 . 1 . . . . A 74 ILE CA . 25979 1 679 . 1 1 55 55 ILE CB C 13 37.169 0.000 . 1 . . . . A 74 ILE CB . 25979 1 680 . 1 1 55 55 ILE CG1 C 13 27.553 0.000 . 1 . . . . A 74 ILE CG1 . 25979 1 681 . 1 1 55 55 ILE CG2 C 13 18.806 0.000 . 1 . . . . A 74 ILE CG2 . 25979 1 682 . 1 1 55 55 ILE CD1 C 13 13.063 0.000 . 1 . . . . A 74 ILE CD1 . 25979 1 683 . 1 1 55 55 ILE N N 15 123.880 0.000 . 1 . . . . A 74 ILE N . 25979 1 684 . 1 1 56 56 ILE H H 1 8.003 0.000 . 1 . . . . A 75 ILE H . 25979 1 685 . 1 1 56 56 ILE HA H 1 4.328 0.000 . 1 . . . . A 75 ILE HA . 25979 1 686 . 1 1 56 56 ILE HB H 1 1.514 0.000 . 1 . . . . A 75 ILE HB . 25979 1 687 . 1 1 56 56 ILE HG12 H 1 1.324 0.000 . 2 . . . . A 75 ILE HG12 . 25979 1 688 . 1 1 56 56 ILE HG13 H 1 1.408 0.002 . 2 . . . . A 75 ILE HG13 . 25979 1 689 . 1 1 56 56 ILE HG21 H 1 0.965 0.000 . 1 . . . . A 75 ILE HG21 . 25979 1 690 . 1 1 56 56 ILE HG22 H 1 0.965 0.000 . 1 . . . . A 75 ILE HG22 . 25979 1 691 . 1 1 56 56 ILE HG23 H 1 0.965 0.000 . 1 . . . . A 75 ILE HG23 . 25979 1 692 . 1 1 56 56 ILE HD11 H 1 0.771 0.000 . 1 . . . . A 75 ILE HD11 . 25979 1 693 . 1 1 56 56 ILE HD12 H 1 0.771 0.000 . 1 . . . . A 75 ILE HD12 . 25979 1 694 . 1 1 56 56 ILE HD13 H 1 0.771 0.000 . 1 . . . . A 75 ILE HD13 . 25979 1 695 . 1 1 56 56 ILE C C 13 175.322 0.000 . 1 . . . . A 75 ILE C . 25979 1 696 . 1 1 56 56 ILE CA C 13 59.446 0.000 . 1 . . . . A 75 ILE CA . 25979 1 697 . 1 1 56 56 ILE CB C 13 40.283 0.000 . 1 . . . . A 75 ILE CB . 25979 1 698 . 1 1 56 56 ILE CG1 C 13 27.127 0.000 . 1 . . . . A 75 ILE CG1 . 25979 1 699 . 1 1 56 56 ILE CG2 C 13 20.304 0.000 . 1 . . . . A 75 ILE CG2 . 25979 1 700 . 1 1 56 56 ILE CD1 C 13 12.794 0.000 . 1 . . . . A 75 ILE CD1 . 25979 1 701 . 1 1 56 56 ILE N N 15 129.035 0.000 . 1 . . . . A 75 ILE N . 25979 1 702 . 1 1 57 57 PHE H H 1 9.155 0.000 . 1 . . . . A 76 PHE H . 25979 1 703 . 1 1 57 57 PHE HA H 1 4.945 0.000 . 1 . . . . A 76 PHE HA . 25979 1 704 . 1 1 57 57 PHE HB2 H 1 3.181 0.000 . 2 . . . . A 76 PHE HB2 . 25979 1 705 . 1 1 57 57 PHE HB3 H 1 3.014 0.003 . 2 . . . . A 76 PHE HB3 . 25979 1 706 . 1 1 57 57 PHE HD2 H 1 7.445 0.004 . 3 . . . . A 76 PHE HD2 . 25979 1 707 . 1 1 57 57 PHE HE2 H 1 7.341 0.006 . 3 . . . . A 76 PHE HE2 . 25979 1 708 . 1 1 57 57 PHE HZ H 1 7.261 0.002 . 1 . . . . A 76 PHE HZ . 25979 1 709 . 1 1 57 57 PHE C C 13 173.450 0.000 . 1 . . . . A 76 PHE C . 25979 1 710 . 1 1 57 57 PHE CA C 13 56.734 0.000 . 1 . . . . A 76 PHE CA . 25979 1 711 . 1 1 57 57 PHE CB C 13 37.859 0.000 . 1 . . . . A 76 PHE CB . 25979 1 712 . 1 1 57 57 PHE CD2 C 13 132.053 0.000 . 3 . . . . A 76 PHE CD2 . 25979 1 713 . 1 1 57 57 PHE CZ C 13 129.574 0.000 . 1 . . . . A 76 PHE CZ . 25979 1 714 . 1 1 57 57 PHE N N 15 129.738 0.000 . 1 . . . . A 76 PHE N . 25979 1 715 . 1 1 58 58 PRO HA H 1 4.485 0.000 . 1 . . . . A 77 PRO HA . 25979 1 716 . 1 1 58 58 PRO HB2 H 1 2.576 0.007 . 2 . . . . A 77 PRO HB2 . 25979 1 717 . 1 1 58 58 PRO HB3 H 1 1.943 0.008 . 2 . . . . A 77 PRO HB3 . 25979 1 718 . 1 1 58 58 PRO HG2 H 1 2.247 0.007 . 2 . . . . A 77 PRO HG2 . 25979 1 719 . 1 1 58 58 PRO HG3 H 1 1.890 0.007 . 2 . . . . A 77 PRO HG3 . 25979 1 720 . 1 1 58 58 PRO HD2 H 1 4.264 0.005 . 2 . . . . A 77 PRO HD2 . 25979 1 721 . 1 1 58 58 PRO HD3 H 1 3.832 0.004 . 2 . . . . A 77 PRO HD3 . 25979 1 722 . 1 1 58 58 PRO C C 13 177.007 0.000 . 1 . . . . A 77 PRO C . 25979 1 723 . 1 1 58 58 PRO CA C 13 64.754 0.000 . 1 . . . . A 77 PRO CA . 25979 1 724 . 1 1 58 58 PRO CB C 13 31.597 0.000 . 1 . . . . A 77 PRO CB . 25979 1 725 . 1 1 58 58 PRO CG C 13 28.209 0.000 . 1 . . . . A 77 PRO CG . 25979 1 726 . 1 1 58 58 PRO CD C 13 50.144 0.000 . 1 . . . . A 77 PRO CD . 25979 1 727 . 1 1 59 59 ASP H H 1 9.078 0.000 . 1 . . . . A 78 ASP H . 25979 1 728 . 1 1 59 59 ASP HA H 1 4.333 0.000 . 1 . . . . A 78 ASP HA . 25979 1 729 . 1 1 59 59 ASP HB2 H 1 2.982 0.000 . 2 . . . . A 78 ASP HB2 . 25979 1 730 . 1 1 59 59 ASP HB3 H 1 2.932 0.000 . 2 . . . . A 78 ASP HB3 . 25979 1 731 . 1 1 59 59 ASP C C 13 175.697 0.000 . 1 . . . . A 78 ASP C . 25979 1 732 . 1 1 59 59 ASP CA C 13 56.808 0.000 . 1 . . . . A 78 ASP CA . 25979 1 733 . 1 1 59 59 ASP CB C 13 40.478 0.000 . 1 . . . . A 78 ASP CB . 25979 1 734 . 1 1 59 59 ASP N N 15 119.069 0.000 . 1 . . . . A 78 ASP N . 25979 1 735 . 1 1 60 60 ASP H H 1 8.189 0.000 . 1 . . . . A 79 ASP H . 25979 1 736 . 1 1 60 60 ASP HA H 1 4.637 0.000 . 1 . . . . A 79 ASP HA . 25979 1 737 . 1 1 60 60 ASP HB2 H 1 3.178 0.000 . 2 . . . . A 79 ASP HB2 . 25979 1 738 . 1 1 60 60 ASP HB3 H 1 2.840 0.000 . 2 . . . . A 79 ASP HB3 . 25979 1 739 . 1 1 60 60 ASP C C 13 179.239 0.000 . 1 . . . . A 79 ASP C . 25979 1 740 . 1 1 60 60 ASP CA C 13 57.533 0.000 . 1 . . . . A 79 ASP CA . 25979 1 741 . 1 1 60 60 ASP CB C 13 42.584 0.000 . 1 . . . . A 79 ASP CB . 25979 1 742 . 1 1 60 60 ASP N N 15 120.140 0.000 . 1 . . . . A 79 ASP N . 25979 1 743 . 1 1 61 61 CYS H H 1 9.222 0.000 . 1 . . . . A 80 CYS H . 25979 1 744 . 1 1 61 61 CYS HA H 1 5.317 0.006 . 1 . . . . A 80 CYS HA . 25979 1 745 . 1 1 61 61 CYS HB2 H 1 2.103 0.006 . 2 . . . . A 80 CYS HB2 . 25979 1 746 . 1 1 61 61 CYS HB3 H 1 1.922 0.007 . 2 . . . . A 80 CYS HB3 . 25979 1 747 . 1 1 61 61 CYS C C 13 173.191 0.000 . 1 . . . . A 80 CYS C . 25979 1 748 . 1 1 61 61 CYS CA C 13 57.188 0.000 . 1 . . . . A 80 CYS CA . 25979 1 749 . 1 1 61 61 CYS CB C 13 32.986 0.000 . 1 . . . . A 80 CYS CB . 25979 1 750 . 1 1 61 61 CYS N N 15 115.687 0.000 . 1 . . . . A 80 CYS N . 25979 1 751 . 1 1 62 62 GLU H H 1 8.024 0.000 . 1 . . . . A 81 GLU H . 25979 1 752 . 1 1 62 62 GLU HA H 1 4.510 0.000 . 1 . . . . A 81 GLU HA . 25979 1 753 . 1 1 62 62 GLU HB2 H 1 1.889 0.003 . 2 . . . . A 81 GLU HB2 . 25979 1 754 . 1 1 62 62 GLU HG2 H 1 2.085 0.000 . 2 . . . . A 81 GLU HG2 . 25979 1 755 . 1 1 62 62 GLU C C 13 172.816 0.000 . 1 . . . . A 81 GLU C . 25979 1 756 . 1 1 62 62 GLU CA C 13 54.771 0.000 . 1 . . . . A 81 GLU CA . 25979 1 757 . 1 1 62 62 GLU CB C 13 33.951 0.000 . 1 . . . . A 81 GLU CB . 25979 1 758 . 1 1 62 62 GLU CG C 13 35.742 0.000 . 1 . . . . A 81 GLU CG . 25979 1 759 . 1 1 62 62 GLU N N 15 117.084 0.000 . 1 . . . . A 81 GLU N . 25979 1 760 . 1 1 63 63 PHE H H 1 9.468 0.000 . 1 . . . . A 82 PHE H . 25979 1 761 . 1 1 63 63 PHE HA H 1 6.124 0.005 . 1 . . . . A 82 PHE HA . 25979 1 762 . 1 1 63 63 PHE HB2 H 1 3.139 0.005 . 2 . . . . A 82 PHE HB2 . 25979 1 763 . 1 1 63 63 PHE HB3 H 1 2.579 0.010 . 2 . . . . A 82 PHE HB3 . 25979 1 764 . 1 1 63 63 PHE HD1 H 1 7.338 0.004 . 3 . . . . A 82 PHE HD1 . 25979 1 765 . 1 1 63 63 PHE HE1 H 1 6.919 0.002 . 3 . . . . A 82 PHE HE1 . 25979 1 766 . 1 1 63 63 PHE HZ H 1 6.584 0.002 . 1 . . . . A 82 PHE HZ . 25979 1 767 . 1 1 63 63 PHE C C 13 175.437 0.000 . 1 . . . . A 82 PHE C . 25979 1 768 . 1 1 63 63 PHE CA C 13 55.245 0.000 . 1 . . . . A 82 PHE CA . 25979 1 769 . 1 1 63 63 PHE CB C 13 42.169 0.000 . 1 . . . . A 82 PHE CB . 25979 1 770 . 1 1 63 63 PHE N N 15 128.098 0.000 . 1 . . . . A 82 PHE N . 25979 1 771 . 1 1 64 64 LYS H H 1 8.957 0.000 . 1 . . . . A 83 LYS H . 25979 1 772 . 1 1 64 64 LYS HA H 1 4.855 0.000 . 1 . . . . A 83 LYS HA . 25979 1 773 . 1 1 64 64 LYS HB2 H 1 1.691 0.000 . 2 . . . . A 83 LYS HB2 . 25979 1 774 . 1 1 64 64 LYS HB3 H 1 1.796 0.000 . 2 . . . . A 83 LYS HB3 . 25979 1 775 . 1 1 64 64 LYS HG2 H 1 1.281 0.000 . 2 . . . . A 83 LYS HG2 . 25979 1 776 . 1 1 64 64 LYS HD2 H 1 1.610 0.004 . 2 . . . . A 83 LYS HD2 . 25979 1 777 . 1 1 64 64 LYS HD3 H 1 1.555 0.004 . 2 . . . . A 83 LYS HD3 . 25979 1 778 . 1 1 64 64 LYS HE2 H 1 2.925 0.005 . 2 . . . . A 83 LYS HE2 . 25979 1 779 . 1 1 64 64 LYS HE3 H 1 2.819 0.007 . 2 . . . . A 83 LYS HE3 . 25979 1 780 . 1 1 64 64 LYS C C 13 173.680 0.000 . 1 . . . . A 83 LYS C . 25979 1 781 . 1 1 64 64 LYS CA C 13 54.736 0.000 . 1 . . . . A 83 LYS CA . 25979 1 782 . 1 1 64 64 LYS CB C 13 36.304 0.000 . 1 . . . . A 83 LYS CB . 25979 1 783 . 1 1 64 64 LYS CG C 13 23.621 0.000 . 1 . . . . A 83 LYS CG . 25979 1 784 . 1 1 64 64 LYS CD C 13 29.521 0.000 . 1 . . . . A 83 LYS CD . 25979 1 785 . 1 1 64 64 LYS CE C 13 41.739 0.000 . 1 . . . . A 83 LYS CE . 25979 1 786 . 1 1 64 64 LYS N N 15 124.583 0.000 . 1 . . . . A 83 LYS N . 25979 1 787 . 1 1 65 65 ARG H H 1 8.745 0.000 . 1 . . . . A 84 ARG H . 25979 1 788 . 1 1 65 65 ARG HA H 1 3.262 0.006 . 1 . . . . A 84 ARG HA . 25979 1 789 . 1 1 65 65 ARG HB2 H 1 1.598 0.003 . 2 . . . . A 84 ARG HB2 . 25979 1 790 . 1 1 65 65 ARG HB3 H 1 1.470 0.002 . 2 . . . . A 84 ARG HB3 . 25979 1 791 . 1 1 65 65 ARG HG2 H 1 1.322 0.002 . 2 . . . . A 84 ARG HG2 . 25979 1 792 . 1 1 65 65 ARG HG3 H 1 0.980 0.000 . 2 . . . . A 84 ARG HG3 . 25979 1 793 . 1 1 65 65 ARG HD2 H 1 3.007 0.005 . 2 . . . . A 84 ARG HD2 . 25979 1 794 . 1 1 65 65 ARG HD3 H 1 2.816 0.000 . 2 . . . . A 84 ARG HD3 . 25979 1 795 . 1 1 65 65 ARG C C 13 175.956 0.000 . 1 . . . . A 84 ARG C . 25979 1 796 . 1 1 65 65 ARG CA C 13 55.718 0.000 . 1 . . . . A 84 ARG CA . 25979 1 797 . 1 1 65 65 ARG CB C 13 30.572 0.000 . 1 . . . . A 84 ARG CB . 25979 1 798 . 1 1 65 65 ARG N N 15 123.880 0.000 . 1 . . . . A 84 ARG N . 25979 1 799 . 1 1 66 66 VAL H H 1 8.529 0.000 . 1 . . . . A 85 VAL H . 25979 1 800 . 1 1 66 66 VAL HA H 1 4.447 0.004 . 1 . . . . A 85 VAL HA . 25979 1 801 . 1 1 66 66 VAL HB H 1 1.926 0.000 . 1 . . . . A 85 VAL HB . 25979 1 802 . 1 1 66 66 VAL HG11 H 1 1.080 0.000 . 2 . . . . A 85 VAL HG11 . 25979 1 803 . 1 1 66 66 VAL HG12 H 1 1.080 0.000 . 2 . . . . A 85 VAL HG12 . 25979 1 804 . 1 1 66 66 VAL HG13 H 1 1.080 0.000 . 2 . . . . A 85 VAL HG13 . 25979 1 805 . 1 1 66 66 VAL HG21 H 1 1.172 0.023 . 2 . . . . A 85 VAL HG21 . 25979 1 806 . 1 1 66 66 VAL HG22 H 1 1.172 0.023 . 2 . . . . A 85 VAL HG22 . 25979 1 807 . 1 1 66 66 VAL HG23 H 1 1.172 0.023 . 2 . . . . A 85 VAL HG23 . 25979 1 808 . 1 1 66 66 VAL C C 13 174.991 0.000 . 1 . . . . A 85 VAL C . 25979 1 809 . 1 1 66 66 VAL CA C 13 59.707 0.000 . 1 . . . . A 85 VAL CA . 25979 1 810 . 1 1 66 66 VAL CB C 13 31.780 0.000 . 1 . . . . A 85 VAL CB . 25979 1 811 . 1 1 66 66 VAL CG1 C 13 22.715 0.000 . 2 . . . . A 85 VAL CG1 . 25979 1 812 . 1 1 66 66 VAL CG2 C 13 22.305 0.000 . 2 . . . . A 85 VAL CG2 . 25979 1 813 . 1 1 66 66 VAL N N 15 127.395 0.000 . 1 . . . . A 85 VAL N . 25979 1 814 . 1 1 67 67 PRO HA H 1 4.281 0.004 . 1 . . . . A 86 PRO HA . 25979 1 815 . 1 1 67 67 PRO HB2 H 1 2.220 0.006 . 2 . . . . A 86 PRO HB2 . 25979 1 816 . 1 1 67 67 PRO HB3 H 1 1.916 0.004 . 2 . . . . A 86 PRO HB3 . 25979 1 817 . 1 1 67 67 PRO HD2 H 1 4.099 0.002 . 2 . . . . A 86 PRO HD2 . 25979 1 818 . 1 1 67 67 PRO HD3 H 1 4.027 0.006 . 2 . . . . A 86 PRO HD3 . 25979 1 819 . 1 1 67 67 PRO C C 13 173.170 0.000 . 1 . . . . A 86 PRO C . 25979 1 820 . 1 1 67 67 PRO CA C 13 61.816 0.000 . 1 . . . . A 86 PRO CA . 25979 1 821 . 1 1 67 67 PRO CB C 13 31.825 0.000 . 1 . . . . A 86 PRO CB . 25979 1 822 . 1 1 67 67 PRO CG C 13 27.307 0.000 . 1 . . . . A 86 PRO CG . 25979 1 823 . 1 1 67 67 PRO CD C 13 50.939 0.000 . 1 . . . . A 86 PRO CD . 25979 1 824 . 1 1 68 68 GLN H H 1 8.246 0.000 . 1 . . . . A 87 GLN H . 25979 1 825 . 1 1 68 68 GLN HA H 1 4.078 0.006 . 1 . . . . A 87 GLN HA . 25979 1 826 . 1 1 68 68 GLN HB2 H 1 2.334 0.000 . 2 . . . . A 87 GLN HB2 . 25979 1 827 . 1 1 68 68 GLN HB3 H 1 1.964 0.003 . 2 . . . . A 87 GLN HB3 . 25979 1 828 . 1 1 68 68 GLN HG2 H 1 2.636 0.002 . 2 . . . . A 87 GLN HG2 . 25979 1 829 . 1 1 68 68 GLN HG3 H 1 2.520 0.002 . 2 . . . . A 87 GLN HG2 . 25979 1 830 . 1 1 68 68 GLN HE21 H 1 6.993 0.002 . 2 . . . . A 87 GLN HE21 . 25979 1 831 . 1 1 68 68 GLN HE22 H 1 7.768 0.002 . 2 . . . . A 87 GLN HE22 . 25979 1 832 . 1 1 68 68 GLN C C 13 174.113 0.000 . 1 . . . . A 87 GLN C . 25979 1 833 . 1 1 68 68 GLN CA C 13 58.074 0.000 . 1 . . . . A 87 GLN CA . 25979 1 834 . 1 1 68 68 GLN CB C 13 27.826 0.000 . 1 . . . . A 87 GLN CB . 25979 1 835 . 1 1 68 68 GLN N N 15 116.368 0.000 . 1 . . . . A 87 GLN N . 25979 1 836 . 1 1 68 68 GLN NE2 N 15 111.904 0.000 . 1 . . . . A 87 GLN NE2 . 25979 1 837 . 1 1 69 69 CYS H H 1 6.678 0.000 . 1 . . . . A 88 CYS H . 25979 1 838 . 1 1 69 69 CYS HA H 1 4.874 0.000 . 1 . . . . A 88 CYS HA . 25979 1 839 . 1 1 69 69 CYS HB2 H 1 2.166 0.000 . 2 . . . . A 88 CYS HB2 . 25979 1 840 . 1 1 69 69 CYS C C 13 173.709 0.000 . 1 . . . . A 88 CYS C . 25979 1 841 . 1 1 69 69 CYS CA C 13 55.478 0.000 . 1 . . . . A 88 CYS CA . 25979 1 842 . 1 1 69 69 CYS CB C 13 26.412 0.000 . 1 . . . . A 88 CYS CB . 25979 1 843 . 1 1 69 69 CYS N N 15 117.552 0.000 . 1 . . . . A 88 CYS N . 25979 1 844 . 1 1 70 70 PRO HD2 H 1 3.892 0.000 . 2 . . . . A 89 PRO HD2 . 25979 1 845 . 1 1 70 70 PRO HD3 H 1 3.803 0.000 . 2 . . . . A 89 PRO HD3 . 25979 1 846 . 1 1 70 70 PRO C C 13 175.740 0.000 . 1 . . . . A 89 PRO C . 25979 1 847 . 1 1 70 70 PRO CA C 13 62.706 0.000 . 1 . . . . A 89 PRO CA . 25979 1 848 . 1 1 70 70 PRO CB C 13 33.870 0.000 . 1 . . . . A 89 PRO CB . 25979 1 849 . 1 1 72 72 GLY H H 1 7.548 0.000 . 1 . . . . A 91 GLY H . 25979 1 850 . 1 1 72 72 GLY HA2 H 1 4.197 0.000 . 2 . . . . A 91 GLY HA2 . 25979 1 851 . 1 1 72 72 GLY HA3 H 1 3.741 0.000 . 2 . . . . A 91 GLY HA3 . 25979 1 852 . 1 1 72 72 GLY C C 13 172.082 0.000 . 1 . . . . A 91 GLY C . 25979 1 853 . 1 1 72 72 GLY CA C 13 45.211 0.000 . 1 . . . . A 91 GLY CA . 25979 1 854 . 1 1 72 72 GLY N N 15 108.648 0.000 . 1 . . . . A 91 GLY N . 25979 1 855 . 1 1 73 73 ARG HD2 H 1 3.298 0.005 . 2 . . . . A 92 ARG HD2 . 25979 1 856 . 1 1 73 73 ARG HD3 H 1 3.249 0.000 . 2 . . . . A 92 ARG HD3 . 25979 1 857 . 1 1 73 73 ARG HE H 1 9.919 0.003 . 1 . . . . A 92 ARG HE . 25979 1 858 . 1 1 73 73 ARG NE N 15 87.327 0.000 . 1 . . . . A 92 ARG NE . 25979 1 859 . 1 1 74 74 VAL HA H 1 5.316 0.005 . 1 . . . . A 93 VAL HA . 25979 1 860 . 1 1 74 74 VAL HB H 1 1.838 0.002 . 1 . . . . A 93 VAL HB . 25979 1 861 . 1 1 74 74 VAL HG21 H 1 1.246 0.004 . 2 . . . . A 93 VAL HG21 . 25979 1 862 . 1 1 74 74 VAL HG22 H 1 1.246 0.004 . 2 . . . . A 93 VAL HG22 . 25979 1 863 . 1 1 74 74 VAL HG23 H 1 1.246 0.004 . 2 . . . . A 93 VAL HG23 . 25979 1 864 . 1 1 74 74 VAL C C 13 174.061 0.000 . 1 . . . . A 93 VAL C . 25979 1 865 . 1 1 74 74 VAL CA C 13 61.401 0.000 . 1 . . . . A 93 VAL CA . 25979 1 866 . 1 1 74 74 VAL CB C 13 33.635 0.000 . 1 . . . . A 93 VAL CB . 25979 1 867 . 1 1 74 74 VAL CG2 C 13 21.895 0.000 . 2 . . . . A 93 VAL CG2 . 25979 1 868 . 1 1 75 75 TYR H H 1 9.448 0.000 . 1 . . . . A 94 TYR H . 25979 1 869 . 1 1 75 75 TYR HA H 1 4.814 0.003 . 1 . . . . A 94 TYR HA . 25979 1 870 . 1 1 75 75 TYR HB2 H 1 2.313 0.008 . 2 . . . . A 94 TYR HB2 . 25979 1 871 . 1 1 75 75 TYR HD2 H 1 6.567 0.002 . 3 . . . . A 94 TYR HD2 . 25979 1 872 . 1 1 75 75 TYR HE2 H 1 6.619 0.002 . 3 . . . . A 94 TYR HE2 . 25979 1 873 . 1 1 75 75 TYR C C 13 173.176 0.000 . 1 . . . . A 94 TYR C . 25979 1 874 . 1 1 75 75 TYR CA C 13 56.415 0.000 . 1 . . . . A 94 TYR CA . 25979 1 875 . 1 1 75 75 TYR CB C 13 44.350 0.000 . 1 . . . . A 94 TYR CB . 25979 1 876 . 1 1 75 75 TYR CD2 C 13 132.794 0.000 . 3 . . . . A 94 TYR CD2 . 25979 1 877 . 1 1 75 75 TYR CE2 C 13 117.022 0.000 . 3 . . . . A 94 TYR CE2 . 25979 1 878 . 1 1 75 75 TYR N N 15 126.692 0.000 . 1 . . . . A 94 TYR N . 25979 1 879 . 1 1 76 76 VAL H H 1 9.205 0.000 . 1 . . . . A 95 VAL H . 25979 1 880 . 1 1 76 76 VAL HA H 1 5.062 0.008 . 1 . . . . A 95 VAL HA . 25979 1 881 . 1 1 76 76 VAL HB H 1 1.384 0.004 . 1 . . . . A 95 VAL HB . 25979 1 882 . 1 1 76 76 VAL HG11 H 1 0.833 0.005 . 2 . . . . A 95 VAL HG11 . 25979 1 883 . 1 1 76 76 VAL HG12 H 1 0.833 0.005 . 2 . . . . A 95 VAL HG12 . 25979 1 884 . 1 1 76 76 VAL HG13 H 1 0.833 0.005 . 2 . . . . A 95 VAL HG13 . 25979 1 885 . 1 1 76 76 VAL HG21 H 1 -0.161 0.000 . 2 . . . . A 95 VAL HG21 . 25979 1 886 . 1 1 76 76 VAL HG22 H 1 -0.161 0.000 . 2 . . . . A 95 VAL HG22 . 25979 1 887 . 1 1 76 76 VAL HG23 H 1 -0.161 0.000 . 2 . . . . A 95 VAL HG23 . 25979 1 888 . 1 1 76 76 VAL C C 13 172.240 0.000 . 1 . . . . A 95 VAL C . 25979 1 889 . 1 1 76 76 VAL CA C 13 56.765 0.000 . 1 . . . . A 95 VAL CA . 25979 1 890 . 1 1 76 76 VAL CB C 13 35.981 0.000 . 1 . . . . A 95 VAL CB . 25979 1 891 . 1 1 76 76 VAL CG1 C 13 19.435 0.000 . 2 . . . . A 95 VAL CG1 . 25979 1 892 . 1 1 76 76 VAL CG2 C 13 21.752 0.000 . 2 . . . . A 95 VAL CG2 . 25979 1 893 . 1 1 76 76 VAL N N 15 119.427 0.000 . 1 . . . . A 95 VAL N . 25979 1 894 . 1 1 77 77 LEU H H 1 9.474 0.000 . 1 . . . . A 96 LEU H . 25979 1 895 . 1 1 77 77 LEU HA H 1 4.942 0.000 . 1 . . . . A 96 LEU HA . 25979 1 896 . 1 1 77 77 LEU HB2 H 1 1.101 0.000 . 2 . . . . A 96 LEU HB2 . 25979 1 897 . 1 1 77 77 LEU HB3 H 1 2.174 0.008 . 2 . . . . A 96 LEU HB3 . 25979 1 898 . 1 1 77 77 LEU HG H 1 0.820 0.000 . 1 . . . . A 96 LEU HG . 25979 1 899 . 1 1 77 77 LEU HD11 H 1 0.326 0.000 . 2 . . . . A 96 LEU HD11 . 25979 1 900 . 1 1 77 77 LEU HD12 H 1 0.326 0.000 . 2 . . . . A 96 LEU HD12 . 25979 1 901 . 1 1 77 77 LEU HD13 H 1 0.326 0.000 . 2 . . . . A 96 LEU HD13 . 25979 1 902 . 1 1 77 77 LEU HD21 H 1 -0.044 0.000 . 2 . . . . A 96 LEU HD21 . 25979 1 903 . 1 1 77 77 LEU HD22 H 1 -0.044 0.000 . 2 . . . . A 96 LEU HD22 . 25979 1 904 . 1 1 77 77 LEU HD23 H 1 -0.044 0.000 . 2 . . . . A 96 LEU HD23 . 25979 1 905 . 1 1 77 77 LEU C C 13 174.055 0.000 . 1 . . . . A 96 LEU C . 25979 1 906 . 1 1 77 77 LEU CA C 13 53.501 0.000 . 1 . . . . A 96 LEU CA . 25979 1 907 . 1 1 77 77 LEU CB C 13 43.333 0.000 . 1 . . . . A 96 LEU CB . 25979 1 908 . 1 1 77 77 LEU CG C 13 26.979 0.000 . 1 . . . . A 96 LEU CG . 25979 1 909 . 1 1 77 77 LEU CD1 C 13 23.048 0.000 . 2 . . . . A 96 LEU CD1 . 25979 1 910 . 1 1 77 77 LEU CD2 C 13 24.714 0.000 . 2 . . . . A 96 LEU CD2 . 25979 1 911 . 1 1 77 77 LEU N N 15 128.567 0.000 . 1 . . . . A 96 LEU N . 25979 1 912 . 1 1 78 78 LYS H H 1 9.060 0.000 . 1 . . . . A 97 LYS H . 25979 1 913 . 1 1 78 78 LYS HA H 1 4.576 0.000 . 1 . . . . A 97 LYS HA . 25979 1 914 . 1 1 78 78 LYS HB2 H 1 1.877 0.000 . 2 . . . . A 97 LYS HB2 . 25979 1 915 . 1 1 78 78 LYS HB3 H 1 1.566 0.000 . 2 . . . . A 97 LYS HB3 . 25979 1 916 . 1 1 78 78 LYS HG2 H 1 1.250 0.000 . 2 . . . . A 97 LYS HG2 . 25979 1 917 . 1 1 78 78 LYS HG3 H 1 1.060 0.000 . 2 . . . . A 97 LYS HG3 . 25979 1 918 . 1 1 78 78 LYS HD2 H 1 1.645 0.009 . 2 . . . . A 97 LYS HD2 . 25979 1 919 . 1 1 78 78 LYS HD3 H 1 1.609 0.006 . 2 . . . . A 97 LYS HD3 . 25979 1 920 . 1 1 78 78 LYS HE3 H 1 2.887 0.000 . 2 . . . . A 97 LYS HE3 . 25979 1 921 . 1 1 78 78 LYS C C 13 175.538 0.000 . 1 . . . . A 97 LYS C . 25979 1 922 . 1 1 78 78 LYS CA C 13 55.222 0.000 . 1 . . . . A 97 LYS CA . 25979 1 923 . 1 1 78 78 LYS CB C 13 34.886 0.000 . 1 . . . . A 97 LYS CB . 25979 1 924 . 1 1 78 78 LYS CG C 13 25.448 0.000 . 1 . . . . A 97 LYS CG . 25979 1 925 . 1 1 78 78 LYS CD C 13 29.849 0.000 . 1 . . . . A 97 LYS CD . 25979 1 926 . 1 1 78 78 LYS CE C 13 41.739 0.000 . 1 . . . . A 97 LYS CE . 25979 1 927 . 1 1 78 78 LYS N N 15 126.926 0.000 . 1 . . . . A 97 LYS N . 25979 1 928 . 1 1 79 79 PHE H H 1 7.713 0.000 . 1 . . . . A 98 PHE H . 25979 1 929 . 1 1 79 79 PHE HA H 1 4.763 0.000 . 1 . . . . A 98 PHE HA . 25979 1 930 . 1 1 79 79 PHE HB2 H 1 3.247 0.004 . 2 . . . . A 98 PHE HB2 . 25979 1 931 . 1 1 79 79 PHE HB3 H 1 3.082 0.000 . 2 . . . . A 98 PHE HB3 . 25979 1 932 . 1 1 79 79 PHE HD1 H 1 7.210 0.006 . 3 . . . . A 98 PHE HD1 . 25979 1 933 . 1 1 79 79 PHE HE1 H 1 7.096 0.021 . 3 . . . . A 98 PHE HE1 . 25979 1 934 . 1 1 79 79 PHE HZ H 1 6.966 0.002 . 1 . . . . A 98 PHE HZ . 25979 1 935 . 1 1 79 79 PHE C C 13 175.869 0.000 . 1 . . . . A 98 PHE C . 25979 1 936 . 1 1 79 79 PHE CA C 13 57.848 0.000 . 1 . . . . A 98 PHE CA . 25979 1 937 . 1 1 79 79 PHE CB C 13 38.103 0.000 . 1 . . . . A 98 PHE CB . 25979 1 938 . 1 1 79 79 PHE CD1 C 13 132.181 0.000 . 3 . . . . A 98 PHE CD1 . 25979 1 939 . 1 1 79 79 PHE CE1 C 13 130.865 0.000 . 3 . . . . A 98 PHE CE1 . 25979 1 940 . 1 1 79 79 PHE CZ C 13 129.582 0.000 . 1 . . . . A 98 PHE CZ . 25979 1 941 . 1 1 79 79 PHE N N 15 126.692 0.000 . 1 . . . . A 98 PHE N . 25979 1 942 . 1 1 80 80 LYS H H 1 8.332 0.000 . 1 . . . . A 99 LYS H . 25979 1 943 . 1 1 80 80 LYS HA H 1 3.964 0.000 . 1 . . . . A 99 LYS HA . 25979 1 944 . 1 1 80 80 LYS HB2 H 1 1.902 0.000 . 2 . . . . A 99 LYS HB2 . 25979 1 945 . 1 1 80 80 LYS HB3 H 1 1.796 0.005 . 2 . . . . A 99 LYS HB3 . 25979 1 946 . 1 1 80 80 LYS HG2 H 1 1.381 0.000 . 2 . . . . A 99 LYS HG2 . 25979 1 947 . 1 1 80 80 LYS HD2 H 1 1.624 0.000 . 2 . . . . A 99 LYS HD2 . 25979 1 948 . 1 1 80 80 LYS HD3 H 1 1.677 0.001 . 2 . . . . A 99 LYS HD3 . 25979 1 949 . 1 1 80 80 LYS HE2 H 1 2.814 0.003 . 2 . . . . A 99 LYS HE2 . 25979 1 950 . 1 1 80 80 LYS HE3 H 1 2.830 0.000 . 2 . . . . A 99 LYS HE3 . 25979 1 951 . 1 1 80 80 LYS C C 13 177.036 0.000 . 1 . . . . A 99 LYS C . 25979 1 952 . 1 1 80 80 LYS CA C 13 59.158 0.000 . 1 . . . . A 99 LYS CA . 25979 1 953 . 1 1 80 80 LYS CB C 13 32.255 0.000 . 1 . . . . A 99 LYS CB . 25979 1 954 . 1 1 80 80 LYS CG C 13 25.609 0.000 . 1 . . . . A 99 LYS CG . 25979 1 955 . 1 1 80 80 LYS CD C 13 28.816 0.040 . 1 . . . . A 99 LYS CD . 25979 1 956 . 1 1 80 80 LYS CE C 13 41.411 0.000 . 1 . . . . A 99 LYS CE . 25979 1 957 . 1 1 80 80 LYS N N 15 123.177 0.000 . 1 . . . . A 99 LYS N . 25979 1 958 . 1 1 81 81 ALA H H 1 8.990 0.000 . 1 . . . . A 100 ALA H . 25979 1 959 . 1 1 81 81 ALA HA H 1 4.597 0.000 . 1 . . . . A 100 ALA HA . 25979 1 960 . 1 1 81 81 ALA HB1 H 1 1.455 0.000 . 1 . . . . A 100 ALA HB1 . 25979 1 961 . 1 1 81 81 ALA HB2 H 1 1.455 0.000 . 1 . . . . A 100 ALA HB2 . 25979 1 962 . 1 1 81 81 ALA HB3 H 1 1.455 0.000 . 1 . . . . A 100 ALA HB3 . 25979 1 963 . 1 1 81 81 ALA C C 13 177.525 0.000 . 1 . . . . A 100 ALA C . 25979 1 964 . 1 1 81 81 ALA CA C 13 51.614 0.000 . 1 . . . . A 100 ALA CA . 25979 1 965 . 1 1 81 81 ALA CB C 13 18.967 0.000 . 1 . . . . A 100 ALA CB . 25979 1 966 . 1 1 81 81 ALA N N 15 121.536 0.000 . 1 . . . . A 100 ALA N . 25979 1 967 . 1 1 82 82 GLY H H 1 8.000 0.000 . 1 . . . . A 101 GLY H . 25979 1 968 . 1 1 82 82 GLY HA2 H 1 4.133 0.001 . 2 . . . . A 101 GLY HA2 . 25979 1 969 . 1 1 82 82 GLY HA3 H 1 4.035 0.001 . 2 . . . . A 101 GLY HA3 . 25979 1 970 . 1 1 82 82 GLY C C 13 173.695 0.000 . 1 . . . . A 101 GLY C . 25979 1 971 . 1 1 82 82 GLY CA C 13 45.473 0.000 . 1 . . . . A 101 GLY CA . 25979 1 972 . 1 1 82 82 GLY N N 15 108.016 0.000 . 1 . . . . A 101 GLY N . 25979 1 973 . 1 1 83 83 SER H H 1 8.125 0.000 . 1 . . . . A 102 SER H . 25979 1 974 . 1 1 83 83 SER HA H 1 4.417 0.000 . 1 . . . . A 102 SER HA . 25979 1 975 . 1 1 83 83 SER HB2 H 1 3.984 0.000 . 2 . . . . A 102 SER HB2 . 25979 1 976 . 1 1 83 83 SER HB3 H 1 3.866 0.000 . 2 . . . . A 102 SER HB3 . 25979 1 977 . 1 1 83 83 SER C C 13 174.950 0.000 . 1 . . . . A 102 SER C . 25979 1 978 . 1 1 83 83 SER CA C 13 57.996 0.000 . 1 . . . . A 102 SER CA . 25979 1 979 . 1 1 83 83 SER CB C 13 63.982 0.000 . 1 . . . . A 102 SER CB . 25979 1 980 . 1 1 83 83 SER N N 15 115.451 0.000 . 1 . . . . A 102 SER N . 25979 1 981 . 1 1 84 84 LYS H H 1 7.958 0.000 . 1 . . . . A 103 LYS H . 25979 1 982 . 1 1 84 84 LYS HA H 1 4.221 0.000 . 1 . . . . A 103 LYS HA . 25979 1 983 . 1 1 84 84 LYS HB2 H 1 1.478 0.000 . 2 . . . . A 103 LYS HB2 . 25979 1 984 . 1 1 84 84 LYS HB3 H 1 1.351 0.000 . 2 . . . . A 103 LYS HB3 . 25979 1 985 . 1 1 84 84 LYS HG2 H 1 1.262 0.000 . 2 . . . . A 103 LYS HG2 . 25979 1 986 . 1 1 84 84 LYS HD2 H 1 1.011 0.002 . 2 . . . . A 103 LYS HD2 . 25979 1 987 . 1 1 84 84 LYS HD3 H 1 0.973 0.011 . 2 . . . . A 103 LYS HD3 . 25979 1 988 . 1 1 84 84 LYS HE2 H 1 2.445 0.005 . 2 . . . . A 103 LYS HE2 . 25979 1 989 . 1 1 84 84 LYS HE3 H 1 2.430 0.005 . 2 . . . . A 103 LYS HE3 . 25979 1 990 . 1 1 84 84 LYS C C 13 177.065 0.000 . 1 . . . . A 103 LYS C . 25979 1 991 . 1 1 84 84 LYS CA C 13 54.909 0.000 . 1 . . . . A 103 LYS CA . 25979 1 992 . 1 1 84 84 LYS CB C 13 32.019 0.000 . 1 . . . . A 103 LYS CB . 25979 1 993 . 1 1 84 84 LYS CG C 13 24.683 0.000 . 1 . . . . A 103 LYS CG . 25979 1 994 . 1 1 84 84 LYS CD C 13 28.865 0.000 . 1 . . . . A 103 LYS CD . 25979 1 995 . 1 1 84 84 LYS CE C 13 41.008 0.000 . 1 . . . . A 103 LYS CE . 25979 1 996 . 1 1 84 84 LYS N N 15 123.187 0.000 . 1 . . . . A 103 LYS N . 25979 1 997 . 1 1 85 85 ARG H H 1 8.428 0.000 . 1 . . . . A 104 ARG H . 25979 1 998 . 1 1 85 85 ARG HA H 1 5.029 0.000 . 1 . . . . A 104 ARG HA . 25979 1 999 . 1 1 85 85 ARG HB2 H 1 1.653 0.005 . 2 . . . . A 104 ARG HB2 . 25979 1 1000 . 1 1 85 85 ARG HB3 H 1 1.653 0.005 . 2 . . . . A 104 ARG HB3 . 25979 1 1001 . 1 1 85 85 ARG HG2 H 1 1.766 0.007 . 2 . . . . A 104 ARG HG2 . 25979 1 1002 . 1 1 85 85 ARG HG3 H 1 1.705 0.025 . 2 . . . . A 104 ARG HG3 . 25979 1 1003 . 1 1 85 85 ARG HD2 H 1 3.245 0.000 . 2 . . . . A 104 ARG HD2 . 25979 1 1004 . 1 1 85 85 ARG HD3 H 1 3.046 0.000 . 2 . . . . A 104 ARG HD3 . 25979 1 1005 . 1 1 85 85 ARG C C 13 173.837 0.000 . 1 . . . . A 104 ARG C . 25979 1 1006 . 1 1 85 85 ARG CA C 13 54.840 0.000 . 1 . . . . A 104 ARG CA . 25979 1 1007 . 1 1 85 85 ARG CB C 13 33.099 0.000 . 1 . . . . A 104 ARG CB . 25979 1 1008 . 1 1 85 85 ARG CG C 13 27.881 0.000 . 1 . . . . A 104 ARG CG . 25979 1 1009 . 1 1 85 85 ARG CD C 13 43.215 0.000 . 1 . . . . A 104 ARG CD . 25979 1 1010 . 1 1 85 85 ARG N N 15 128.098 0.000 . 1 . . . . A 104 ARG N . 25979 1 1011 . 1 1 86 86 LEU H H 1 8.15 0.000 . 1 . . . . A 105 LEU H . 25979 1 1012 . 1 1 86 86 LEU HA H 1 4.769 0.007 . 1 . . . . A 105 LEU HA . 25979 1 1013 . 1 1 86 86 LEU HB2 H 1 1.755 0.003 . 2 . . . . A 105 LEU HB2 . 25979 1 1014 . 1 1 86 86 LEU HB3 H 1 1.621 0.006 . 2 . . . . A 105 LEU HB3 . 25979 1 1015 . 1 1 86 86 LEU HG H 1 1.677 0.002 . 1 . . . . A 105 LEU HG . 25979 1 1016 . 1 1 86 86 LEU HD11 H 1 0.977 0.000 . 2 . . . . A 105 LEU HD11 . 25979 1 1017 . 1 1 86 86 LEU HD12 H 1 0.977 0.000 . 2 . . . . A 105 LEU HD12 . 25979 1 1018 . 1 1 86 86 LEU HD13 H 1 0.977 0.000 . 2 . . . . A 105 LEU HD13 . 25979 1 1019 . 1 1 86 86 LEU HD21 H 1 1.025 0.008 . 2 . . . . A 105 LEU HD21 . 25979 1 1020 . 1 1 86 86 LEU HD22 H 1 1.025 0.008 . 2 . . . . A 105 LEU HD22 . 25979 1 1021 . 1 1 86 86 LEU HD23 H 1 1.025 0.008 . 2 . . . . A 105 LEU HD23 . 25979 1 1022 . 1 1 86 86 LEU C C 13 174.026 0.000 . 1 . . . . A 105 LEU C . 25979 1 1023 . 1 1 86 86 LEU CA C 13 53.814 0.000 . 1 . . . . A 105 LEU CA . 25979 1 1024 . 1 1 86 86 LEU CB C 13 44.564 0.000 . 1 . . . . A 105 LEU CB . 25979 1 1025 . 1 1 86 86 LEU CG C 13 28.209 0.000 . 1 . . . . A 105 LEU CG . 25979 1 1026 . 1 1 86 86 LEU CD1 C 13 24.273 0.000 . 2 . . . . A 105 LEU CD1 . 25979 1 1027 . 1 1 86 86 LEU CD2 C 13 25.585 0.000 . 2 . . . . A 105 LEU CD2 . 25979 1 1028 . 1 1 86 86 LEU N N 15 122.005 0.000 . 1 . . . . A 105 LEU N . 25979 1 1029 . 1 1 87 87 PHE H H 1 8.094 0.000 . 1 . . . . A 106 PHE H . 25979 1 1030 . 1 1 87 87 PHE HA H 1 5.137 0.000 . 1 . . . . A 106 PHE HA . 25979 1 1031 . 1 1 87 87 PHE HB2 H 1 2.714 0.009 . 2 . . . . A 106 PHE HB2 . 25979 1 1032 . 1 1 87 87 PHE HB3 H 1 2.507 0.007 . 2 . . . . A 106 PHE HB3 . 25979 1 1033 . 1 1 87 87 PHE HD1 H 1 6.886 0.002 . 3 . . . . A 106 PHE HD1 . 25979 1 1034 . 1 1 87 87 PHE HE1 H 1 6.682 0.003 . 3 . . . . A 106 PHE HE1 . 25979 1 1035 . 1 1 87 87 PHE HZ H 1 5.547 0.008 . 1 . . . . A 106 PHE HZ . 25979 1 1036 . 1 1 87 87 PHE C C 13 174.962 0.000 . 1 . . . . A 106 PHE C . 25979 1 1037 . 1 1 87 87 PHE CA C 13 57.350 0.000 . 1 . . . . A 106 PHE CA . 25979 1 1038 . 1 1 87 87 PHE CB C 13 43.733 0.000 . 1 . . . . A 106 PHE CB . 25979 1 1039 . 1 1 87 87 PHE CD1 C 13 130.619 0.000 . 3 . . . . A 106 PHE CD1 . 25979 1 1040 . 1 1 87 87 PHE CZ C 13 128.977 0.000 . 1 . . . . A 106 PHE CZ . 25979 1 1041 . 1 1 87 87 PHE N N 15 119.662 0.000 . 1 . . . . A 106 PHE N . 25979 1 1042 . 1 1 88 88 PHE H H 1 9.358 0.000 . 1 . . . . A 107 PHE H . 25979 1 1043 . 1 1 88 88 PHE HA H 1 5.854 0.000 . 1 . . . . A 107 PHE HA . 25979 1 1044 . 1 1 88 88 PHE HB2 H 1 3.362 0.000 . 2 . . . . A 107 PHE HB2 . 25979 1 1045 . 1 1 88 88 PHE HB3 H 1 2.739 0.000 . 2 . . . . A 107 PHE HB3 . 25979 1 1046 . 1 1 88 88 PHE HD1 H 1 7.185 0.003 . 3 . . . . A 107 PHE HD1 . 25979 1 1047 . 1 1 88 88 PHE HE1 H 1 7.072 0.004 . 3 . . . . A 107 PHE HE1 . 25979 1 1048 . 1 1 88 88 PHE HZ H 1 7.244 0.002 . 1 . . . . A 107 PHE HZ . 25979 1 1049 . 1 1 88 88 PHE C C 13 174.170 0.000 . 1 . . . . A 107 PHE C . 25979 1 1050 . 1 1 88 88 PHE CA C 13 56.493 0.000 . 1 . . . . A 107 PHE CA . 25979 1 1051 . 1 1 88 88 PHE CB C 13 44.180 0.000 . 1 . . . . A 107 PHE CB . 25979 1 1052 . 1 1 88 88 PHE N N 15 117.084 0.000 . 1 . . . . A 107 PHE N . 25979 1 1053 . 1 1 89 89 TRP H H 1 9.090 0.000 . 1 . . . . A 108 TRP H . 25979 1 1054 . 1 1 89 89 TRP HA H 1 5.863 0.000 . 1 . . . . A 108 TRP HA . 25979 1 1055 . 1 1 89 89 TRP HB2 H 1 3.490 0.007 . 2 . . . . A 108 TRP HB2 . 25979 1 1056 . 1 1 89 89 TRP HB3 H 1 3.279 0.011 . 2 . . . . A 108 TRP HB3 . 25979 1 1057 . 1 1 89 89 TRP HD1 H 1 6.895 0.004 . 1 . . . . A 108 TRP HD1 . 25979 1 1058 . 1 1 89 89 TRP HE1 H 1 10.515 0.000 . 1 . . . . A 108 TRP HE1 . 25979 1 1059 . 1 1 89 89 TRP HE3 H 1 7.704 0.003 . 1 . . . . A 108 TRP HE3 . 25979 1 1060 . 1 1 89 89 TRP HZ2 H 1 7.760 0.002 . 1 . . . . A 108 TRP HZ2 . 25979 1 1061 . 1 1 89 89 TRP HZ3 H 1 7.036 0.002 . 1 . . . . A 108 TRP HZ3 . 25979 1 1062 . 1 1 89 89 TRP HH2 H 1 7.371 0.003 . 1 . . . . A 108 TRP HH2 . 25979 1 1063 . 1 1 89 89 TRP C C 13 175.524 0.000 . 1 . . . . A 108 TRP C . 25979 1 1064 . 1 1 89 89 TRP CA C 13 52.918 0.000 . 1 . . . . A 108 TRP CA . 25979 1 1065 . 1 1 89 89 TRP CB C 13 30.525 0.000 . 1 . . . . A 108 TRP CB . 25979 1 1066 . 1 1 89 89 TRP CD1 C 13 127.472 0.000 . 1 . . . . A 108 TRP CD1 . 25979 1 1067 . 1 1 89 89 TRP CE3 C 13 123.388 0.000 . 1 . . . . A 108 TRP CE3 . 25979 1 1068 . 1 1 89 89 TRP CZ2 C 13 114.142 0.000 . 1 . . . . A 108 TRP CZ2 . 25979 1 1069 . 1 1 89 89 TRP CH2 C 13 124.497 0.000 . 1 . . . . A 108 TRP CH2 . 25979 1 1070 . 1 1 89 89 TRP N N 15 118.256 0.000 . 1 . . . . A 108 TRP N . 25979 1 1071 . 1 1 89 89 TRP NE1 N 15 129.573 0.000 . 1 . . . . A 108 TRP NE1 . 25979 1 1072 . 1 1 90 90 MET H H 1 9.250 0.000 . 1 . . . . A 109 MET H . 25979 1 1073 . 1 1 90 90 MET HA H 1 4.530 0.000 . 1 . . . . A 109 MET HA . 25979 1 1074 . 1 1 90 90 MET HB2 H 1 2.331 0.000 . 2 . . . . A 109 MET HB2 . 25979 1 1075 . 1 1 90 90 MET HB3 H 1 2.143 0.002 . 2 . . . . A 109 MET HB3 . 25979 1 1076 . 1 1 90 90 MET HG2 H 1 2.796 0.000 . 2 . . . . A 109 MET HG2 . 25979 1 1077 . 1 1 90 90 MET HG3 H 1 2.599 0.000 . 2 . . . . A 109 MET HG3 . 25979 1 1078 . 1 1 90 90 MET HE1 H 1 1.390 0.000 . 1 . . . . A 109 MET HE1 . 25979 1 1079 . 1 1 90 90 MET HE2 H 1 1.390 0.000 . 1 . . . . A 109 MET HE2 . 25979 1 1080 . 1 1 90 90 MET HE3 H 1 1.390 0.000 . 1 . . . . A 109 MET HE3 . 25979 1 1081 . 1 1 90 90 MET C C 13 175.999 0.000 . 1 . . . . A 109 MET C . 25979 1 1082 . 1 1 90 90 MET CA C 13 56.493 0.000 . 1 . . . . A 109 MET CA . 25979 1 1083 . 1 1 90 90 MET CB C 13 32.611 0.000 . 1 . . . . A 109 MET CB . 25979 1 1084 . 1 1 90 90 MET CE C 13 16.852 0.000 . 1 . . . . A 109 MET CE . 25979 1 1085 . 1 1 90 90 MET N N 15 120.599 0.000 . 1 . . . . A 109 MET N . 25979 1 1086 . 1 1 91 91 GLN H H 1 8.447 0.000 . 1 . . . . A 110 GLN H . 25979 1 1087 . 1 1 91 91 GLN HA H 1 4.335 0.000 . 1 . . . . A 110 GLN HA . 25979 1 1088 . 1 1 91 91 GLN C C 13 174.775 0.000 . 1 . . . . A 110 GLN C . 25979 1 1089 . 1 1 91 91 GLN CA C 13 53.793 0.000 . 1 . . . . A 110 GLN CA . 25979 1 1090 . 1 1 91 91 GLN CB C 13 29.020 0.000 . 1 . . . . A 110 GLN CB . 25979 1 1091 . 1 1 91 91 GLN N N 15 117.318 0.000 . 1 . . . . A 110 GLN N . 25979 1 1092 . 1 1 92 92 GLU H H 1 6.702 0.000 . 1 . . . . A 111 GLU H . 25979 1 1093 . 1 1 92 92 GLU HA H 1 4.372 0.007 . 1 . . . . A 111 GLU HA . 25979 1 1094 . 1 1 92 92 GLU HB2 H 1 2.652 0.005 . 2 . . . . A 111 GLU HB2 . 25979 1 1095 . 1 1 92 92 GLU HB3 H 1 1.800 0.004 . 2 . . . . A 111 GLU HB3 . 25979 1 1096 . 1 1 92 92 GLU HG2 H 1 2.922 0.006 . 2 . . . . A 111 GLU HG2 . 25979 1 1097 . 1 1 92 92 GLU HG3 H 1 2.835 0.002 . 2 . . . . A 111 GLU HG3 . 25979 1 1098 . 1 1 92 92 GLU C C 13 175.927 0.000 . 1 . . . . A 111 GLU C . 25979 1 1099 . 1 1 92 92 GLU CA C 13 54.283 0.000 . 1 . . . . A 111 GLU CA . 25979 1 1100 . 1 1 92 92 GLU CB C 13 30.350 0.000 . 1 . . . . A 111 GLU CB . 25979 1 1101 . 1 1 92 92 GLU CG C 13 36.124 0.038 . 1 . . . . A 111 GLU CG . 25979 1 1102 . 1 1 92 92 GLU N N 15 119.896 0.000 . 1 . . . . A 111 GLU N . 25979 1 1103 . 1 1 93 93 PRO HA H 1 4.249 0.000 . 1 . . . . A 112 PRO HA . 25979 1 1104 . 1 1 93 93 PRO HB2 H 1 2.323 0.000 . 2 . . . . A 112 PRO HB2 . 25979 1 1105 . 1 1 93 93 PRO HB3 H 1 1.989 0.000 . 2 . . . . A 112 PRO HB3 . 25979 1 1106 . 1 1 93 93 PRO HG2 H 1 2.183 0.000 . 2 . . . . A 112 PRO HG2 . 25979 1 1107 . 1 1 93 93 PRO HG3 H 1 1.896 0.000 . 2 . . . . A 112 PRO HG3 . 25979 1 1108 . 1 1 93 93 PRO HD2 H 1 4.076 0.004 . 2 . . . . A 112 PRO HD2 . 25979 1 1109 . 1 1 93 93 PRO HD3 H 1 3.998 0.002 . 2 . . . . A 112 PRO HD3 . 25979 1 1110 . 1 1 93 93 PRO C C 13 177.295 0.000 . 1 . . . . A 112 PRO C . 25979 1 1111 . 1 1 93 93 PRO CA C 13 65.312 0.000 . 1 . . . . A 112 PRO CA . 25979 1 1112 . 1 1 93 93 PRO CB C 13 33.068 0.000 . 1 . . . . A 112 PRO CB . 25979 1 1113 . 1 1 93 93 PRO CG C 13 27.682 0.000 . 1 . . . . A 112 PRO CG . 25979 1 1114 . 1 1 93 93 PRO CD C 13 48.996 0.000 . 1 . . . . A 112 PRO CD . 25979 1 1115 . 1 1 94 94 LYS H H 1 8.040 0.000 . 1 . . . . A 113 LYS H . 25979 1 1116 . 1 1 94 94 LYS HA H 1 4.779 0.000 . 1 . . . . A 113 LYS HA . 25979 1 1117 . 1 1 94 94 LYS HB2 H 1 2.046 0.000 . 2 . . . . A 113 LYS HB2 . 25979 1 1118 . 1 1 94 94 LYS HB3 H 1 1.914 0.000 . 2 . . . . A 113 LYS HB3 . 25979 1 1119 . 1 1 94 94 LYS HG2 H 1 1.563 0.000 . 2 . . . . A 113 LYS HG2 . 25979 1 1120 . 1 1 94 94 LYS HG3 H 1 1.469 0.000 . 2 . . . . A 113 LYS HG3 . 25979 1 1121 . 1 1 94 94 LYS HD2 H 1 1.757 0.004 . 2 . . . . A 113 LYS HD2 . 25979 1 1122 . 1 1 94 94 LYS HE2 H 1 3.041 0.004 . 2 . . . . A 113 LYS HE2 . 25979 1 1123 . 1 1 94 94 LYS C C 13 177.754 0.000 . 1 . . . . A 113 LYS C . 25979 1 1124 . 1 1 94 94 LYS CA C 13 54.518 0.000 . 1 . . . . A 113 LYS CA . 25979 1 1125 . 1 1 94 94 LYS CB C 13 33.587 0.000 . 1 . . . . A 113 LYS CB . 25979 1 1126 . 1 1 94 94 LYS CG C 13 24.929 0.000 . 1 . . . . A 113 LYS CG . 25979 1 1127 . 1 1 94 94 LYS CD C 13 28.976 0.000 . 1 . . . . A 113 LYS CD . 25979 1 1128 . 1 1 94 94 LYS CE C 13 41.903 0.000 . 1 . . . . A 113 LYS CE . 25979 1 1129 . 1 1 94 94 LYS N N 15 114.272 0.000 . 1 . . . . A 113 LYS N . 25979 1 1130 . 1 1 95 95 THR H H 1 8.680 0.000 . 1 . . . . A 114 THR H . 25979 1 1131 . 1 1 95 95 THR HA H 1 4.331 0.005 . 1 . . . . A 114 THR HA . 25979 1 1132 . 1 1 95 95 THR HB H 1 4.489 0.005 . 1 . . . . A 114 THR HB . 25979 1 1133 . 1 1 95 95 THR HG21 H 1 1.233 0.003 . 1 . . . . A 114 THR HG21 . 25979 1 1134 . 1 1 95 95 THR HG22 H 1 1.233 0.003 . 1 . . . . A 114 THR HG22 . 25979 1 1135 . 1 1 95 95 THR HG23 H 1 1.233 0.003 . 1 . . . . A 114 THR HG23 . 25979 1 1136 . 1 1 95 95 THR C C 13 177.024 0.000 . 1 . . . . A 114 THR C . 25979 1 1137 . 1 1 95 95 THR CA C 13 62.464 0.000 . 1 . . . . A 114 THR CA . 25979 1 1138 . 1 1 95 95 THR CB C 13 69.539 0.000 . 1 . . . . A 114 THR CB . 25979 1 1139 . 1 1 95 95 THR CG2 C 13 20.751 0.000 . 1 . . . . A 114 THR CG2 . 25979 1 1140 . 1 1 95 95 THR N N 15 111.460 0.000 . 1 . . . . A 114 THR N . 25979 1 1141 . 1 1 96 96 ASP H H 1 8.251 0.000 . 1 . . . . A 115 ASP H . 25979 1 1142 . 1 1 96 96 ASP HA H 1 4.286 0.000 . 1 . . . . A 115 ASP HA . 25979 1 1143 . 1 1 96 96 ASP HB2 H 1 2.723 0.002 . 2 . . . . A 115 ASP HB2 . 25979 1 1144 . 1 1 96 96 ASP HB3 H 1 2.659 0.001 . 2 . . . . A 115 ASP HB3 . 25979 1 1145 . 1 1 96 96 ASP C C 13 176.733 0.000 . 1 . . . . A 115 ASP C . 25979 1 1146 . 1 1 96 96 ASP CA C 13 56.519 0.000 . 1 . . . . A 115 ASP CA . 25979 1 1147 . 1 1 96 96 ASP CB C 13 40.213 0.000 . 1 . . . . A 115 ASP CB . 25979 1 1148 . 1 1 96 96 ASP N N 15 119.662 0.000 . 1 . . . . A 115 ASP N . 25979 1 1149 . 1 1 97 97 GLN H H 1 8.231 0.000 . 1 . . . . A 116 GLN H . 25979 1 1150 . 1 1 97 97 GLN HA H 1 4.417 0.000 . 1 . . . . A 116 GLN HA . 25979 1 1151 . 1 1 97 97 GLN HB2 H 1 1.734 0.000 . 2 . . . . A 116 GLN HB2 . 25979 1 1152 . 1 1 97 97 GLN HB3 H 1 1.628 0.000 . 2 . . . . A 116 GLN HB3 . 25979 1 1153 . 1 1 97 97 GLN HG2 H 1 2.178 0.000 . 2 . . . . A 116 GLN HG2 . 25979 1 1154 . 1 1 97 97 GLN HG3 H 1 2.111 0.000 . 2 . . . . A 116 GLN HG3 . 25979 1 1155 . 1 1 97 97 GLN HE21 H 1 6.774 0.007 . 2 . . . . A 116 GLN HE21 . 25979 1 1156 . 1 1 97 97 GLN HE22 H 1 7.481 0.003 . 2 . . . . A 116 GLN HE22 . 25979 1 1157 . 1 1 97 97 GLN C C 13 175.153 0.000 . 1 . . . . A 116 GLN C . 25979 1 1158 . 1 1 97 97 GLN CA C 13 55.022 0.000 . 1 . . . . A 116 GLN CA . 25979 1 1159 . 1 1 97 97 GLN CB C 13 29.398 0.000 . 1 . . . . A 116 GLN CB . 25979 1 1160 . 1 1 97 97 GLN CG C 13 34.422 0.000 . 1 . . . . A 116 GLN CG . 25979 1 1161 . 1 1 97 97 GLN N N 15 115.209 0.000 . 1 . . . . A 116 GLN N . 25979 1 1162 . 1 1 97 97 GLN NE2 N 15 112.514 0.000 . 1 . . . . A 116 GLN NE2 . 25979 1 1163 . 1 1 98 98 ASP H H 1 7.638 0.002 . 1 . . . . A 117 ASP H . 25979 1 1164 . 1 1 98 98 ASP HA H 1 3.987 0.001 . 1 . . . . A 117 ASP HA . 25979 1 1165 . 1 1 98 98 ASP HB2 H 1 3.004 0.001 . 2 . . . . A 117 ASP HB2 . 25979 1 1166 . 1 1 98 98 ASP HB3 H 1 2.838 0.002 . 2 . . . . A 117 ASP HB3 . 25979 1 1167 . 1 1 98 98 ASP C C 13 177.381 0.000 . 1 . . . . A 117 ASP C . 25979 1 1168 . 1 1 98 98 ASP CA C 13 58.820 0.000 . 1 . . . . A 117 ASP CA . 25979 1 1169 . 1 1 98 98 ASP CB C 13 38.989 0.000 . 1 . . . . A 117 ASP CB . 25979 1 1170 . 1 1 98 98 ASP N N 15 122.471 0.009 . 1 . . . . A 117 ASP N . 25979 1 1171 . 1 1 99 99 GLU H H 1 8.329 0.000 . 1 . . . . A 118 GLU H . 25979 1 1172 . 1 1 99 99 GLU HA H 1 4.079 0.000 . 1 . . . . A 118 GLU HA . 25979 1 1173 . 1 1 99 99 GLU HB2 H 1 2.059 0.008 . 2 . . . . A 118 GLU HB2 . 25979 1 1174 . 1 1 99 99 GLU HG2 H 1 2.417 0.000 . 2 . . . . A 118 GLU HG2 . 25979 1 1175 . 1 1 99 99 GLU HG3 H 1 2.320 0.000 . 2 . . . . A 118 GLU HG3 . 25979 1 1176 . 1 1 99 99 GLU C C 13 179.239 0.000 . 1 . . . . A 118 GLU C . 25979 1 1177 . 1 1 99 99 GLU CA C 13 59.229 0.000 . 1 . . . . A 118 GLU CA . 25979 1 1178 . 1 1 99 99 GLU CB C 13 28.885 0.000 . 1 . . . . A 118 GLU CB . 25979 1 1179 . 1 1 99 99 GLU CG C 13 36.831 0.000 . 1 . . . . A 118 GLU CG . 25979 1 1180 . 1 1 99 99 GLU N N 15 116.849 0.000 . 1 . . . . A 118 GLU N . 25979 1 1181 . 1 1 100 100 GLU H H 1 7.932 0.000 . 1 . . . . A 119 GLU H . 25979 1 1182 . 1 1 100 100 GLU HA H 1 4.171 0.007 . 1 . . . . A 119 GLU HA . 25979 1 1183 . 1 1 100 100 GLU HB2 H 1 1.988 0.001 . 2 . . . . A 119 GLU HB2 . 25979 1 1184 . 1 1 100 100 GLU HB3 H 1 1.746 0.006 . 2 . . . . A 119 GLU HB3 . 25979 1 1185 . 1 1 100 100 GLU HG2 H 1 2.217 0.002 . 2 . . . . A 119 GLU HG2 . 25979 1 1186 . 1 1 100 100 GLU HG3 H 1 2.158 0.010 . 2 . . . . A 119 GLU HG3 . 25979 1 1187 . 1 1 100 100 GLU C C 13 178.332 0.000 . 1 . . . . A 119 GLU C . 25979 1 1188 . 1 1 100 100 GLU CA C 13 58.740 0.000 . 1 . . . . A 119 GLU CA . 25979 1 1189 . 1 1 100 100 GLU CB C 13 28.842 0.000 . 1 . . . . A 119 GLU CB . 25979 1 1190 . 1 1 100 100 GLU CG C 13 35.096 0.000 . 1 . . . . A 119 GLU CG . 25979 1 1191 . 1 1 100 100 GLU N N 15 122.942 0.000 . 1 . . . . A 119 GLU N . 25979 1 1192 . 1 1 101 101 HIS H H 1 8.594 0.000 . 1 . . . . A 120 HIS H . 25979 1 1193 . 1 1 101 101 HIS HA H 1 4.238 0.001 . 1 . . . . A 120 HIS HA . 25979 1 1194 . 1 1 101 101 HIS HD2 H 1 6.585 0.002 . 1 . . . . A 120 HIS HD2 . 25979 1 1195 . 1 1 101 101 HIS HE1 H 1 7.615 0.002 . 1 . . . . A 120 HIS HE1 . 25979 1 1196 . 1 1 101 101 HIS C C 13 176.575 0.000 . 1 . . . . A 120 HIS C . 25979 1 1197 . 1 1 101 101 HIS CA C 13 58.815 0.000 . 1 . . . . A 120 HIS CA . 25979 1 1198 . 1 1 101 101 HIS CB C 13 28.397 0.000 . 1 . . . . A 120 HIS CB . 25979 1 1199 . 1 1 101 101 HIS CD2 C 13 120.475 0.000 . 1 . . . . A 120 HIS CD2 . 25979 1 1200 . 1 1 101 101 HIS CE1 C 13 138.017 0.000 . 1 . . . . A 120 HIS CE1 . 25979 1 1201 . 1 1 101 101 HIS N N 15 118.734 0.000 . 1 . . . . A 120 HIS N . 25979 1 1202 . 1 1 102 102 CYS H H 1 7.936 0.000 . 1 . . . . A 121 CYS H . 25979 1 1203 . 1 1 102 102 CYS HA H 1 3.988 0.000 . 1 . . . . A 121 CYS HA . 25979 1 1204 . 1 1 102 102 CYS HB2 H 1 3.240 0.000 . 2 . . . . A 121 CYS HB2 . 25979 1 1205 . 1 1 102 102 CYS HB3 H 1 2.610 0.000 . 2 . . . . A 121 CYS HB3 . 25979 1 1206 . 1 1 102 102 CYS C C 13 176.503 0.000 . 1 . . . . A 121 CYS C . 25979 1 1207 . 1 1 102 102 CYS CA C 13 62.110 0.000 . 1 . . . . A 121 CYS CA . 25979 1 1208 . 1 1 102 102 CYS CB C 13 26.439 0.000 . 1 . . . . A 121 CYS CB . 25979 1 1209 . 1 1 102 102 CYS N N 15 117.562 0.000 . 1 . . . . A 121 CYS N . 25979 1 1210 . 1 1 103 103 ARG H H 1 8.482 0.000 . 1 . . . . A 122 ARG H . 25979 1 1211 . 1 1 103 103 ARG HA H 1 4.181 0.000 . 1 . . . . A 122 ARG HA . 25979 1 1212 . 1 1 103 103 ARG HE H 1 7.725 0.000 . 1 . . . . A 122 ARG HE . 25979 1 1213 . 1 1 103 103 ARG HB2 H 1 2.023 0.000 . 2 . . . . A 122 ARG HB2 . 25979 1 1214 . 1 1 103 103 ARG HG2 H 1 1.777 0.000 . 2 . . . . A 122 ARG HG2 . 25979 1 1215 . 1 1 103 103 ARG HG3 H 1 1.576 0.000 . 2 . . . . A 122 ARG HG3 . 25979 1 1216 . 1 1 103 103 ARG HD2 H 1 3.182 0.000 . 2 . . . . A 122 ARG HD2 . 25979 1 1217 . 1 1 103 103 ARG HD3 H 1 3.282 0.000 . 2 . . . . A 122 ARG HD3 . 25979 1 1218 . 1 1 103 103 ARG C C 13 179.642 0.000 . 1 . . . . A 122 ARG C . 25979 1 1219 . 1 1 103 103 ARG CA C 13 60.036 0.000 . 1 . . . . A 122 ARG CA . 25979 1 1220 . 1 1 103 103 ARG CB C 13 30.010 0.000 . 1 . . . . A 122 ARG CB . 25979 1 1221 . 1 1 103 103 ARG CG C 13 27.635 0.000 . 1 . . . . A 122 ARG CG . 25979 1 1222 . 1 1 103 103 ARG CD C 13 42.887 0.000 . 1 . . . . A 122 ARG CD . 25979 1 1223 . 1 1 103 103 ARG N N 15 120.609 0.000 . 1 . . . . A 122 ARG N . 25979 1 1224 . 1 1 103 103 ARG NE N 15 83.469 0.000 . 1 . . . . A 122 ARG NE . 25979 1 1225 . 1 1 104 104 LYS H H 1 8.643 0.000 . 1 . . . . A 123 LYS H . 25979 1 1226 . 1 1 104 104 LYS HA H 1 3.818 0.000 . 1 . . . . A 123 LYS HA . 25979 1 1227 . 1 1 104 104 LYS HB2 H 1 2.157 0.000 . 2 . . . . A 123 LYS HB2 . 25979 1 1228 . 1 1 104 104 LYS HB3 H 1 1.755 0.004 . 2 . . . . A 123 LYS HB3 . 25979 1 1229 . 1 1 104 104 LYS HG2 H 1 1.792 0.007 . 2 . . . . A 123 LYS HG2 . 25979 1 1230 . 1 1 104 104 LYS HG3 H 1 1.477 0.009 . 2 . . . . A 123 LYS HG3 . 25979 1 1231 . 1 1 104 104 LYS HD2 H 1 1.906 0.004 . 2 . . . . A 123 LYS HD2 . 25979 1 1232 . 1 1 104 104 LYS HD3 H 1 1.732 0.005 . 2 . . . . A 123 LYS HD3 . 25979 1 1233 . 1 1 104 104 LYS HE2 H 1 3.049 0.000 . 2 . . . . A 123 LYS HE2 . 25979 1 1234 . 1 1 104 104 LYS C C 13 178.015 0.000 . 1 . . . . A 123 LYS C . 25979 1 1235 . 1 1 104 104 LYS CA C 13 59.377 0.000 . 1 . . . . A 123 LYS CA . 25979 1 1236 . 1 1 104 104 LYS CB C 13 32.696 0.000 . 1 . . . . A 123 LYS CB . 25979 1 1237 . 1 1 104 104 LYS CG C 13 26.211 0.056 . 1 . . . . A 123 LYS CG . 25979 1 1238 . 1 1 104 104 LYS CD C 13 29.439 0.000 . 1 . . . . A 123 LYS CD . 25979 1 1239 . 1 1 104 104 LYS CE C 13 42.395 0.000 . 1 . . . . A 123 LYS CE . 25979 1 1240 . 1 1 104 104 LYS N N 15 118.959 0.000 . 1 . . . . A 123 LYS N . 25979 1 1241 . 1 1 105 105 VAL H H 1 8.167 0.000 . 1 . . . . A 124 VAL H . 25979 1 1242 . 1 1 105 105 VAL HA H 1 3.435 0.000 . 1 . . . . A 124 VAL HA . 25979 1 1243 . 1 1 105 105 VAL HB H 1 2.057 0.000 . 1 . . . . A 124 VAL HB . 25979 1 1244 . 1 1 105 105 VAL HG11 H 1 0.738 0.004 . 2 . . . . A 124 VAL HG11 . 25979 1 1245 . 1 1 105 105 VAL HG12 H 1 0.738 0.004 . 2 . . . . A 124 VAL HG12 . 25979 1 1246 . 1 1 105 105 VAL HG13 H 1 0.738 0.004 . 2 . . . . A 124 VAL HG13 . 25979 1 1247 . 1 1 105 105 VAL HG21 H 1 0.340 0.000 . 2 . . . . A 124 VAL HG21 . 25979 1 1248 . 1 1 105 105 VAL HG22 H 1 0.340 0.000 . 2 . . . . A 124 VAL HG22 . 25979 1 1249 . 1 1 105 105 VAL HG23 H 1 0.340 0.000 . 2 . . . . A 124 VAL HG23 . 25979 1 1250 . 1 1 105 105 VAL C C 13 176.834 0.000 . 1 . . . . A 124 VAL C . 25979 1 1251 . 1 1 105 105 VAL CA C 13 67.267 0.000 . 1 . . . . A 124 VAL CA . 25979 1 1252 . 1 1 105 105 VAL CB C 13 31.048 0.000 . 1 . . . . A 124 VAL CB . 25979 1 1253 . 1 1 105 105 VAL CG1 C 13 22.678 0.000 . 2 . . . . A 124 VAL CG1 . 25979 1 1254 . 1 1 105 105 VAL CG2 C 13 21.381 0.000 . 2 . . . . A 124 VAL CG2 . 25979 1 1255 . 1 1 105 105 VAL N N 15 118.021 0.000 . 1 . . . . A 124 VAL N . 25979 1 1256 . 1 1 106 106 ASN H H 1 7.511 0.000 . 1 . . . . A 125 ASN H . 25979 1 1257 . 1 1 106 106 ASN HA H 1 4.233 0.000 . 1 . . . . A 125 ASN HA . 25979 1 1258 . 1 1 106 106 ASN HB2 H 1 2.892 0.000 . 2 . . . . A 125 ASN HB2 . 25979 1 1259 . 1 1 106 106 ASN HB3 H 1 2.813 0.000 . 2 . . . . A 125 ASN HB3 . 25979 1 1260 . 1 1 106 106 ASN HD21 H 1 8.933 0.000 . 2 . . . . A 125 ASN HD21 . 25979 1 1261 . 1 1 106 106 ASN HD22 H 1 7.446 0.000 . 2 . . . . A 125 ASN HD22 . 25979 1 1262 . 1 1 106 106 ASN C C 13 177.122 0.000 . 1 . . . . A 125 ASN C . 25979 1 1263 . 1 1 106 106 ASN CA C 13 58.116 0.000 . 1 . . . . A 125 ASN CA . 25979 1 1264 . 1 1 106 106 ASN CB C 13 39.892 0.000 . 1 . . . . A 125 ASN CB . 25979 1 1265 . 1 1 106 106 ASN N N 15 113.569 0.000 . 1 . . . . A 125 ASN N . 25979 1 1266 . 1 1 106 106 ASN ND2 N 15 120.029 0.000 . 1 . . . . A 125 ASN ND2 . 25979 1 1267 . 1 1 107 107 GLU H H 1 8.431 0.000 . 1 . . . . A 126 GLU H . 25979 1 1268 . 1 1 107 107 GLU HA H 1 3.989 0.000 . 1 . . . . A 126 GLU HA . 25979 1 1269 . 1 1 107 107 GLU HB2 H 1 1.905 0.000 . 2 . . . . A 126 GLU HB2 . 25979 1 1270 . 1 1 107 107 GLU HB3 H 1 1.725 0.005 . 2 . . . . A 126 GLU HB3 . 25979 1 1271 . 1 1 107 107 GLU HG2 H 1 2.155 0.004 . 2 . . . . A 126 GLU HG2 . 25979 1 1272 . 1 1 107 107 GLU HG3 H 1 1.918 0.004 . 2 . . . . A 126 GLU HG3 . 25979 1 1273 . 1 1 107 107 GLU C C 13 178.346 0.000 . 1 . . . . A 126 GLU C . 25979 1 1274 . 1 1 107 107 GLU CA C 13 59.359 0.000 . 1 . . . . A 126 GLU CA . 25979 1 1275 . 1 1 107 107 GLU CB C 13 29.333 0.000 . 1 . . . . A 126 GLU CB . 25979 1 1276 . 1 1 107 107 GLU CG C 13 35.413 0.000 . 1 . . . . A 126 GLU CG . 25979 1 1277 . 1 1 107 107 GLU N N 15 119.662 0.000 . 1 . . . . A 126 GLU N . 25979 1 1278 . 1 1 108 108 TYR H H 1 8.262 0.000 . 1 . . . . A 127 TYR H . 25979 1 1279 . 1 1 108 108 TYR HA H 1 4.389 0.000 . 1 . . . . A 127 TYR HA . 25979 1 1280 . 1 1 108 108 TYR HB2 H 1 2.916 0.000 . 2 . . . . A 127 TYR HB2 . 25979 1 1281 . 1 1 108 108 TYR HB3 H 1 2.744 0.000 . 2 . . . . A 127 TYR HB3 . 25979 1 1282 . 1 1 108 108 TYR HD1 H 1 6.991 0.002 . 3 . . . . A 127 TYR HD1 . 25979 1 1283 . 1 1 108 108 TYR HE1 H 1 6.755 0.001 . 3 . . . . A 127 TYR HE1 . 25979 1 1284 . 1 1 108 108 TYR C C 13 176.244 0.000 . 1 . . . . A 127 TYR C . 25979 1 1285 . 1 1 108 108 TYR CA C 13 60.775 0.000 . 1 . . . . A 127 TYR CA . 25979 1 1286 . 1 1 108 108 TYR CB C 13 37.750 0.000 . 1 . . . . A 127 TYR CB . 25979 1 1287 . 1 1 108 108 TYR CD1 C 13 132.339 0.000 . 3 . . . . A 127 TYR CD1 . 25979 1 1288 . 1 1 108 108 TYR CE1 C 13 118.230 0.000 . 3 . . . . A 127 TYR CE1 . 25979 1 1289 . 1 1 108 108 TYR N N 15 115.912 0.000 . 1 . . . . A 127 TYR N . 25979 1 1290 . 1 1 109 109 LEU H H 1 7.810 0.000 . 1 . . . . A 128 LEU H . 25979 1 1291 . 1 1 109 109 LEU HA H 1 4.069 0.000 . 1 . . . . A 128 LEU HA . 25979 1 1292 . 1 1 109 109 LEU HB2 H 1 1.626 0.000 . 2 . . . . A 128 LEU HB2 . 25979 1 1293 . 1 1 109 109 LEU HB3 H 1 1.408 0.000 . 2 . . . . A 128 LEU HB3 . 25979 1 1294 . 1 1 109 109 LEU HG H 1 2.205 0.004 . 1 . . . . A 128 LEU HG . 25979 1 1295 . 1 1 109 109 LEU HD11 H 1 0.648 0.000 . 2 . . . . A 128 LEU HD11 . 25979 1 1296 . 1 1 109 109 LEU HD12 H 1 0.648 0.000 . 2 . . . . A 128 LEU HD12 . 25979 1 1297 . 1 1 109 109 LEU HD13 H 1 0.648 0.000 . 2 . . . . A 128 LEU HD13 . 25979 1 1298 . 1 1 109 109 LEU HD21 H 1 0.506 0.000 . 2 . . . . A 128 LEU HD21 . 25979 1 1299 . 1 1 109 109 LEU HD22 H 1 0.506 0.000 . 2 . . . . A 128 LEU HD22 . 25979 1 1300 . 1 1 109 109 LEU HD23 H 1 0.506 0.000 . 2 . . . . A 128 LEU HD23 . 25979 1 1301 . 1 1 109 109 LEU C C 13 178.822 0.000 . 1 . . . . A 128 LEU C . 25979 1 1302 . 1 1 109 109 LEU CA C 13 57.099 0.000 . 1 . . . . A 128 LEU CA . 25979 1 1303 . 1 1 109 109 LEU CB C 13 40.779 0.000 . 1 . . . . A 128 LEU CB . 25979 1 1304 . 1 1 109 109 LEU CG C 13 25.585 0.000 . 1 . . . . A 128 LEU CG . 25979 1 1305 . 1 1 109 109 LEU CD1 C 13 22.445 0.000 . 2 . . . . A 128 LEU CD1 . 25979 1 1306 . 1 1 109 109 LEU CD2 C 13 25.913 0.000 . 2 . . . . A 128 LEU CD2 . 25979 1 1307 . 1 1 109 109 LEU N N 15 111.225 0.000 . 1 . . . . A 128 LEU N . 25979 1 1308 . 1 1 110 110 ASN H H 1 7.426 0.000 . 1 . . . . A 129 ASN H . 25979 1 1309 . 1 1 110 110 ASN HA H 1 4.990 0.000 . 1 . . . . A 129 ASN HA . 25979 1 1310 . 1 1 110 110 ASN HB2 H 1 2.885 0.000 . 2 . . . . A 129 ASN HB2 . 25979 1 1311 . 1 1 110 110 ASN HD21 H 1 7.161 0.000 . 2 . . . . A 129 ASN HD21 . 25979 1 1312 . 1 1 110 110 ASN HD22 H 1 7.673 0.003 . 2 . . . . A 129 ASN HD22 . 25979 1 1313 . 1 1 110 110 ASN C C 13 174.617 0.000 . 1 . . . . A 129 ASN C . 25979 1 1314 . 1 1 110 110 ASN CA C 13 54.362 0.000 . 1 . . . . A 129 ASN CA . 25979 1 1315 . 1 1 110 110 ASN CB C 13 40.151 0.000 . 1 . . . . A 129 ASN CB . 25979 1 1316 . 1 1 110 110 ASN N N 15 110.757 0.000 . 1 . . . . A 129 ASN N . 25979 1 1317 . 1 1 110 110 ASN ND2 N 15 114.951 0.000 . 1 . . . . A 129 ASN ND2 . 25979 1 1318 . 1 1 111 111 ASN H H 1 8.374 0.000 . 1 . . . . A 130 ASN H . 25979 1 1319 . 1 1 111 111 ASN HA H 1 5.086 0.000 . 1 . . . . A 130 ASN HA . 25979 1 1320 . 1 1 111 111 ASN HB2 H 1 2.820 0.008 . 2 . . . . A 130 ASN HB2 . 25979 1 1321 . 1 1 111 111 ASN HB3 H 1 2.694 0.034 . 2 . . . . A 130 ASN HB3 . 25979 1 1322 . 1 1 111 111 ASN HD21 H 1 6.820 0.003 . 2 . . . . A 130 ASN HD21 . 25979 1 1323 . 1 1 111 111 ASN HD22 H 1 7.608 0.002 . 2 . . . . A 130 ASN HD22 . 25979 1 1324 . 1 1 111 111 ASN C C 13 170.484 0.000 . 1 . . . . A 130 ASN C . 25979 1 1325 . 1 1 111 111 ASN CA C 13 51.671 0.000 . 1 . . . . A 130 ASN CA . 25979 1 1326 . 1 1 111 111 ASN CB C 13 38.975 0.000 . 1 . . . . A 130 ASN CB . 25979 1 1327 . 1 1 111 111 ASN N N 15 119.896 0.000 . 1 . . . . A 130 ASN N . 25979 1 1328 . 1 1 111 111 ASN ND2 N 15 112.717 0.000 . 1 . . . . A 130 ASN ND2 . 25979 1 1329 . 1 1 112 112 PRO HA H 1 4.734 0.004 . 1 . . . . A 131 PRO HA . 25979 1 1330 . 1 1 112 112 PRO HB2 H 1 2.599 0.007 . 2 . . . . A 131 PRO HB2 . 25979 1 1331 . 1 1 112 112 PRO HB3 H 1 1.919 0.007 . 2 . . . . A 131 PRO HB3 . 25979 1 1332 . 1 1 112 112 PRO HG2 H 1 2.111 0.008 . 2 . . . . A 131 PRO HG2 . 25979 1 1333 . 1 1 112 112 PRO HG3 H 1 2.027 0.006 . 2 . . . . A 131 PRO HG3 . 25979 1 1334 . 1 1 112 112 PRO HD2 H 1 3.576 0.005 . 2 . . . . A 131 PRO HD2 . 25979 1 1335 . 1 1 112 112 PRO HD3 H 1 3.336 0.005 . 2 . . . . A 131 PRO HD3 . 25979 1 1336 . 1 1 112 112 PRO CA C 13 61.682 0.000 . 1 . . . . A 131 PRO CA . 25979 1 1337 . 1 1 112 112 PRO CB C 13 30.833 0.000 . 1 . . . . A 131 PRO CB . 25979 1 1338 . 1 1 112 112 PRO CG C 13 27.225 0.000 . 1 . . . . A 131 PRO CG . 25979 1 1339 . 1 1 112 112 PRO CD C 13 49.931 0.016 . 1 . . . . A 131 PRO CD . 25979 1 1340 . 1 1 113 113 PRO HA H 1 4.492 0.005 . 1 . . . . A 132 PRO HA . 25979 1 1341 . 1 1 113 113 PRO HB2 H 1 2.312 0.006 . 2 . . . . A 132 PRO HB2 . 25979 1 1342 . 1 1 113 113 PRO HB3 H 1 2.063 0.006 . 2 . . . . A 132 PRO HB3 . 25979 1 1343 . 1 1 113 113 PRO HG2 H 1 2.083 0.005 . 2 . . . . A 132 PRO HG2 . 25979 1 1344 . 1 1 113 113 PRO HG3 H 1 2.028 0.004 . 2 . . . . A 132 PRO HG3 . 25979 1 1345 . 1 1 113 113 PRO HD2 H 1 3.850 0.005 . 2 . . . . A 132 PRO HD2 . 25979 1 1346 . 1 1 113 113 PRO HD3 H 1 3.525 0.005 . 2 . . . . A 132 PRO HD3 . 25979 1 1347 . 1 1 113 113 PRO C C 13 176.532 0.000 . 1 . . . . A 132 PRO C . 25979 1 1348 . 1 1 113 113 PRO CA C 13 62.419 0.000 . 1 . . . . A 132 PRO CA . 25979 1 1349 . 1 1 113 113 PRO CB C 13 31.571 0.000 . 1 . . . . A 132 PRO CB . 25979 1 1350 . 1 1 113 113 PRO CG C 13 27.682 0.000 . 1 . . . . A 132 PRO CG . 25979 1 1351 . 1 1 113 113 PRO CD C 13 50.203 0.000 . 1 . . . . A 132 PRO CD . 25979 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 25979 _Assigned_chem_shift_list.ID 2 _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 2 '3D HNCACB' 1 $sample_1 isotropic 25979 2 3 '3D CBCA(CO)NH' 1 $sample_1 isotropic 25979 2 4 '3D HNCO' 1 $sample_1 isotropic 25979 2 5 '3D 1H-15N NOESY' 1 $sample_1 isotropic 25979 2 6 '3D 1H-13C NOESY aliphatic' 2 $sample_2 isotropic 25979 2 9 '3D HN(CA)CO' 1 $sample_1 isotropic 25979 2 10 '3D half-filtered NOESY' 2 $sample_2 isotropic 25979 2 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.Ambiguity_set_ID _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 . 2 2 1 1 GLN HA H 1 4.459 0.003 . 1 . . . . B 940 GLN HA . 25979 2 2 . 2 2 1 1 GLN HB2 H 1 2.200 0.006 . 2 . . . . B 940 GLN HB2 . 25979 2 3 . 2 2 1 1 GLN HB3 H 1 2.042 0.003 . 2 . . . . B 940 GLN HB3 . 25979 2 4 . 2 2 1 1 GLN HG2 H 1 2.429 0.008 . 2 . . . . B 940 GLN HG2 . 25979 2 5 . 2 2 1 1 GLN HE21 H 1 7.643 0.000 . 2 . . . . B 940 GLN HE21 . 25979 2 6 . 2 2 1 1 GLN HE22 H 1 6.894 0.000 . 2 . . . . B 940 GLN HE22 . 25979 2 7 . 2 2 1 1 GLN CA C 13 55.434 0.000 . 1 . . . . B 940 GLN CA . 25979 2 8 . 2 2 1 1 GLN CB C 13 29.708 0.000 . 1 . . . . B 940 GLN CB . 25979 2 9 . 2 2 1 1 GLN CG C 13 33.371 0.000 . 1 . . . . B 940 GLN CG . 25979 2 10 . 2 2 1 1 GLN N N 15 121.776 0.000 . 1 . . . . B 940 GLN N . 25979 2 11 . 2 2 1 1 GLN NE2 N 15 113.274 0.000 . 1 . . . . B 940 GLN NE2 . 25979 2 12 . 2 2 2 2 GLU H H 1 8.441 0.001 . 1 . . . . B 941 GLU H . 25979 2 13 . 2 2 2 2 GLU HA H 1 4.266 0.007 . 1 . . . . B 941 GLU HA . 25979 2 14 . 2 2 2 2 GLU HB2 H 1 2.225 0.008 . 2 . . . . B 941 GLU HB2 . 25979 2 15 . 2 2 2 2 GLU HB3 H 1 1.812 0.002 . 2 . . . . B 941 GLU HB3 . 25979 2 16 . 2 2 2 2 GLU HG2 H 1 2.568 0.004 . 2 . . . . B 941 GLU HG2 . 25979 2 17 . 2 2 2 2 GLU HG3 H 1 2.472 0.003 . 2 . . . . B 941 GLU HG3 . 25979 2 18 . 2 2 2 2 GLU CA C 13 55.317 0.000 . 1 . . . . B 941 GLU CA . 25979 2 19 . 2 2 2 2 GLU CB C 13 29.155 0.018 . 1 . . . . B 941 GLU CB . 25979 2 20 . 2 2 2 2 GLU CG C 13 36.462 0.000 . 1 . . . . B 941 GLU CG . 25979 2 21 . 2 2 2 2 GLU N N 15 121.990 0.000 . 1 . . . . B 941 GLU N . 25979 2 22 . 2 2 3 3 PRO HA H 1 4.574 0.000 . 1 . . . . B 942 PRO HA . 25979 2 23 . 2 2 3 3 PRO HB2 H 1 2.559 0.006 . 2 . . . . B 942 PRO HB2 . 25979 2 24 . 2 2 3 3 PRO HB3 H 1 2.328 0.005 . 2 . . . . B 942 PRO HB3 . 25979 2 25 . 2 2 3 3 PRO HG2 H 1 2.179 0.005 . 2 . . . . B 942 PRO HG2 . 25979 2 26 . 2 2 3 3 PRO HG3 H 1 2.101 0.001 . 2 . . . . B 942 PRO HG3 . 25979 2 27 . 2 2 3 3 PRO HD2 H 1 3.641 0.007 . 2 . . . . B 942 PRO HD2 . 25979 2 28 . 2 2 3 3 PRO HD3 H 1 3.545 0.006 . 2 . . . . B 942 PRO HD3 . 25979 2 29 . 2 2 3 3 PRO C C 13 176.045 0.000 . 1 . . . . B 942 PRO C . 25979 2 30 . 2 2 3 3 PRO CA C 13 62.888 0.000 . 1 . . . . B 942 PRO CA . 25979 2 31 . 2 2 3 3 PRO CB C 13 32.527 0.000 . 1 . . . . B 942 PRO CB . 25979 2 32 . 2 2 3 3 PRO CG C 13 28.030 0.000 . 1 . . . . B 942 PRO CG . 25979 2 33 . 2 2 3 3 PRO CD C 13 50.539 0.000 . 1 . . . . B 942 PRO CD . 25979 2 34 . 2 2 4 4 GLU H H 1 8.360 0.000 . 1 . . . . B 943 GLU H . 25979 2 35 . 2 2 4 4 GLU HA H 1 4.644 0.010 . 1 . . . . B 943 GLU HA . 25979 2 36 . 2 2 4 4 GLU HB2 H 1 2.120 0.004 . 2 . . . . B 943 GLU HB2 . 25979 2 37 . 2 2 4 4 GLU HB3 H 1 1.782 0.012 . 2 . . . . B 943 GLU HB3 . 25979 2 38 . 2 2 4 4 GLU HG2 H 1 2.454 0.003 . 2 . . . . B 943 GLU HG2 . 25979 2 39 . 2 2 4 4 GLU HG3 H 1 2.389 0.005 . 2 . . . . B 943 GLU HG3 . 25979 2 40 . 2 2 4 4 GLU C C 13 173.222 0.000 . 1 . . . . B 943 GLU C . 25979 2 41 . 2 2 4 4 GLU CA C 13 54.250 0.000 . 1 . . . . B 943 GLU CA . 25979 2 42 . 2 2 4 4 GLU CB C 13 28.874 0.000 . 1 . . . . B 943 GLU CB . 25979 2 43 . 2 2 4 4 GLU CG C 13 36.181 0.048 . 1 . . . . B 943 GLU CG . 25979 2 44 . 2 2 4 4 GLU N N 15 120.409 0.000 . 1 . . . . B 943 GLU N . 25979 2 45 . 2 2 5 5 PRO HA H 1 2.746 0.000 . 1 . . . . B 944 PRO HA . 25979 2 46 . 2 2 5 5 PRO HB2 H 1 1.374 0.004 . 2 . . . . B 944 PRO HB2 . 25979 2 47 . 2 2 5 5 PRO HB3 H 1 1.213 0.054 . 2 . . . . B 944 PRO HB3 . 25979 2 48 . 2 2 5 5 PRO HG2 H 1 2.075 0.000 . 2 . . . . B 944 PRO HG2 . 25979 2 49 . 2 2 5 5 PRO HG3 H 1 2.016 0.000 . 2 . . . . B 944 PRO HG3 . 25979 2 50 . 2 2 5 5 PRO HD2 H 1 3.969 0.003 . 2 . . . . B 944 PRO HD2 . 25979 2 51 . 2 2 5 5 PRO HD3 H 1 3.651 0.005 . 2 . . . . B 944 PRO HD3 . 25979 2 52 . 2 2 5 5 PRO CA C 13 60.624 0.000 . 1 . . . . B 944 PRO CA . 25979 2 53 . 2 2 5 5 PRO CB C 13 30.027 0.000 . 1 . . . . B 944 PRO CB . 25979 2 54 . 2 2 5 5 PRO CG C 13 27.187 0.000 . 1 . . . . B 944 PRO CG . 25979 2 55 . 2 2 5 5 PRO CD C 13 49.972 0.004 . 1 . . . . B 944 PRO CD . 25979 2 56 . 2 2 6 6 PRO HA H 1 4.256 0.006 . 1 . . . . B 945 PRO HA . 25979 2 57 . 2 2 6 6 PRO HB2 H 1 1.936 0.001 . 2 . . . . B 945 PRO HB2 . 25979 2 58 . 2 2 6 6 PRO HB3 H 1 1.655 0.009 . 2 . . . . B 945 PRO HB3 . 25979 2 59 . 2 2 6 6 PRO HG2 H 1 1.649 0.005 . 2 . . . . B 945 PRO HG2 . 25979 2 60 . 2 2 6 6 PRO HG3 H 1 1.359 0.000 . 2 . . . . B 945 PRO HG3 . 25979 2 61 . 2 2 6 6 PRO HD2 H 1 2.743 0.000 . 2 . . . . B 945 PRO HD2 . 25979 2 62 . 2 2 6 6 PRO HD3 H 1 1.768 0.000 . 2 . . . . B 945 PRO HD3 . 25979 2 63 . 2 2 6 6 PRO C C 13 175.464 0.000 . 1 . . . . B 945 PRO C . 25979 2 64 . 2 2 6 6 PRO CA C 13 61.220 0.000 . 1 . . . . B 945 PRO CA . 25979 2 65 . 2 2 6 6 PRO CB C 13 32.299 0.000 . 1 . . . . B 945 PRO CB . 25979 2 66 . 2 2 6 6 PRO CG C 13 30.037 0.009 . 1 . . . . B 945 PRO CG . 25979 2 67 . 2 2 6 6 PRO CD C 13 49.415 0.009 . 1 . . . . B 945 PRO CD . 25979 2 68 . 2 2 7 7 GLU H H 1 7.935 0.003 . 1 . . . . B 946 GLU H . 25979 2 69 . 2 2 7 7 GLU HA H 1 4.348 0.008 . 1 . . . . B 946 GLU HA . 25979 2 70 . 2 2 7 7 GLU HB2 H 1 2.094 0.000 . 2 . . . . B 946 GLU HB2 . 25979 2 71 . 2 2 7 7 GLU HB3 H 1 1.772 0.001 . 2 . . . . B 946 GLU HB3 . 25979 2 72 . 2 2 7 7 GLU HG2 H 1 2.376 0.001 . 2 . . . . B 946 GLU HG2 . 25979 2 73 . 2 2 7 7 GLU HG3 H 1 2.297 0.008 . 2 . . . . B 946 GLU HG3 . 25979 2 74 . 2 2 7 7 GLU C C 13 174.301 0.000 . 1 . . . . B 946 GLU C . 25979 2 75 . 2 2 7 7 GLU CA C 13 54.474 0.000 . 1 . . . . B 946 GLU CA . 25979 2 76 . 2 2 7 7 GLU CB C 13 28.592 0.000 . 1 . . . . B 946 GLU CB . 25979 2 77 . 2 2 7 7 GLU CG C 13 36.181 0.000 . 1 . . . . B 946 GLU CG . 25979 2 78 . 2 2 7 7 GLU N N 15 118.201 0.000 . 1 . . . . B 946 GLU N . 25979 2 79 . 2 2 8 8 PRO HA H 1 4.851 0.004 . 1 . . . . B 947 PRO HA . 25979 2 80 . 2 2 8 8 PRO HB2 H 1 1.719 0.005 . 2 . . . . B 947 PRO HB2 . 25979 2 81 . 2 2 8 8 PRO HB3 H 1 2.145 0.005 . 2 . . . . B 947 PRO HB3 . 25979 2 82 . 2 2 8 8 PRO HG2 H 1 2.103 0.000 . 2 . . . . B 947 PRO HG2 . 25979 2 83 . 2 2 8 8 PRO HG3 H 1 1.855 0.000 . 2 . . . . B 947 PRO HG3 . 25979 2 84 . 2 2 8 8 PRO HD2 H 1 3.750 0.007 . 2 . . . . B 947 PRO HD2 . 25979 2 85 . 2 2 8 8 PRO HD3 H 1 3.617 0.005 . 2 . . . . B 947 PRO HD3 . 25979 2 86 . 2 2 8 8 PRO C C 13 175.864 0.000 . 1 . . . . B 947 PRO C . 25979 2 87 . 2 2 8 8 PRO CA C 13 62.906 0.000 . 1 . . . . B 947 PRO CA . 25979 2 88 . 2 2 8 8 PRO CB C 13 32.233 0.000 . 1 . . . . B 947 PRO CB . 25979 2 89 . 2 2 8 8 PRO CG C 13 28.311 0.000 . 1 . . . . B 947 PRO CG . 25979 2 90 . 2 2 8 8 PRO CD C 13 50.187 0.005 . 1 . . . . B 947 PRO CD . 25979 2 91 . 2 2 9 9 PHE H H 1 7.869 0.000 . 1 . . . . B 948 PHE H . 25979 2 92 . 2 2 9 9 PHE HA H 1 5.070 0.002 . 1 . . . . B 948 PHE HA . 25979 2 93 . 2 2 9 9 PHE HB2 H 1 3.102 0.004 . 2 . . . . B 948 PHE HB2 . 25979 2 94 . 2 2 9 9 PHE HD1 H 1 7.217 0.001 . 3 . . . . B 948 PHE HD1 . 25979 2 95 . 2 2 9 9 PHE HE1 H 1 6.953 0.003 . 3 . . . . B 948 PHE HE1 . 25979 2 96 . 2 2 9 9 PHE HZ H 1 6.785 0.004 . 1 . . . . B 948 PHE HZ . 25979 2 97 . 2 2 9 9 PHE C C 13 171.805 0.005 . 1 . . . . B 948 PHE C . 25979 2 98 . 2 2 9 9 PHE CA C 13 55.036 0.000 . 1 . . . . B 948 PHE CA . 25979 2 99 . 2 2 9 9 PHE CB C 13 41.522 0.000 . 1 . . . . B 948 PHE CB . 25979 2 100 . 2 2 9 9 PHE CD1 C 13 132.939 0.000 . 3 . . . . B 948 PHE CD1 . 25979 2 101 . 2 2 9 9 PHE N N 15 116.599 0.000 . 1 . . . . B 948 PHE N . 25979 2 102 . 2 2 10 10 GLU H H 1 8.451 0.002 . 1 . . . . B 949 GLU H . 25979 2 103 . 2 2 10 10 GLU HA H 1 4.932 0.002 . 1 . . . . B 949 GLU HA . 25979 2 104 . 2 2 10 10 GLU HB3 H 1 1.919 0.004 . 2 . . . . B 949 GLU HB3 . 25979 2 105 . 2 2 10 10 GLU HG2 H 1 2.214 0.007 . 2 . . . . B 949 GLU HG2 . 25979 2 106 . 2 2 10 10 GLU HG3 H 1 2.098 0.004 . 2 . . . . B 949 GLU HG3 . 25979 2 107 . 2 2 10 10 GLU C C 13 175.891 0.000 . 1 . . . . B 949 GLU C . 25979 2 108 . 2 2 10 10 GLU CA C 13 54.266 0.000 . 1 . . . . B 949 GLU CA . 25979 2 109 . 2 2 10 10 GLU CB C 13 30.924 0.000 . 1 . . . . B 949 GLU CB . 25979 2 110 . 2 2 10 10 GLU CG C 13 36.204 0.000 . 1 . . . . B 949 GLU CG . 25979 2 111 . 2 2 10 10 GLU N N 15 119.256 0.000 . 1 . . . . B 949 GLU N . 25979 2 112 . 2 2 11 11 TYR H H 1 9.116 0.003 . 1 . . . . B 950 TYR H . 25979 2 113 . 2 2 11 11 TYR HA H 1 4.609 0.001 . 1 . . . . B 950 TYR HA . 25979 2 114 . 2 2 11 11 TYR HB2 H 1 2.512 0.011 . 2 . . . . B 950 TYR HB2 . 25979 2 115 . 2 2 11 11 TYR HB3 H 1 2.470 0.003 . 2 . . . . B 950 TYR HB3 . 25979 2 116 . 2 2 11 11 TYR HD1 H 1 7.040 0.033 . 3 . . . . B 950 TYR HD1 . 25979 2 117 . 2 2 11 11 TYR HE1 H 1 6.953 0.002 . 3 . . . . B 950 TYR HE1 . 25979 2 118 . 2 2 11 11 TYR HH H 1 7.050 0.000 . 1 . . . . B 950 TYR HH . 25979 2 119 . 2 2 11 11 TYR C C 13 173.463 0.000 . 1 . . . . B 950 TYR C . 25979 2 120 . 2 2 11 11 TYR CA C 13 57.347 0.000 . 1 . . . . B 950 TYR CA . 25979 2 121 . 2 2 11 11 TYR CB C 13 41.240 0.000 . 1 . . . . B 950 TYR CB . 25979 2 122 . 2 2 11 11 TYR CD1 C 13 132.658 0.000 . 3 . . . . B 950 TYR CD1 . 25979 2 123 . 2 2 11 11 TYR CE1 C 13 118.411 0.000 . 3 . . . . B 950 TYR CE1 . 25979 2 124 . 2 2 11 11 TYR N N 15 126.402 0.000 . 1 . . . . B 950 TYR N . 25979 2 125 . 2 2 12 12 ILE H H 1 7.585 0.005 . 1 . . . . B 951 ILE H . 25979 2 126 . 2 2 12 12 ILE HA H 1 3.949 0.004 . 1 . . . . B 951 ILE HA . 25979 2 127 . 2 2 12 12 ILE HB H 1 1.641 0.002 . 1 . . . . B 951 ILE HB . 25979 2 128 . 2 2 12 12 ILE HG12 H 1 1.343 0.004 . 2 . . . . B 951 ILE HG12 . 25979 2 129 . 2 2 12 12 ILE HG13 H 1 1.055 0.003 . 2 . . . . B 951 ILE HG13 . 25979 2 130 . 2 2 12 12 ILE HG21 H 1 0.789 0.006 . 1 . . . . B 951 ILE HG21 . 25979 2 131 . 2 2 12 12 ILE HG22 H 1 0.789 0.006 . 1 . . . . B 951 ILE HG22 . 25979 2 132 . 2 2 12 12 ILE HG23 H 1 0.789 0.006 . 1 . . . . B 951 ILE HG23 . 25979 2 133 . 2 2 12 12 ILE HD11 H 1 0.804 0.000 . 1 . . . . B 951 ILE HD11 . 25979 2 134 . 2 2 12 12 ILE HD12 H 1 0.804 0.000 . 1 . . . . B 951 ILE HD12 . 25979 2 135 . 2 2 12 12 ILE HD13 H 1 0.804 0.000 . 1 . . . . B 951 ILE HD13 . 25979 2 136 . 2 2 12 12 ILE C C 13 174.396 0.000 . 1 . . . . B 951 ILE C . 25979 2 137 . 2 2 12 12 ILE CA C 13 59.786 0.000 . 1 . . . . B 951 ILE CA . 25979 2 138 . 2 2 12 12 ILE CB C 13 39.273 0.000 . 1 . . . . B 951 ILE CB . 25979 2 139 . 2 2 12 12 ILE CG1 C 13 26.906 0.000 . 1 . . . . B 951 ILE CG1 . 25979 2 140 . 2 2 12 12 ILE CG2 C 13 17.338 0.000 . 1 . . . . B 951 ILE CG2 . 25979 2 141 . 2 2 12 12 ILE CD1 C 13 12.771 0.000 . 1 . . . . B 951 ILE CD1 . 25979 2 142 . 2 2 12 12 ILE N N 15 126.987 0.000 . 1 . . . . B 951 ILE N . 25979 2 143 . 2 2 13 13 ASP H H 1 7.941 0.000 . 1 . . . . B 952 ASP H . 25979 2 144 . 2 2 13 13 ASP HA H 1 4.308 0.005 . 1 . . . . B 952 ASP HA . 25979 2 145 . 2 2 13 13 ASP HB2 H 1 2.691 0.007 . 2 . . . . B 952 ASP HB2 . 25979 2 146 . 2 2 13 13 ASP HB3 H 1 2.451 0.003 . 2 . . . . B 952 ASP HB3 . 25979 2 147 . 2 2 13 13 ASP C C 13 174.519 0.000 . 1 . . . . B 952 ASP C . 25979 2 148 . 2 2 13 13 ASP CA C 13 53.912 0.000 . 1 . . . . B 952 ASP CA . 25979 2 149 . 2 2 13 13 ASP CB C 13 41.521 0.000 . 1 . . . . B 952 ASP CB . 25979 2 150 . 2 2 13 13 ASP N N 15 124.902 0.000 . 1 . . . . B 952 ASP N . 25979 2 151 . 2 2 14 14 ASP H H 1 7.839 0.000 . 1 . . . . B 953 ASP H . 25979 2 152 . 2 2 14 14 ASP HA H 1 4.305 0.000 . 1 . . . . B 953 ASP HA . 25979 2 153 . 2 2 14 14 ASP HB2 H 1 2.587 0.004 . 2 . . . . B 953 ASP HB2 . 25979 2 154 . 2 2 14 14 ASP HB3 H 1 2.533 0.003 . 2 . . . . B 953 ASP HB3 . 25979 2 155 . 2 2 14 14 ASP C C 13 180.939 0.000 . 1 . . . . B 953 ASP C . 25979 2 156 . 2 2 14 14 ASP CA C 13 55.036 0.000 . 1 . . . . B 953 ASP CA . 25979 2 157 . 2 2 14 14 ASP CB C 13 42.352 0.000 . 1 . . . . B 953 ASP CB . 25979 2 158 . 2 2 14 14 ASP N N 15 126.527 0.000 . 1 . . . . B 953 ASP N . 25979 2 stop_ save_