data_17343 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17343 _Entry.Title ; Structure of the NOXO1b PX domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-12-02 _Entry.Accession_date 2010-12-02 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Nicole Davis . Y. . 17343 2 Linda McPhail . C. . 17343 3 David Horita . A. . 17343 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' . 17343 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Horita group, WFUBMC' . 17343 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'nmr structure' . 17343 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17343 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 443 17343 '15N chemical shifts' 135 17343 '1H chemical shifts' 341 17343 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2012-03-12 2010-12-02 update BMRB 'update entry citation' 17343 1 . . 2011-03-30 2010-12-02 original author 'original release' 17343 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16749 'Noxo1b PX domain' 17343 PDB 2L73 'BMRB Entry Tracking System' 17343 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17343 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21188560 _Citation.Full_citation . _Citation.Title 'Backbone 1H, 15N, and 13C resonance assignments for the NOXO1 PX domain.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 5 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 139 _Citation.Page_last 141 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Nicole Davis . Y. . 17343 1 2 Linda McPhail . C. . 17343 1 3 David Horita . A. . 17343 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17343 _Assembly.ID 1 _Assembly.Name NOXO1b _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 NOXO1b 1 $NOXO1b A . yes native no no . . . 17343 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NOXO1b _Entity.Sf_category entity _Entity.Sf_framecode NOXO1b _Entity.Entry_ID 17343 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NOXO1b _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 ; GPLGSMAGPRYPVSVQGAAL VQIKRLQTFAFSVRWSDGSD TFVRRSWDEFRQLKKTLKET FPVEAGLLRRSDRVLPKLLD APLLGRVGRTSRGLARLQLL ETYSRRLLATAERVARSPTI TGFFAPQPLDLEPALPPGSR VILPTPEEQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-5 are remnants of N-terminal fusion tag' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 149 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16060.686 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16749 . Noxo1b_PX . . . . . 100.00 149 100.00 100.00 1.64e-97 . . . . 17343 1 2 no PDB 2L73 . "Structure Of The Noxo1b Px Domain" . . . . . 100.00 149 100.00 100.00 1.64e-97 . . . . 17343 1 3 no DBJ BAC76711 . "NADPH oxidase organizer 1 [Homo sapiens]" . . . . . 96.64 371 100.00 100.00 1.95e-90 . . . . 17343 1 4 no DBJ BAF84886 . "unnamed protein product [Homo sapiens]" . . . . . 96.64 371 100.00 100.00 2.40e-90 . . . . 17343 1 5 no DBJ BAI47049 . "NADPH oxidase organizer 1 [synthetic construct]" . . . . . 96.64 371 100.00 100.00 1.95e-90 . . . . 17343 1 6 no GB AAH15917 . "NADPH oxidase organizer 1 [Homo sapiens]" . . . . . 96.64 370 99.31 99.31 9.02e-88 . . . . 17343 1 7 no GB AAM97925 . "regulatory protein NOXO1-alpha [Homo sapiens]" . . . . . 96.64 370 99.31 99.31 9.02e-88 . . . . 17343 1 8 no GB AAM97926 . "regulatory protein NOXO1-beta [Homo sapiens]" . . . . . 96.64 371 100.00 100.00 1.95e-90 . . . . 17343 1 9 no GB AAN75141 . "NADPH oxidase organizer 1 [Homo sapiens]" . . . . . 96.64 371 100.00 100.00 1.95e-90 . . . . 17343 1 10 no GB AAP13479 . "NADPH oxidase regulatory protein [Homo sapiens]" . . . . . 96.64 370 99.31 99.31 9.02e-88 . . . . 17343 1 11 no REF NP_653204 . "NADPH oxidase organizer 1 isoform a [Homo sapiens]" . . . . . 96.64 370 99.31 99.31 9.02e-88 . . . . 17343 1 12 no REF NP_751907 . "NADPH oxidase organizer 1 isoform b [Homo sapiens]" . . . . . 96.64 371 100.00 100.00 1.95e-90 . . . . 17343 1 13 no REF XP_008958072 . "PREDICTED: NADPH oxidase organizer 1 isoform X3 [Pan paniscus]" . . . . . 95.97 371 100.00 100.00 1.27e-89 . . . . 17343 1 14 no REF XP_012352685 . "PREDICTED: NADPH oxidase organizer 1 isoform X3 [Nomascus leucogenys]" . . . . . 95.97 370 97.90 98.60 2.52e-87 . . . . 17343 1 15 no REF XP_012352686 . "PREDICTED: NADPH oxidase organizer 1 isoform X4 [Nomascus leucogenys]" . . . . . 95.97 369 97.20 97.90 1.18e-84 . . . . 17343 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 17343 1 2 . PRO . 17343 1 3 . LEU . 17343 1 4 . GLY . 17343 1 5 . SER . 17343 1 6 . MET . 17343 1 7 . ALA . 17343 1 8 . GLY . 17343 1 9 . PRO . 17343 1 10 . ARG . 17343 1 11 . TYR . 17343 1 12 . PRO . 17343 1 13 . VAL . 17343 1 14 . SER . 17343 1 15 . VAL . 17343 1 16 . GLN . 17343 1 17 . GLY . 17343 1 18 . ALA . 17343 1 19 . ALA . 17343 1 20 . LEU . 17343 1 21 . VAL . 17343 1 22 . GLN . 17343 1 23 . ILE . 17343 1 24 . LYS . 17343 1 25 . ARG . 17343 1 26 . LEU . 17343 1 27 . GLN . 17343 1 28 . THR . 17343 1 29 . PHE . 17343 1 30 . ALA . 17343 1 31 . PHE . 17343 1 32 . SER . 17343 1 33 . VAL . 17343 1 34 . ARG . 17343 1 35 . TRP . 17343 1 36 . SER . 17343 1 37 . ASP . 17343 1 38 . GLY . 17343 1 39 . SER . 17343 1 40 . ASP . 17343 1 41 . THR . 17343 1 42 . PHE . 17343 1 43 . VAL . 17343 1 44 . ARG . 17343 1 45 . ARG . 17343 1 46 . SER . 17343 1 47 . TRP . 17343 1 48 . ASP . 17343 1 49 . GLU . 17343 1 50 . PHE . 17343 1 51 . ARG . 17343 1 52 . GLN . 17343 1 53 . LEU . 17343 1 54 . LYS . 17343 1 55 . LYS . 17343 1 56 . THR . 17343 1 57 . LEU . 17343 1 58 . LYS . 17343 1 59 . GLU . 17343 1 60 . THR . 17343 1 61 . PHE . 17343 1 62 . PRO . 17343 1 63 . VAL . 17343 1 64 . GLU . 17343 1 65 . ALA . 17343 1 66 . GLY . 17343 1 67 . LEU . 17343 1 68 . LEU . 17343 1 69 . ARG . 17343 1 70 . ARG . 17343 1 71 . SER . 17343 1 72 . ASP . 17343 1 73 . ARG . 17343 1 74 . VAL . 17343 1 75 . LEU . 17343 1 76 . PRO . 17343 1 77 . LYS . 17343 1 78 . LEU . 17343 1 79 . LEU . 17343 1 80 . ASP . 17343 1 81 . ALA . 17343 1 82 . PRO . 17343 1 83 . LEU . 17343 1 84 . LEU . 17343 1 85 . GLY . 17343 1 86 . ARG . 17343 1 87 . VAL . 17343 1 88 . GLY . 17343 1 89 . ARG . 17343 1 90 . THR . 17343 1 91 . SER . 17343 1 92 . ARG . 17343 1 93 . GLY . 17343 1 94 . LEU . 17343 1 95 . ALA . 17343 1 96 . ARG . 17343 1 97 . LEU . 17343 1 98 . GLN . 17343 1 99 . LEU . 17343 1 100 . LEU . 17343 1 101 . GLU . 17343 1 102 . THR . 17343 1 103 . TYR . 17343 1 104 . SER . 17343 1 105 . ARG . 17343 1 106 . ARG . 17343 1 107 . LEU . 17343 1 108 . LEU . 17343 1 109 . ALA . 17343 1 110 . THR . 17343 1 111 . ALA . 17343 1 112 . GLU . 17343 1 113 . ARG . 17343 1 114 . VAL . 17343 1 115 . ALA . 17343 1 116 . ARG . 17343 1 117 . SER . 17343 1 118 . PRO . 17343 1 119 . THR . 17343 1 120 . ILE . 17343 1 121 . THR . 17343 1 122 . GLY . 17343 1 123 . PHE . 17343 1 124 . PHE . 17343 1 125 . ALA . 17343 1 126 . PRO . 17343 1 127 . GLN . 17343 1 128 . PRO . 17343 1 129 . LEU . 17343 1 130 . ASP . 17343 1 131 . LEU . 17343 1 132 . GLU . 17343 1 133 . PRO . 17343 1 134 . ALA . 17343 1 135 . LEU . 17343 1 136 . PRO . 17343 1 137 . PRO . 17343 1 138 . GLY . 17343 1 139 . SER . 17343 1 140 . ARG . 17343 1 141 . VAL . 17343 1 142 . ILE . 17343 1 143 . LEU . 17343 1 144 . PRO . 17343 1 145 . THR . 17343 1 146 . PRO . 17343 1 147 . GLU . 17343 1 148 . GLU . 17343 1 149 . GLN . 17343 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17343 1 . PRO 2 2 17343 1 . LEU 3 3 17343 1 . GLY 4 4 17343 1 . SER 5 5 17343 1 . MET 6 6 17343 1 . ALA 7 7 17343 1 . GLY 8 8 17343 1 . PRO 9 9 17343 1 . ARG 10 10 17343 1 . TYR 11 11 17343 1 . PRO 12 12 17343 1 . VAL 13 13 17343 1 . SER 14 14 17343 1 . VAL 15 15 17343 1 . GLN 16 16 17343 1 . GLY 17 17 17343 1 . ALA 18 18 17343 1 . ALA 19 19 17343 1 . LEU 20 20 17343 1 . VAL 21 21 17343 1 . GLN 22 22 17343 1 . ILE 23 23 17343 1 . LYS 24 24 17343 1 . ARG 25 25 17343 1 . LEU 26 26 17343 1 . GLN 27 27 17343 1 . THR 28 28 17343 1 . PHE 29 29 17343 1 . ALA 30 30 17343 1 . PHE 31 31 17343 1 . SER 32 32 17343 1 . VAL 33 33 17343 1 . ARG 34 34 17343 1 . TRP 35 35 17343 1 . SER 36 36 17343 1 . ASP 37 37 17343 1 . GLY 38 38 17343 1 . SER 39 39 17343 1 . ASP 40 40 17343 1 . THR 41 41 17343 1 . PHE 42 42 17343 1 . VAL 43 43 17343 1 . ARG 44 44 17343 1 . ARG 45 45 17343 1 . SER 46 46 17343 1 . TRP 47 47 17343 1 . ASP 48 48 17343 1 . GLU 49 49 17343 1 . PHE 50 50 17343 1 . ARG 51 51 17343 1 . GLN 52 52 17343 1 . LEU 53 53 17343 1 . LYS 54 54 17343 1 . LYS 55 55 17343 1 . THR 56 56 17343 1 . LEU 57 57 17343 1 . LYS 58 58 17343 1 . GLU 59 59 17343 1 . THR 60 60 17343 1 . PHE 61 61 17343 1 . PRO 62 62 17343 1 . VAL 63 63 17343 1 . GLU 64 64 17343 1 . ALA 65 65 17343 1 . GLY 66 66 17343 1 . LEU 67 67 17343 1 . LEU 68 68 17343 1 . ARG 69 69 17343 1 . ARG 70 70 17343 1 . SER 71 71 17343 1 . ASP 72 72 17343 1 . ARG 73 73 17343 1 . VAL 74 74 17343 1 . LEU 75 75 17343 1 . PRO 76 76 17343 1 . LYS 77 77 17343 1 . LEU 78 78 17343 1 . LEU 79 79 17343 1 . ASP 80 80 17343 1 . ALA 81 81 17343 1 . PRO 82 82 17343 1 . LEU 83 83 17343 1 . LEU 84 84 17343 1 . GLY 85 85 17343 1 . ARG 86 86 17343 1 . VAL 87 87 17343 1 . GLY 88 88 17343 1 . ARG 89 89 17343 1 . THR 90 90 17343 1 . SER 91 91 17343 1 . ARG 92 92 17343 1 . GLY 93 93 17343 1 . LEU 94 94 17343 1 . ALA 95 95 17343 1 . ARG 96 96 17343 1 . LEU 97 97 17343 1 . GLN 98 98 17343 1 . LEU 99 99 17343 1 . LEU 100 100 17343 1 . GLU 101 101 17343 1 . THR 102 102 17343 1 . TYR 103 103 17343 1 . SER 104 104 17343 1 . ARG 105 105 17343 1 . ARG 106 106 17343 1 . LEU 107 107 17343 1 . LEU 108 108 17343 1 . ALA 109 109 17343 1 . THR 110 110 17343 1 . ALA 111 111 17343 1 . GLU 112 112 17343 1 . ARG 113 113 17343 1 . VAL 114 114 17343 1 . ALA 115 115 17343 1 . ARG 116 116 17343 1 . SER 117 117 17343 1 . PRO 118 118 17343 1 . THR 119 119 17343 1 . ILE 120 120 17343 1 . THR 121 121 17343 1 . GLY 122 122 17343 1 . PHE 123 123 17343 1 . PHE 124 124 17343 1 . ALA 125 125 17343 1 . PRO 126 126 17343 1 . GLN 127 127 17343 1 . PRO 128 128 17343 1 . LEU 129 129 17343 1 . ASP 130 130 17343 1 . LEU 131 131 17343 1 . GLU 132 132 17343 1 . PRO 133 133 17343 1 . ALA 134 134 17343 1 . LEU 135 135 17343 1 . PRO 136 136 17343 1 . PRO 137 137 17343 1 . GLY 138 138 17343 1 . SER 139 139 17343 1 . ARG 140 140 17343 1 . VAL 141 141 17343 1 . ILE 142 142 17343 1 . LEU 143 143 17343 1 . PRO 144 144 17343 1 . THR 145 145 17343 1 . PRO 146 146 17343 1 . GLU 147 147 17343 1 . GLU 148 148 17343 1 . GLN 149 149 17343 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17343 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $NOXO1b . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17343 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 17343 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $NOXO1b . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) RIPL . . . . . . . . . . . . . . pGEX-6P . . . . . . 17343 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17343 _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 NOXO1b '[U-13C; U-15N; U-2H]' . . 1 $NOXO1b . . 0.5 . . mM 0.05 . . . 17343 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17343 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17343 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17343 _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 pH 6.5 0.1 pH 17343 1 pressure 1 . atm 17343 1 temperature 293 0.5 K 17343 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 17343 _Sample_condition_list.ID 2 _Sample_condition_list.Details '6mm uncharged acrylamide gel' 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 pH 6.5 . pH 17343 2 temperature 293 . K 17343 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 17343 _Sample_condition_list.ID 3 _Sample_condition_list.Details 'acrylamide gel + APTMAC' 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 pH 6.5 0.1 pH 17343 3 temperature 293 0.5 K 17343 3 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17343 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17343 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17343 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17343 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17343 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 17343 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 17343 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 2 '2D IPAP' no . . . . . . . . . . 1 $sample_1 anisotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 3 '2D IPAP' no . . . . . . . . . . 1 $sample_1 anisotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 6 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 7 '3D HNCOCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 8 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 9 '3D HNCOCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 10 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 11 '3D HMCGCB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 12 '3D 1H-15N NOESYHSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 1 13 '3D 1H-13C NOESYHSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17343 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 17343 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbon' . . . . ppm 0 external direct 1 . . . . . . . . . 17343 1 H 1 water protons . . . . ppm 4.7 internal direct 1 . . . . . . . . . 17343 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . . . . . 17343 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 17343 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 17343 1 2 '2D IPAP' 1 $sample_1 anisotropic 17343 1 3 '2D IPAP' 1 $sample_1 anisotropic 17343 1 4 '3D HNCO' 1 $sample_1 isotropic 17343 1 5 '3D HNCO' 1 $sample_1 isotropic 17343 1 6 '3D HNCACO' 1 $sample_1 isotropic 17343 1 7 '3D HNCOCA' 1 $sample_1 isotropic 17343 1 8 '3D HNCA' 1 $sample_1 isotropic 17343 1 9 '3D HNCOCACB' 1 $sample_1 isotropic 17343 1 10 '3D HNCACB' 1 $sample_1 isotropic 17343 1 11 '3D HMCGCB' 1 $sample_1 isotropic 17343 1 12 '3D 1H-15N NOESYHSQC' 1 $sample_1 isotropic 17343 1 13 '3D 1H-13C NOESYHSQC' 1 $sample_1 isotropic 17343 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO C C 13 176.939 . . 1 . . . . 2 P C . 17343 1 2 . 1 1 2 2 PRO CA C 13 62.505 . . 1 . . . . 2 P CA . 17343 1 3 . 1 1 2 2 PRO CB C 13 31.251 . . 1 . . . . 2 P CB . 17343 1 4 . 1 1 3 3 LEU H H 1 8.396 . . 1 . . . . 3 L HN . 17343 1 5 . 1 1 3 3 LEU HD11 H 1 0.724 . . 2 . . . . 3 L HD11 . 17343 1 6 . 1 1 3 3 LEU HD12 H 1 0.724 . . 2 . . . . 3 L HD11 . 17343 1 7 . 1 1 3 3 LEU HD13 H 1 0.724 . . 2 . . . . 3 L HD11 . 17343 1 8 . 1 1 3 3 LEU HD21 H 1 0.659 . . 2 . . . . 3 L HD21 . 17343 1 9 . 1 1 3 3 LEU HD22 H 1 0.659 . . 2 . . . . 3 L HD21 . 17343 1 10 . 1 1 3 3 LEU HD23 H 1 0.659 . . 2 . . . . 3 L HD21 . 17343 1 11 . 1 1 3 3 LEU C C 13 177.881 . . 1 . . . . 3 L C . 17343 1 12 . 1 1 3 3 LEU CA C 13 54.831 . . 1 . . . . 3 L CA . 17343 1 13 . 1 1 3 3 LEU CB C 13 41.066 . . 1 . . . . 3 L CB . 17343 1 14 . 1 1 3 3 LEU CD1 C 13 24.599 . . 2 . . . . 3 L CD1 . 17343 1 15 . 1 1 3 3 LEU CD2 C 13 23.176 . . 2 . . . . 3 L CD2 . 17343 1 16 . 1 1 3 3 LEU N N 15 122.109 . . 1 . . . . 3 L N . 17343 1 17 . 1 1 4 4 GLY H H 1 8.273 . . 1 . . . . 4 G HN . 17343 1 18 . 1 1 4 4 GLY C C 13 174.142 . . 1 . . . . 4 G C . 17343 1 19 . 1 1 4 4 GLY CA C 13 44.747 . . 1 . . . . 4 G CA . 17343 1 20 . 1 1 4 4 GLY N N 15 109.487 . . 1 . . . . 4 G N . 17343 1 21 . 1 1 5 5 SER H H 1 8.113 . . 1 . . . . 5 S HN . 17343 1 22 . 1 1 5 5 SER C C 13 174.623 . . 1 . . . . 5 S C . 17343 1 23 . 1 1 5 5 SER CA C 13 57.831 . . 1 . . . . 5 S CA . 17343 1 24 . 1 1 5 5 SER CB C 13 62.932 . . 1 . . . . 5 S CB . 17343 1 25 . 1 1 5 5 SER N N 15 115.448 . . 1 . . . . 5 S N . 17343 1 26 . 1 1 6 6 MET H H 1 8.303 . . 1 . . . . 6 M HN . 17343 1 27 . 1 1 6 6 MET C C 13 175.710 . . 1 . . . . 6 M C . 17343 1 28 . 1 1 6 6 MET CA C 13 54.832 . . 1 . . . . 6 M CA . 17343 1 29 . 1 1 6 6 MET CB C 13 31.870 . . 1 . . . . 6 M CB . 17343 1 30 . 1 1 6 6 MET N N 15 121.891 . . 1 . . . . 6 M N . 17343 1 31 . 1 1 7 7 ALA H H 1 8.112 . . 1 . . . . 7 A HN . 17343 1 32 . 1 1 7 7 ALA HB1 H 1 1.203 . . 1 . . . . 7 A HB1 . 17343 1 33 . 1 1 7 7 ALA HB2 H 1 1.203 . . 1 . . . . 7 A HB1 . 17343 1 34 . 1 1 7 7 ALA HB3 H 1 1.203 . . 1 . . . . 7 A HB1 . 17343 1 35 . 1 1 7 7 ALA C C 13 177.622 . . 1 . . . . 7 A C . 17343 1 36 . 1 1 7 7 ALA CA C 13 51.842 . . 1 . . . . 7 A CA . 17343 1 37 . 1 1 7 7 ALA CB C 13 18.679 . . 1 . . . . 7 A CB . 17343 1 38 . 1 1 7 7 ALA N N 15 124.686 . . 1 . . . . 7 A N . 17343 1 39 . 1 1 8 8 GLY H H 1 8.038 . . 1 . . . . 8 G HN . 17343 1 40 . 1 1 8 8 GLY C C 13 171.372 . . 1 . . . . 8 G C . 17343 1 41 . 1 1 8 8 GLY CA C 13 43.810 . . 1 . . . . 8 G CA . 17343 1 42 . 1 1 8 8 GLY N N 15 108.035 . . 1 . . . . 8 G N . 17343 1 43 . 1 1 9 9 PRO C C 13 176.630 . . 1 . . . . 9 P C . 17343 1 44 . 1 1 9 9 PRO CA C 13 62.332 . . 1 . . . . 9 P CA . 17343 1 45 . 1 1 9 9 PRO CB C 13 31.098 . . 1 . . . . 9 P CB . 17343 1 46 . 1 1 10 10 ARG H H 1 8.233 . . 1 . . . . 10 R HN . 17343 1 47 . 1 1 10 10 ARG C C 13 174.368 . . 1 . . . . 10 R C . 17343 1 48 . 1 1 10 10 ARG CA C 13 55.235 . . 1 . . . . 10 R CA . 17343 1 49 . 1 1 10 10 ARG CB C 13 30.074 . . 1 . . . . 10 R CB . 17343 1 50 . 1 1 10 10 ARG N N 15 120.632 . . 1 . . . . 10 R N . 17343 1 51 . 1 1 11 11 TYR H H 1 8.360 . . 1 . . . . 11 Y HN . 17343 1 52 . 1 1 11 11 TYR C C 13 172.192 . . 1 . . . . 11 Y C . 17343 1 53 . 1 1 11 11 TYR CA C 13 53.614 . . 1 . . . . 11 Y CA . 17343 1 54 . 1 1 11 11 TYR CB C 13 37.141 . . 1 . . . . 11 Y CB . 17343 1 55 . 1 1 11 11 TYR N N 15 118.931 . . 1 . . . . 11 Y N . 17343 1 56 . 1 1 12 12 PRO C C 13 174.908 . . 1 . . . . 12 P C . 17343 1 57 . 1 1 13 13 VAL H H 1 8.918 . . 1 . . . . 13 V HN . 17343 1 58 . 1 1 13 13 VAL HG11 H 1 0.578 . . 2 . . . . 13 V HG11 . 17343 1 59 . 1 1 13 13 VAL HG12 H 1 0.578 . . 2 . . . . 13 V HG11 . 17343 1 60 . 1 1 13 13 VAL HG13 H 1 0.578 . . 2 . . . . 13 V HG11 . 17343 1 61 . 1 1 13 13 VAL HG21 H 1 0.339 . . 2 . . . . 13 V HG21 . 17343 1 62 . 1 1 13 13 VAL HG22 H 1 0.339 . . 2 . . . . 13 V HG21 . 17343 1 63 . 1 1 13 13 VAL HG23 H 1 0.339 . . 2 . . . . 13 V HG21 . 17343 1 64 . 1 1 13 13 VAL C C 13 176.145 . . 1 . . . . 13 V C . 17343 1 65 . 1 1 13 13 VAL CA C 13 60.714 . . 1 . . . . 13 V CA . 17343 1 66 . 1 1 13 13 VAL CB C 13 32.797 . . 1 . . . . 13 V CB . 17343 1 67 . 1 1 13 13 VAL CG1 C 13 21.125 . . 2 . . . . 13 V CG1 . 17343 1 68 . 1 1 13 13 VAL CG2 C 13 18.726 . . 2 . . . . 13 V CG2 . 17343 1 69 . 1 1 13 13 VAL N N 15 114.476 . . 1 . . . . 13 V N . 17343 1 70 . 1 1 14 14 SER H H 1 7.386 . . 1 . . . . 14 S HN . 17343 1 71 . 1 1 14 14 SER C C 13 171.690 . . 1 . . . . 14 S C . 17343 1 72 . 1 1 14 14 SER CA C 13 57.156 . . 1 . . . . 14 S CA . 17343 1 73 . 1 1 14 14 SER CB C 13 63.404 . . 1 . . . . 14 S CB . 17343 1 74 . 1 1 14 14 SER N N 15 113.914 . . 1 . . . . 14 S N . 17343 1 75 . 1 1 15 15 VAL H H 1 7.736 . . 1 . . . . 15 V HN . 17343 1 76 . 1 1 15 15 VAL HG11 H 1 0.519 . . 2 . . . . 15 V HG11 . 17343 1 77 . 1 1 15 15 VAL HG12 H 1 0.519 . . 2 . . . . 15 V HG11 . 17343 1 78 . 1 1 15 15 VAL HG13 H 1 0.519 . . 2 . . . . 15 V HG11 . 17343 1 79 . 1 1 15 15 VAL HG21 H 1 0.233 . . 2 . . . . 15 V HG21 . 17343 1 80 . 1 1 15 15 VAL HG22 H 1 0.233 . . 2 . . . . 15 V HG21 . 17343 1 81 . 1 1 15 15 VAL HG23 H 1 0.233 . . 2 . . . . 15 V HG21 . 17343 1 82 . 1 1 15 15 VAL C C 13 173.336 . . 1 . . . . 15 V C . 17343 1 83 . 1 1 15 15 VAL CA C 13 59.853 . . 1 . . . . 15 V CA . 17343 1 84 . 1 1 15 15 VAL CB C 13 35.284 . . 1 . . . . 15 V CB . 17343 1 85 . 1 1 15 15 VAL CG1 C 13 21.201 . . 2 . . . . 15 V CG1 . 17343 1 86 . 1 1 15 15 VAL CG2 C 13 21.050 . . 2 . . . . 15 V CG2 . 17343 1 87 . 1 1 15 15 VAL N N 15 119.759 . . 1 . . . . 15 V N . 17343 1 88 . 1 1 16 16 GLN H H 1 8.883 . . 1 . . . . 16 Q HN . 17343 1 89 . 1 1 16 16 GLN HE21 H 1 7.438 . . 2 . . . . 16 Q HE21 . 17343 1 90 . 1 1 16 16 GLN HE22 H 1 6.689 . . 2 . . . . 16 Q HE22 . 17343 1 91 . 1 1 16 16 GLN C C 13 176.016 . . 1 . . . . 16 Q C . 17343 1 92 . 1 1 16 16 GLN CA C 13 53.667 . . 1 . . . . 16 Q CA . 17343 1 93 . 1 1 16 16 GLN CB C 13 31.272 . . 1 . . . . 16 Q CB . 17343 1 94 . 1 1 16 16 GLN N N 15 124.169 . . 1 . . . . 16 Q N . 17343 1 95 . 1 1 16 16 GLN NE2 N 15 111.984 . . 1 . . . . 16 Q NE2 . 17343 1 96 . 1 1 18 18 ALA H H 1 9.240 . . 1 . . . . 18 A HN . 17343 1 97 . 1 1 18 18 ALA N N 15 131.073 . . 1 . . . . 18 A N . 17343 1 98 . 1 1 19 19 ALA H H 1 7.434 . . 1 . . . . 19 A HN . 17343 1 99 . 1 1 19 19 ALA C C 13 174.364 . . 1 . . . . 19 A C . 17343 1 100 . 1 1 19 19 ALA CA C 13 52.007 . . 1 . . . . 19 A CA . 17343 1 101 . 1 1 19 19 ALA N N 15 113.123 . . 1 . . . . 19 A N . 17343 1 102 . 1 1 20 20 LEU H H 1 8.814 . . 1 . . . . 20 L HN . 17343 1 103 . 1 1 20 20 LEU HD11 H 1 0.770 . . 2 . . . . 20 L HD11 . 17343 1 104 . 1 1 20 20 LEU HD12 H 1 0.770 . . 2 . . . . 20 L HD11 . 17343 1 105 . 1 1 20 20 LEU HD13 H 1 0.770 . . 2 . . . . 20 L HD11 . 17343 1 106 . 1 1 20 20 LEU HD21 H 1 0.539 . . 2 . . . . 20 L HD21 . 17343 1 107 . 1 1 20 20 LEU HD22 H 1 0.539 . . 2 . . . . 20 L HD21 . 17343 1 108 . 1 1 20 20 LEU HD23 H 1 0.539 . . 2 . . . . 20 L HD21 . 17343 1 109 . 1 1 20 20 LEU C C 13 173.763 . . 1 . . . . 20 L C . 17343 1 110 . 1 1 20 20 LEU CA C 13 53.349 . . 1 . . . . 20 L CA . 17343 1 111 . 1 1 20 20 LEU CB C 13 43.598 . . 1 . . . . 20 L CB . 17343 1 112 . 1 1 20 20 LEU CD1 C 13 26.641 . . 2 . . . . 20 L CD1 . 17343 1 113 . 1 1 20 20 LEU CD2 C 13 23.723 . . 2 . . . . 20 L CD2 . 17343 1 114 . 1 1 20 20 LEU N N 15 122.793 . . 1 . . . . 20 L N . 17343 1 115 . 1 1 21 21 VAL H H 1 8.677 . . 1 . . . . 21 V HN . 17343 1 116 . 1 1 21 21 VAL HG11 H 1 0.519 . . 2 . . . . 21 V HG11 . 17343 1 117 . 1 1 21 21 VAL HG12 H 1 0.519 . . 2 . . . . 21 V HG11 . 17343 1 118 . 1 1 21 21 VAL HG13 H 1 0.519 . . 2 . . . . 21 V HG11 . 17343 1 119 . 1 1 21 21 VAL HG21 H 1 0.543 . . 2 . . . . 21 V HG21 . 17343 1 120 . 1 1 21 21 VAL HG22 H 1 0.543 . . 2 . . . . 21 V HG21 . 17343 1 121 . 1 1 21 21 VAL HG23 H 1 0.543 . . 2 . . . . 21 V HG21 . 17343 1 122 . 1 1 21 21 VAL C C 13 174.160 . . 1 . . . . 21 V C . 17343 1 123 . 1 1 21 21 VAL CA C 13 60.554 . . 1 . . . . 21 V CA . 17343 1 124 . 1 1 21 21 VAL CB C 13 31.373 . . 1 . . . . 21 V CB . 17343 1 125 . 1 1 21 21 VAL CG1 C 13 20.835 . . 2 . . . . 21 V CG1 . 17343 1 126 . 1 1 21 21 VAL CG2 C 13 20.369 . . 2 . . . . 21 V CG2 . 17343 1 127 . 1 1 21 21 VAL N N 15 127.087 . . 1 . . . . 21 V N . 17343 1 128 . 1 1 22 22 GLN H H 1 8.945 . . 1 . . . . 22 Q HN . 17343 1 129 . 1 1 22 22 GLN HE21 H 1 7.260 . . 2 . . . . 22 Q HE21 . 17343 1 130 . 1 1 22 22 GLN HE22 H 1 6.631 . . 2 . . . . 22 Q HE22 . 17343 1 131 . 1 1 22 22 GLN C C 13 174.953 . . 1 . . . . 22 Q C . 17343 1 132 . 1 1 22 22 GLN CA C 13 53.568 . . 1 . . . . 22 Q CA . 17343 1 133 . 1 1 22 22 GLN CB C 13 30.221 . . 1 . . . . 22 Q CB . 17343 1 134 . 1 1 22 22 GLN N N 15 127.283 . . 1 . . . . 22 Q N . 17343 1 135 . 1 1 22 22 GLN NE2 N 15 110.664 . . 1 . . . . 22 Q NE2 . 17343 1 136 . 1 1 23 23 ILE H H 1 8.500 . . 1 . . . . 23 I HN . 17343 1 137 . 1 1 23 23 ILE HD11 H 1 0.548 . . 1 . . . . 23 I HD11 . 17343 1 138 . 1 1 23 23 ILE HD12 H 1 0.548 . . 1 . . . . 23 I HD11 . 17343 1 139 . 1 1 23 23 ILE HD13 H 1 0.548 . . 1 . . . . 23 I HD11 . 17343 1 140 . 1 1 23 23 ILE C C 13 175.429 . . 1 . . . . 23 I C . 17343 1 141 . 1 1 23 23 ILE CA C 13 60.350 . . 1 . . . . 23 I CA . 17343 1 142 . 1 1 23 23 ILE CB C 13 38.348 . . 1 . . . . 23 I CB . 17343 1 143 . 1 1 23 23 ILE CD1 C 13 13.547 . . 1 . . . . 23 I CD1 . 17343 1 144 . 1 1 23 23 ILE N N 15 127.125 . . 1 . . . . 23 I N . 17343 1 145 . 1 1 24 24 LYS H H 1 9.012 . . 1 . . . . 24 K HN . 17343 1 146 . 1 1 24 24 LYS C C 13 176.348 . . 1 . . . . 24 K C . 17343 1 147 . 1 1 24 24 LYS CA C 13 58.240 . . 1 . . . . 24 K CA . 17343 1 148 . 1 1 24 24 LYS CB C 13 28.665 . . 1 . . . . 24 K CB . 17343 1 149 . 1 1 24 24 LYS N N 15 125.805 . . 1 . . . . 24 K N . 17343 1 150 . 1 1 25 25 ARG H H 1 8.189 . . 1 . . . . 25 R HN . 17343 1 151 . 1 1 25 25 ARG C C 13 175.784 . . 1 . . . . 25 R C . 17343 1 152 . 1 1 25 25 ARG CA C 13 56.492 . . 1 . . . . 25 R CA . 17343 1 153 . 1 1 25 25 ARG CB C 13 28.739 . . 1 . . . . 25 R CB . 17343 1 154 . 1 1 25 25 ARG N N 15 119.525 . . 1 . . . . 25 R N . 17343 1 155 . 1 1 26 26 LEU H H 1 8.039 . . 1 . . . . 26 L HN . 17343 1 156 . 1 1 26 26 LEU HD11 H 1 0.814 . . 2 . . . . 26 L HD11 . 17343 1 157 . 1 1 26 26 LEU HD12 H 1 0.814 . . 2 . . . . 26 L HD11 . 17343 1 158 . 1 1 26 26 LEU HD13 H 1 0.814 . . 2 . . . . 26 L HD11 . 17343 1 159 . 1 1 26 26 LEU HD21 H 1 0.723 . . 2 . . . . 26 L HD21 . 17343 1 160 . 1 1 26 26 LEU HD22 H 1 0.723 . . 2 . . . . 26 L HD21 . 17343 1 161 . 1 1 26 26 LEU HD23 H 1 0.723 . . 2 . . . . 26 L HD21 . 17343 1 162 . 1 1 26 26 LEU C C 13 176.003 . . 1 . . . . 26 L C . 17343 1 163 . 1 1 26 26 LEU CA C 13 54.311 . . 1 . . . . 26 L CA . 17343 1 164 . 1 1 26 26 LEU CB C 13 41.642 . . 1 . . . . 26 L CB . 17343 1 165 . 1 1 26 26 LEU CD1 C 13 24.159 . . 2 . . . . 26 L CD1 . 17343 1 166 . 1 1 26 26 LEU CD2 C 13 23.741 . . 2 . . . . 26 L CD2 . 17343 1 167 . 1 1 26 26 LEU N N 15 122.136 . . 1 . . . . 26 L N . 17343 1 168 . 1 1 27 27 GLN H H 1 8.652 . . 1 . . . . 27 Q HN . 17343 1 169 . 1 1 27 27 GLN HE21 H 1 7.732 . . 2 . . . . 27 Q HE21 . 17343 1 170 . 1 1 27 27 GLN HE22 H 1 6.224 . . 2 . . . . 27 Q HE22 . 17343 1 171 . 1 1 27 27 GLN C C 13 175.327 . . 1 . . . . 27 Q C . 17343 1 172 . 1 1 27 27 GLN CA C 13 54.201 . . 1 . . . . 27 Q CA . 17343 1 173 . 1 1 27 27 GLN CB C 13 29.630 . . 1 . . . . 27 Q CB . 17343 1 174 . 1 1 27 27 GLN N N 15 123.446 . . 1 . . . . 27 Q N . 17343 1 175 . 1 1 27 27 GLN NE2 N 15 110.349 . . 1 . . . . 27 Q NE2 . 17343 1 176 . 1 1 28 28 THR H H 1 8.853 . . 1 . . . . 28 T HN . 17343 1 177 . 1 1 28 28 THR C C 13 175.289 . . 1 . . . . 28 T C . 17343 1 178 . 1 1 28 28 THR CA C 13 59.424 . . 1 . . . . 28 T CA . 17343 1 179 . 1 1 28 28 THR CB C 13 71.652 . . 1 . . . . 28 T CB . 17343 1 180 . 1 1 28 28 THR N N 15 116.710 . . 1 . . . . 28 T N . 17343 1 181 . 1 1 29 29 PHE H H 1 8.558 . . 1 . . . . 29 F HN . 17343 1 182 . 1 1 29 29 PHE C C 13 172.945 . . 1 . . . . 29 F C . 17343 1 183 . 1 1 29 29 PHE CA C 13 56.876 . . 1 . . . . 29 F CA . 17343 1 184 . 1 1 29 29 PHE CB C 13 40.596 . . 1 . . . . 29 F CB . 17343 1 185 . 1 1 29 29 PHE N N 15 118.774 . . 1 . . . . 29 F N . 17343 1 186 . 1 1 30 30 ALA H H 1 8.911 . . 1 . . . . 30 A HN . 17343 1 187 . 1 1 30 30 ALA C C 13 176.172 . . 1 . . . . 30 A C . 17343 1 188 . 1 1 30 30 ALA CA C 13 49.118 . . 1 . . . . 30 A CA . 17343 1 189 . 1 1 30 30 ALA CB C 13 20.133 . . 1 . . . . 30 A CB . 17343 1 190 . 1 1 30 30 ALA N N 15 125.326 . . 1 . . . . 30 A N . 17343 1 191 . 1 1 31 31 PHE H H 1 9.385 . . 1 . . . . 31 F HN . 17343 1 192 . 1 1 31 31 PHE C C 13 174.781 . . 1 . . . . 31 F C . 17343 1 193 . 1 1 31 31 PHE CA C 13 56.275 . . 1 . . . . 31 F CA . 17343 1 194 . 1 1 31 31 PHE CB C 13 41.706 . . 1 . . . . 31 F CB . 17343 1 195 . 1 1 31 31 PHE N N 15 118.554 . . 1 . . . . 31 F N . 17343 1 196 . 1 1 32 32 SER H H 1 9.029 . . 1 . . . . 32 S HN . 17343 1 197 . 1 1 32 32 SER C C 13 173.951 . . 1 . . . . 32 S C . 17343 1 198 . 1 1 32 32 SER CA C 13 56.210 . . 1 . . . . 32 S CA . 17343 1 199 . 1 1 32 32 SER CB C 13 63.500 . . 1 . . . . 32 S CB . 17343 1 200 . 1 1 32 32 SER N N 15 115.931 . . 1 . . . . 32 S N . 17343 1 201 . 1 1 33 33 VAL H H 1 9.234 . . 1 . . . . 33 V HN . 17343 1 202 . 1 1 33 33 VAL HG11 H 1 0.696 . . 2 . . . . 33 V HG11 . 17343 1 203 . 1 1 33 33 VAL HG12 H 1 0.696 . . 2 . . . . 33 V HG11 . 17343 1 204 . 1 1 33 33 VAL HG13 H 1 0.696 . . 2 . . . . 33 V HG11 . 17343 1 205 . 1 1 33 33 VAL HG21 H 1 -0.270 . . 2 . . . . 33 V HG21 . 17343 1 206 . 1 1 33 33 VAL HG22 H 1 -0.270 . . 2 . . . . 33 V HG21 . 17343 1 207 . 1 1 33 33 VAL HG23 H 1 -0.270 . . 2 . . . . 33 V HG21 . 17343 1 208 . 1 1 33 33 VAL C C 13 174.028 . . 1 . . . . 33 V C . 17343 1 209 . 1 1 33 33 VAL CA C 13 60.434 . . 1 . . . . 33 V CA . 17343 1 210 . 1 1 33 33 VAL CB C 13 32.846 . . 1 . . . . 33 V CB . 17343 1 211 . 1 1 33 33 VAL CG1 C 13 21.001 . . 2 . . . . 33 V CG1 . 17343 1 212 . 1 1 33 33 VAL CG2 C 13 19.368 . . 2 . . . . 33 V CG2 . 17343 1 213 . 1 1 33 33 VAL N N 15 129.255 . . 1 . . . . 33 V N . 17343 1 214 . 1 1 34 34 ARG H H 1 8.115 . . 1 . . . . 34 R HN . 17343 1 215 . 1 1 34 34 ARG C C 13 176.146 . . 1 . . . . 34 R C . 17343 1 216 . 1 1 34 34 ARG CA C 13 53.116 . . 1 . . . . 34 R CA . 17343 1 217 . 1 1 34 34 ARG CB C 13 29.450 . . 1 . . . . 34 R CB . 17343 1 218 . 1 1 34 34 ARG N N 15 126.655 . . 1 . . . . 34 R N . 17343 1 219 . 1 1 35 35 TRP H H 1 9.064 . . 1 . . . . 35 W HN . 17343 1 220 . 1 1 35 35 TRP HE1 H 1 10.425 . . 1 . . . . 35 W HE1 . 17343 1 221 . 1 1 35 35 TRP C C 13 179.064 . . 1 . . . . 35 W C . 17343 1 222 . 1 1 35 35 TRP CA C 13 56.259 . . 1 . . . . 35 W CA . 17343 1 223 . 1 1 35 35 TRP CB C 13 31.260 . . 1 . . . . 35 W CB . 17343 1 224 . 1 1 35 35 TRP N N 15 125.184 . . 1 . . . . 35 W N . 17343 1 225 . 1 1 35 35 TRP NE1 N 15 134.348 . . 1 . . . . 35 W NE1 . 17343 1 226 . 1 1 36 36 SER H H 1 9.219 . . 1 . . . . 36 S HN . 17343 1 227 . 1 1 36 36 SER C C 13 173.647 . . 1 . . . . 36 S C . 17343 1 228 . 1 1 36 36 SER CA C 13 60.263 . . 1 . . . . 36 S CA . 17343 1 229 . 1 1 36 36 SER CB C 13 61.227 . . 1 . . . . 36 S CB . 17343 1 230 . 1 1 36 36 SER N N 15 117.798 . . 1 . . . . 36 S N . 17343 1 231 . 1 1 37 37 ASP H H 1 7.486 . . 1 . . . . 37 D HN . 17343 1 232 . 1 1 37 37 ASP C C 13 176.681 . . 1 . . . . 37 D C . 17343 1 233 . 1 1 37 37 ASP CA C 13 52.390 . . 1 . . . . 37 D CA . 17343 1 234 . 1 1 37 37 ASP CB C 13 39.565 . . 1 . . . . 37 D CB . 17343 1 235 . 1 1 37 37 ASP N N 15 119.293 . . 1 . . . . 37 D N . 17343 1 236 . 1 1 38 38 GLY H H 1 8.128 . . 1 . . . . 38 G HN . 17343 1 237 . 1 1 38 38 GLY C C 13 173.424 . . 1 . . . . 38 G C . 17343 1 238 . 1 1 38 38 GLY CA C 13 44.540 . . 1 . . . . 38 G CA . 17343 1 239 . 1 1 38 38 GLY N N 15 108.164 . . 1 . . . . 38 G N . 17343 1 240 . 1 1 39 39 SER H H 1 7.741 . . 1 . . . . 39 S HN . 17343 1 241 . 1 1 39 39 SER C C 13 171.993 . . 1 . . . . 39 S C . 17343 1 242 . 1 1 39 39 SER CA C 13 57.970 . . 1 . . . . 39 S CA . 17343 1 243 . 1 1 39 39 SER CB C 13 64.115 . . 1 . . . . 39 S CB . 17343 1 244 . 1 1 39 39 SER N N 15 116.066 . . 1 . . . . 39 S N . 17343 1 245 . 1 1 40 40 ASP H H 1 8.228 . . 1 . . . . 40 D HN . 17343 1 246 . 1 1 40 40 ASP C C 13 176.733 . . 1 . . . . 40 D C . 17343 1 247 . 1 1 40 40 ASP CA C 13 52.919 . . 1 . . . . 40 D CA . 17343 1 248 . 1 1 40 40 ASP CB C 13 43.949 . . 1 . . . . 40 D CB . 17343 1 249 . 1 1 40 40 ASP N N 15 118.345 . . 1 . . . . 40 D N . 17343 1 250 . 1 1 41 41 THR H H 1 9.547 . . 1 . . . . 41 T HN . 17343 1 251 . 1 1 41 41 THR C C 13 172.560 . . 1 . . . . 41 T C . 17343 1 252 . 1 1 41 41 THR CA C 13 59.313 . . 1 . . . . 41 T CA . 17343 1 253 . 1 1 41 41 THR CB C 13 71.721 . . 1 . . . . 41 T CB . 17343 1 254 . 1 1 41 41 THR N N 15 111.791 . . 1 . . . . 41 T N . 17343 1 255 . 1 1 42 42 PHE H H 1 8.587 . . 1 . . . . 42 F HN . 17343 1 256 . 1 1 42 42 PHE C C 13 176.470 . . 1 . . . . 42 F C . 17343 1 257 . 1 1 42 42 PHE CA C 13 56.484 . . 1 . . . . 42 F CA . 17343 1 258 . 1 1 42 42 PHE CB C 13 40.876 . . 1 . . . . 42 F CB . 17343 1 259 . 1 1 42 42 PHE N N 15 120.852 . . 1 . . . . 42 F N . 17343 1 260 . 1 1 43 43 VAL H H 1 8.683 . . 1 . . . . 43 V HN . 17343 1 261 . 1 1 43 43 VAL HG11 H 1 0.779 . . 2 . . . . 43 V HG11 . 17343 1 262 . 1 1 43 43 VAL HG12 H 1 0.779 . . 2 . . . . 43 V HG11 . 17343 1 263 . 1 1 43 43 VAL HG13 H 1 0.779 . . 2 . . . . 43 V HG11 . 17343 1 264 . 1 1 43 43 VAL HG21 H 1 0.810 . . 2 . . . . 43 V HG21 . 17343 1 265 . 1 1 43 43 VAL HG22 H 1 0.810 . . 2 . . . . 43 V HG21 . 17343 1 266 . 1 1 43 43 VAL HG23 H 1 0.810 . . 2 . . . . 43 V HG21 . 17343 1 267 . 1 1 43 43 VAL C C 13 174.293 . . 1 . . . . 43 V C . 17343 1 268 . 1 1 43 43 VAL CA C 13 58.235 . . 1 . . . . 43 V CA . 17343 1 269 . 1 1 43 43 VAL CB C 13 34.930 . . 1 . . . . 43 V CB . 17343 1 270 . 1 1 43 43 VAL CG1 C 13 21.950 . . 2 . . . . 43 V CG1 . 17343 1 271 . 1 1 43 43 VAL CG2 C 13 18.326 . . 2 . . . . 43 V CG2 . 17343 1 272 . 1 1 43 43 VAL N N 15 116.126 . . 1 . . . . 43 V N . 17343 1 273 . 1 1 44 44 ARG H H 1 8.729 . . 1 . . . . 44 R HN . 17343 1 274 . 1 1 44 44 ARG C C 13 176.421 . . 1 . . . . 44 R C . 17343 1 275 . 1 1 44 44 ARG CA C 13 54.368 . . 1 . . . . 44 R CA . 17343 1 276 . 1 1 44 44 ARG CB C 13 31.672 . . 1 . . . . 44 R CB . 17343 1 277 . 1 1 44 44 ARG N N 15 123.009 . . 1 . . . . 44 R N . 17343 1 278 . 1 1 45 45 ARG H H 1 9.456 . . 1 . . . . 45 R HN . 17343 1 279 . 1 1 45 45 ARG C C 13 175.442 . . 1 . . . . 45 R C . 17343 1 280 . 1 1 45 45 ARG CA C 13 51.791 . . 1 . . . . 45 R CA . 17343 1 281 . 1 1 45 45 ARG CB C 13 34.958 . . 1 . . . . 45 R CB . 17343 1 282 . 1 1 45 45 ARG N N 15 125.812 . . 1 . . . . 45 R N . 17343 1 283 . 1 1 46 46 SER H H 1 10.032 . . 1 . . . . 46 S HN . 17343 1 284 . 1 1 46 46 SER C C 13 175.502 . . 1 . . . . 46 S C . 17343 1 285 . 1 1 46 46 SER CA C 13 56.473 . . 1 . . . . 46 S CA . 17343 1 286 . 1 1 46 46 SER CB C 13 65.551 . . 1 . . . . 46 S CB . 17343 1 287 . 1 1 46 46 SER N N 15 119.001 . . 1 . . . . 46 S N . 17343 1 288 . 1 1 47 47 TRP H H 1 9.749 . . 1 . . . . 47 W HN . 17343 1 289 . 1 1 47 47 TRP C C 13 178.400 . . 1 . . . . 47 W C . 17343 1 290 . 1 1 47 47 TRP CA C 13 61.302 . . 1 . . . . 47 W CA . 17343 1 291 . 1 1 47 47 TRP CB C 13 28.807 . . 1 . . . . 47 W CB . 17343 1 292 . 1 1 47 47 TRP N N 15 121.331 . . 1 . . . . 47 W N . 17343 1 293 . 1 1 48 48 ASP H H 1 8.626 . . 1 . . . . 48 D HN . 17343 1 294 . 1 1 48 48 ASP C C 13 179.059 . . 1 . . . . 48 D C . 17343 1 295 . 1 1 48 48 ASP CA C 13 57.236 . . 1 . . . . 48 D CA . 17343 1 296 . 1 1 48 48 ASP CB C 13 39.866 . . 1 . . . . 48 D CB . 17343 1 297 . 1 1 48 48 ASP N N 15 116.411 . . 1 . . . . 48 D N . 17343 1 298 . 1 1 49 49 GLU H H 1 8.106 . . 1 . . . . 49 E HN . 17343 1 299 . 1 1 49 49 GLU C C 13 180.330 . . 1 . . . . 49 E C . 17343 1 300 . 1 1 49 49 GLU CA C 13 59.647 . . 1 . . . . 49 E CA . 17343 1 301 . 1 1 49 49 GLU CB C 13 28.285 . . 1 . . . . 49 E CB . 17343 1 302 . 1 1 49 49 GLU N N 15 120.414 . . 1 . . . . 49 E N . 17343 1 303 . 1 1 50 50 PHE H H 1 7.776 . . 1 . . . . 50 F HN . 17343 1 304 . 1 1 50 50 PHE C C 13 177.444 . . 1 . . . . 50 F C . 17343 1 305 . 1 1 50 50 PHE CA C 13 62.062 . . 1 . . . . 50 F CA . 17343 1 306 . 1 1 50 50 PHE CB C 13 37.904 . . 1 . . . . 50 F CB . 17343 1 307 . 1 1 50 50 PHE N N 15 120.546 . . 1 . . . . 50 F N . 17343 1 308 . 1 1 51 51 ARG H H 1 8.021 . . 1 . . . . 51 R HN . 17343 1 309 . 1 1 51 51 ARG C C 13 179.205 . . 1 . . . . 51 R C . 17343 1 310 . 1 1 51 51 ARG CA C 13 59.441 . . 1 . . . . 51 R CA . 17343 1 311 . 1 1 51 51 ARG CB C 13 28.214 . . 1 . . . . 51 R CB . 17343 1 312 . 1 1 51 51 ARG N N 15 119.585 . . 1 . . . . 51 R N . 17343 1 313 . 1 1 52 52 GLN H H 1 7.946 . . 1 . . . . 52 Q HN . 17343 1 314 . 1 1 52 52 GLN HE21 H 1 7.263 . . 2 . . . . 52 Q HE21 . 17343 1 315 . 1 1 52 52 GLN HE22 H 1 6.827 . . 2 . . . . 52 Q HE22 . 17343 1 316 . 1 1 52 52 GLN C C 13 177.805 . . 1 . . . . 52 Q C . 17343 1 317 . 1 1 52 52 GLN CA C 13 57.557 . . 1 . . . . 52 Q CA . 17343 1 318 . 1 1 52 52 GLN CB C 13 27.056 . . 1 . . . . 52 Q CB . 17343 1 319 . 1 1 52 52 GLN N N 15 119.328 . . 1 . . . . 52 Q N . 17343 1 320 . 1 1 52 52 GLN NE2 N 15 113.203 . . 1 . . . . 52 Q NE2 . 17343 1 321 . 1 1 53 53 LEU H H 1 7.549 . . 1 . . . . 53 L HN . 17343 1 322 . 1 1 53 53 LEU HD11 H 1 -0.576 . . 2 . . . . 53 L HD11 . 17343 1 323 . 1 1 53 53 LEU HD12 H 1 -0.576 . . 2 . . . . 53 L HD11 . 17343 1 324 . 1 1 53 53 LEU HD13 H 1 -0.576 . . 2 . . . . 53 L HD11 . 17343 1 325 . 1 1 53 53 LEU HD21 H 1 0.216 . . 2 . . . . 53 L HD21 . 17343 1 326 . 1 1 53 53 LEU HD22 H 1 0.216 . . 2 . . . . 53 L HD21 . 17343 1 327 . 1 1 53 53 LEU HD23 H 1 0.216 . . 2 . . . . 53 L HD21 . 17343 1 328 . 1 1 53 53 LEU C C 13 177.451 . . 1 . . . . 53 L C . 17343 1 329 . 1 1 53 53 LEU CA C 13 57.518 . . 1 . . . . 53 L CA . 17343 1 330 . 1 1 53 53 LEU CB C 13 39.126 . . 1 . . . . 53 L CB . 17343 1 331 . 1 1 53 53 LEU CD1 C 13 23.369 . . 2 . . . . 53 L CD1 . 17343 1 332 . 1 1 53 53 LEU CD2 C 13 22.196 . . 2 . . . . 53 L CD2 . 17343 1 333 . 1 1 53 53 LEU N N 15 124.008 . . 1 . . . . 53 L N . 17343 1 334 . 1 1 54 54 LYS H H 1 7.992 . . 1 . . . . 54 K HN . 17343 1 335 . 1 1 54 54 LYS C C 13 179.039 . . 1 . . . . 54 K C . 17343 1 336 . 1 1 54 54 LYS CA C 13 59.407 . . 1 . . . . 54 K CA . 17343 1 337 . 1 1 54 54 LYS CB C 13 30.205 . . 1 . . . . 54 K CB . 17343 1 338 . 1 1 54 54 LYS N N 15 118.803 . . 1 . . . . 54 K N . 17343 1 339 . 1 1 55 55 LYS H H 1 7.474 . . 1 . . . . 55 K HN . 17343 1 340 . 1 1 55 55 LYS C C 13 178.352 . . 1 . . . . 55 K C . 17343 1 341 . 1 1 55 55 LYS CA C 13 59.106 . . 1 . . . . 55 K CA . 17343 1 342 . 1 1 55 55 LYS CB C 13 31.470 . . 1 . . . . 55 K CB . 17343 1 343 . 1 1 55 55 LYS N N 15 120.542 . . 1 . . . . 55 K N . 17343 1 344 . 1 1 56 56 THR H H 1 8.455 . . 1 . . . . 56 T HN . 17343 1 345 . 1 1 56 56 THR C C 13 178.280 . . 1 . . . . 56 T C . 17343 1 346 . 1 1 56 56 THR CA C 13 65.832 . . 1 . . . . 56 T CA . 17343 1 347 . 1 1 56 56 THR CB C 13 67.589 . . 1 . . . . 56 T CB . 17343 1 348 . 1 1 56 56 THR N N 15 117.611 . . 1 . . . . 56 T N . 17343 1 349 . 1 1 57 57 LEU H H 1 8.953 . . 1 . . . . 57 L HN . 17343 1 350 . 1 1 57 57 LEU HD11 H 1 0.607 . . 2 . . . . 57 L HD11 . 17343 1 351 . 1 1 57 57 LEU HD12 H 1 0.607 . . 2 . . . . 57 L HD11 . 17343 1 352 . 1 1 57 57 LEU HD13 H 1 0.607 . . 2 . . . . 57 L HD11 . 17343 1 353 . 1 1 57 57 LEU HD21 H 1 0.700 . . 2 . . . . 57 L HD21 . 17343 1 354 . 1 1 57 57 LEU HD22 H 1 0.700 . . 2 . . . . 57 L HD21 . 17343 1 355 . 1 1 57 57 LEU HD23 H 1 0.700 . . 2 . . . . 57 L HD21 . 17343 1 356 . 1 1 57 57 LEU C C 13 177.645 . . 1 . . . . 57 L C . 17343 1 357 . 1 1 57 57 LEU CA C 13 58.074 . . 1 . . . . 57 L CA . 17343 1 358 . 1 1 57 57 LEU CB C 13 40.784 . . 1 . . . . 57 L CB . 17343 1 359 . 1 1 57 57 LEU CD1 C 13 27.369 . . 2 . . . . 57 L CD1 . 17343 1 360 . 1 1 57 57 LEU CD2 C 13 25.274 . . 2 . . . . 57 L CD2 . 17343 1 361 . 1 1 57 57 LEU N N 15 124.295 . . 1 . . . . 57 L N . 17343 1 362 . 1 1 58 58 LYS H H 1 7.446 . . 1 . . . . 58 K HN . 17343 1 363 . 1 1 58 58 LYS C C 13 176.967 . . 1 . . . . 58 K C . 17343 1 364 . 1 1 58 58 LYS CA C 13 58.948 . . 1 . . . . 58 K CA . 17343 1 365 . 1 1 58 58 LYS CB C 13 31.005 . . 1 . . . . 58 K CB . 17343 1 366 . 1 1 58 58 LYS N N 15 118.455 . . 1 . . . . 58 K N . 17343 1 367 . 1 1 59 59 GLU H H 1 7.299 . . 1 . . . . 59 E HN . 17343 1 368 . 1 1 59 59 GLU C C 13 178.257 . . 1 . . . . 59 E C . 17343 1 369 . 1 1 59 59 GLU CA C 13 57.088 . . 1 . . . . 59 E CA . 17343 1 370 . 1 1 59 59 GLU CB C 13 29.204 . . 1 . . . . 59 E CB . 17343 1 371 . 1 1 59 59 GLU N N 15 113.484 . . 1 . . . . 59 E N . 17343 1 372 . 1 1 60 60 THR H H 1 7.823 . . 1 . . . . 60 T HN . 17343 1 373 . 1 1 60 60 THR C C 13 173.188 . . 1 . . . . 60 T C . 17343 1 374 . 1 1 60 60 THR CA C 13 64.452 . . 1 . . . . 60 T CA . 17343 1 375 . 1 1 60 60 THR CB C 13 69.181 . . 1 . . . . 60 T CB . 17343 1 376 . 1 1 60 60 THR N N 15 114.316 . . 1 . . . . 60 T N . 17343 1 377 . 1 1 61 61 PHE H H 1 8.027 . . 1 . . . . 61 F HN . 17343 1 378 . 1 1 61 61 PHE C C 13 171.523 . . 1 . . . . 61 F C . 17343 1 379 . 1 1 61 61 PHE CA C 13 55.081 . . 1 . . . . 61 F CA . 17343 1 380 . 1 1 61 61 PHE CB C 13 37.373 . . 1 . . . . 61 F CB . 17343 1 381 . 1 1 61 61 PHE N N 15 119.831 . . 1 . . . . 61 F N . 17343 1 382 . 1 1 62 62 PRO CA C 13 64.440 . . 1 . . . . 62 P CA . 17343 1 383 . 1 1 63 63 VAL H H 1 8.175 . . 1 . . . . 63 V HN . 17343 1 384 . 1 1 63 63 VAL HG11 H 1 0.898 . . 2 . . . . 63 V HG11 . 17343 1 385 . 1 1 63 63 VAL HG12 H 1 0.898 . . 2 . . . . 63 V HG11 . 17343 1 386 . 1 1 63 63 VAL HG13 H 1 0.898 . . 2 . . . . 63 V HG11 . 17343 1 387 . 1 1 63 63 VAL HG21 H 1 0.760 . . 2 . . . . 63 V HG21 . 17343 1 388 . 1 1 63 63 VAL HG22 H 1 0.760 . . 2 . . . . 63 V HG21 . 17343 1 389 . 1 1 63 63 VAL HG23 H 1 0.760 . . 2 . . . . 63 V HG21 . 17343 1 390 . 1 1 63 63 VAL CB C 13 30.400 . . 1 . . . . 63 V CB . 17343 1 391 . 1 1 63 63 VAL CG1 C 13 22.359 . . 2 . . . . 63 V CG1 . 17343 1 392 . 1 1 63 63 VAL CG2 C 13 20.425 . . 2 . . . . 63 V CG2 . 17343 1 393 . 1 1 63 63 VAL N N 15 118.387 . . 1 . . . . 63 V N . 17343 1 394 . 1 1 64 64 GLU H H 1 9.440 . . 1 . . . . 64 E HN . 17343 1 395 . 1 1 64 64 GLU C C 13 177.757 . . 1 . . . . 64 E C . 17343 1 396 . 1 1 64 64 GLU N N 15 122.195 . . 1 . . . . 64 E N . 17343 1 397 . 1 1 65 65 ALA H H 1 8.459 . . 1 . . . . 65 A HN . 17343 1 398 . 1 1 65 65 ALA C C 13 177.423 . . 1 . . . . 65 A C . 17343 1 399 . 1 1 65 65 ALA CA C 13 52.107 . . 1 . . . . 65 A CA . 17343 1 400 . 1 1 65 65 ALA CB C 13 18.739 . . 1 . . . . 65 A CB . 17343 1 401 . 1 1 65 65 ALA N N 15 120.537 . . 1 . . . . 65 A N . 17343 1 402 . 1 1 66 66 GLY H H 1 8.213 . . 1 . . . . 66 G HN . 17343 1 403 . 1 1 66 66 GLY C C 13 174.147 . . 1 . . . . 66 G C . 17343 1 404 . 1 1 66 66 GLY CA C 13 45.574 . . 1 . . . . 66 G CA . 17343 1 405 . 1 1 66 66 GLY N N 15 107.018 . . 1 . . . . 66 G N . 17343 1 406 . 1 1 67 67 LEU H H 1 7.959 . . 1 . . . . 67 L HN . 17343 1 407 . 1 1 67 67 LEU HD11 H 1 0.753 . . 2 . . . . 67 L HD11 . 17343 1 408 . 1 1 67 67 LEU HD12 H 1 0.753 . . 2 . . . . 67 L HD11 . 17343 1 409 . 1 1 67 67 LEU HD13 H 1 0.753 . . 2 . . . . 67 L HD11 . 17343 1 410 . 1 1 67 67 LEU HD21 H 1 0.630 . . 2 . . . . 67 L HD21 . 17343 1 411 . 1 1 67 67 LEU HD22 H 1 0.630 . . 2 . . . . 67 L HD21 . 17343 1 412 . 1 1 67 67 LEU HD23 H 1 0.630 . . 2 . . . . 67 L HD21 . 17343 1 413 . 1 1 67 67 LEU C C 13 177.778 . . 1 . . . . 67 L C . 17343 1 414 . 1 1 67 67 LEU CA C 13 56.059 . . 1 . . . . 67 L CA . 17343 1 415 . 1 1 67 67 LEU CD1 C 13 24.489 . . 2 . . . . 67 L CD1 . 17343 1 416 . 1 1 67 67 LEU CD2 C 13 22.727 . . 2 . . . . 67 L CD2 . 17343 1 417 . 1 1 67 67 LEU N N 15 117.474 . . 1 . . . . 67 L N . 17343 1 418 . 1 1 68 68 LEU H H 1 8.193 . . 1 . . . . 68 L HN . 17343 1 419 . 1 1 68 68 LEU HD21 H 1 0.649 . . 2 . . . . 68 L HD21 . 17343 1 420 . 1 1 68 68 LEU HD22 H 1 0.649 . . 2 . . . . 68 L HD21 . 17343 1 421 . 1 1 68 68 LEU HD23 H 1 0.649 . . 2 . . . . 68 L HD21 . 17343 1 422 . 1 1 68 68 LEU C C 13 177.464 . . 1 . . . . 68 L C . 17343 1 423 . 1 1 68 68 LEU CA C 13 55.429 . . 1 . . . . 68 L CA . 17343 1 424 . 1 1 68 68 LEU CB C 13 39.963 . . 1 . . . . 68 L CB . 17343 1 425 . 1 1 68 68 LEU CD2 C 13 23.164 . . 2 . . . . 68 L CD2 . 17343 1 426 . 1 1 68 68 LEU N N 15 119.177 . . 1 . . . . 68 L N . 17343 1 427 . 1 1 69 69 ARG H H 1 7.535 . . 1 . . . . 69 R HN . 17343 1 428 . 1 1 69 69 ARG C C 13 176.461 . . 1 . . . . 69 R C . 17343 1 429 . 1 1 69 69 ARG CA C 13 51.779 . . 1 . . . . 69 R CA . 17343 1 430 . 1 1 69 69 ARG CB C 13 30.642 . . 1 . . . . 69 R CB . 17343 1 431 . 1 1 69 69 ARG N N 15 118.701 . . 1 . . . . 69 R N . 17343 1 432 . 1 1 71 71 SER C C 13 174.691 . . 1 . . . . 71 S C . 17343 1 433 . 1 1 72 72 ASP H H 1 7.614 . . 1 . . . . 72 D HN . 17343 1 434 . 1 1 72 72 ASP C C 13 175.706 . . 1 . . . . 72 D C . 17343 1 435 . 1 1 72 72 ASP CA C 13 54.105 . . 1 . . . . 72 D CA . 17343 1 436 . 1 1 72 72 ASP CB C 13 40.471 . . 1 . . . . 72 D CB . 17343 1 437 . 1 1 72 72 ASP N N 15 120.675 . . 1 . . . . 72 D N . 17343 1 438 . 1 1 73 73 ARG H H 1 7.444 . . 1 . . . . 73 R HN . 17343 1 439 . 1 1 73 73 ARG C C 13 176.742 . . 1 . . . . 73 R C . 17343 1 440 . 1 1 73 73 ARG CA C 13 56.905 . . 1 . . . . 73 R CA . 17343 1 441 . 1 1 73 73 ARG N N 15 118.099 . . 1 . . . . 73 R N . 17343 1 442 . 1 1 74 74 VAL H H 1 7.117 . . 1 . . . . 74 V HN . 17343 1 443 . 1 1 74 74 VAL HG11 H 1 0.798 . . 2 . . . . 74 V HG11 . 17343 1 444 . 1 1 74 74 VAL HG12 H 1 0.798 . . 2 . . . . 74 V HG11 . 17343 1 445 . 1 1 74 74 VAL HG13 H 1 0.798 . . 2 . . . . 74 V HG11 . 17343 1 446 . 1 1 74 74 VAL HG21 H 1 0.718 . . 2 . . . . 74 V HG21 . 17343 1 447 . 1 1 74 74 VAL HG22 H 1 0.718 . . 2 . . . . 74 V HG21 . 17343 1 448 . 1 1 74 74 VAL HG23 H 1 0.718 . . 2 . . . . 74 V HG21 . 17343 1 449 . 1 1 74 74 VAL CG1 C 13 20.989 . . 2 . . . . 74 V CG1 . 17343 1 450 . 1 1 74 74 VAL CG2 C 13 18.670 . . 2 . . . . 74 V CG2 . 17343 1 451 . 1 1 75 75 LEU H H 1 7.903 . . 1 . . . . 75 L HN . 17343 1 452 . 1 1 75 75 LEU HD11 H 1 0.749 . . 2 . . . . 75 L HD11 . 17343 1 453 . 1 1 75 75 LEU HD12 H 1 0.749 . . 2 . . . . 75 L HD11 . 17343 1 454 . 1 1 75 75 LEU HD13 H 1 0.749 . . 2 . . . . 75 L HD11 . 17343 1 455 . 1 1 75 75 LEU HD21 H 1 0.600 . . 2 . . . . 75 L HD21 . 17343 1 456 . 1 1 75 75 LEU HD22 H 1 0.600 . . 2 . . . . 75 L HD21 . 17343 1 457 . 1 1 75 75 LEU HD23 H 1 0.600 . . 2 . . . . 75 L HD21 . 17343 1 458 . 1 1 75 75 LEU CA C 13 54.314 . . 1 . . . . 75 L CA . 17343 1 459 . 1 1 75 75 LEU CB C 13 41.331 . . 1 . . . . 75 L CB . 17343 1 460 . 1 1 75 75 LEU CD1 C 13 25.468 . . 2 . . . . 75 L CD1 . 17343 1 461 . 1 1 75 75 LEU CD2 C 13 22.952 . . 2 . . . . 75 L CD2 . 17343 1 462 . 1 1 75 75 LEU N N 15 122.598 . . 1 . . . . 75 L N . 17343 1 463 . 1 1 78 78 LEU H H 1 8.583 . . 1 . . . . 78 L HN . 17343 1 464 . 1 1 78 78 LEU HD11 H 1 -0.382 . . 2 . . . . 78 L HD11 . 17343 1 465 . 1 1 78 78 LEU HD12 H 1 -0.382 . . 2 . . . . 78 L HD11 . 17343 1 466 . 1 1 78 78 LEU HD13 H 1 -0.382 . . 2 . . . . 78 L HD11 . 17343 1 467 . 1 1 78 78 LEU HD21 H 1 -0.223 . . 2 . . . . 78 L HD21 . 17343 1 468 . 1 1 78 78 LEU HD22 H 1 -0.223 . . 2 . . . . 78 L HD21 . 17343 1 469 . 1 1 78 78 LEU HD23 H 1 -0.223 . . 2 . . . . 78 L HD21 . 17343 1 470 . 1 1 78 78 LEU C C 13 174.381 . . 1 . . . . 78 L C . 17343 1 471 . 1 1 78 78 LEU CA C 13 53.634 . . 1 . . . . 78 L CA . 17343 1 472 . 1 1 78 78 LEU CB C 13 40.915 . . 1 . . . . 78 L CB . 17343 1 473 . 1 1 78 78 LEU CD1 C 13 24.257 . . 2 . . . . 78 L CD1 . 17343 1 474 . 1 1 78 78 LEU CD2 C 13 21.409 . . 2 . . . . 78 L CD2 . 17343 1 475 . 1 1 78 78 LEU N N 15 125.502 . . 1 . . . . 78 L N . 17343 1 476 . 1 1 79 79 LEU H H 1 8.085 . . 1 . . . . 79 L HN . 17343 1 477 . 1 1 79 79 LEU HD11 H 1 0.755 . . 2 . . . . 79 L HD11 . 17343 1 478 . 1 1 79 79 LEU HD12 H 1 0.755 . . 2 . . . . 79 L HD11 . 17343 1 479 . 1 1 79 79 LEU HD13 H 1 0.755 . . 2 . . . . 79 L HD11 . 17343 1 480 . 1 1 79 79 LEU HD21 H 1 0.713 . . 2 . . . . 79 L HD21 . 17343 1 481 . 1 1 79 79 LEU HD22 H 1 0.713 . . 2 . . . . 79 L HD21 . 17343 1 482 . 1 1 79 79 LEU HD23 H 1 0.713 . . 2 . . . . 79 L HD21 . 17343 1 483 . 1 1 79 79 LEU C C 13 175.009 . . 1 . . . . 79 L C . 17343 1 484 . 1 1 79 79 LEU CA C 13 53.411 . . 1 . . . . 79 L CA . 17343 1 485 . 1 1 79 79 LEU CB C 13 42.092 . . 1 . . . . 79 L CB . 17343 1 486 . 1 1 79 79 LEU CD1 C 13 24.732 . . 2 . . . . 79 L CD1 . 17343 1 487 . 1 1 79 79 LEU CD2 C 13 23.342 . . 2 . . . . 79 L CD2 . 17343 1 488 . 1 1 79 79 LEU N N 15 128.995 . . 1 . . . . 79 L N . 17343 1 489 . 1 1 80 80 ASP H H 1 8.082 . . 1 . . . . 80 D HN . 17343 1 490 . 1 1 80 80 ASP C C 13 176.019 . . 1 . . . . 80 D C . 17343 1 491 . 1 1 80 80 ASP CA C 13 51.594 . . 1 . . . . 80 D CA . 17343 1 492 . 1 1 80 80 ASP CB C 13 40.960 . . 1 . . . . 80 D CB . 17343 1 493 . 1 1 80 80 ASP N N 15 118.553 . . 1 . . . . 80 D N . 17343 1 494 . 1 1 81 81 ALA H H 1 8.550 . . 1 . . . . 81 A HN . 17343 1 495 . 1 1 81 81 ALA C C 13 175.345 . . 1 . . . . 81 A C . 17343 1 496 . 1 1 81 81 ALA CA C 13 49.433 . . 1 . . . . 81 A CA . 17343 1 497 . 1 1 81 81 ALA N N 15 125.370 . . 1 . . . . 81 A N . 17343 1 498 . 1 1 83 83 LEU H H 1 8.186 . . 1 . . . . 83 L HN . 17343 1 499 . 1 1 83 83 LEU HD11 H 1 0.652 . . 2 . . . . 83 L HD11 . 17343 1 500 . 1 1 83 83 LEU HD12 H 1 0.652 . . 2 . . . . 83 L HD11 . 17343 1 501 . 1 1 83 83 LEU HD13 H 1 0.652 . . 2 . . . . 83 L HD11 . 17343 1 502 . 1 1 83 83 LEU HD21 H 1 0.612 . . 2 . . . . 83 L HD21 . 17343 1 503 . 1 1 83 83 LEU HD22 H 1 0.612 . . 2 . . . . 83 L HD21 . 17343 1 504 . 1 1 83 83 LEU HD23 H 1 0.612 . . 2 . . . . 83 L HD21 . 17343 1 505 . 1 1 83 83 LEU CD1 C 13 24.496 . . 2 . . . . 83 L CD1 . 17343 1 506 . 1 1 83 83 LEU CD2 C 13 23.483 . . 2 . . . . 83 L CD2 . 17343 1 507 . 1 1 83 83 LEU N N 15 121.570 . . 1 . . . . 83 L N . 17343 1 508 . 1 1 84 84 LEU H H 1 7.913 . . 1 . . . . 84 L HN . 17343 1 509 . 1 1 84 84 LEU HD11 H 1 0.703 . . 2 . . . . 84 L HD11 . 17343 1 510 . 1 1 84 84 LEU HD12 H 1 0.703 . . 2 . . . . 84 L HD11 . 17343 1 511 . 1 1 84 84 LEU HD13 H 1 0.703 . . 2 . . . . 84 L HD11 . 17343 1 512 . 1 1 84 84 LEU HD21 H 1 0.660 . . 2 . . . . 84 L HD21 . 17343 1 513 . 1 1 84 84 LEU HD22 H 1 0.660 . . 2 . . . . 84 L HD21 . 17343 1 514 . 1 1 84 84 LEU HD23 H 1 0.660 . . 2 . . . . 84 L HD21 . 17343 1 515 . 1 1 84 84 LEU C C 13 177.321 . . 1 . . . . 84 L C . 17343 1 516 . 1 1 84 84 LEU CD1 C 13 24.649 . . 2 . . . . 84 L CD1 . 17343 1 517 . 1 1 84 84 LEU CD2 C 13 22.900 . . 2 . . . . 84 L CD2 . 17343 1 518 . 1 1 84 84 LEU N N 15 122.664 . . 1 . . . . 84 L N . 17343 1 519 . 1 1 85 85 GLY H H 1 8.213 . . 1 . . . . 85 G HN . 17343 1 520 . 1 1 85 85 GLY C C 13 173.917 . . 1 . . . . 85 G C . 17343 1 521 . 1 1 85 85 GLY CA C 13 44.887 . . 1 . . . . 85 G CA . 17343 1 522 . 1 1 85 85 GLY N N 15 109.140 . . 1 . . . . 85 G N . 17343 1 523 . 1 1 86 86 ARG H H 1 8.044 . . 1 . . . . 86 R HN . 17343 1 524 . 1 1 86 86 ARG C C 13 176.033 . . 1 . . . . 86 R C . 17343 1 525 . 1 1 86 86 ARG CA C 13 55.227 . . 1 . . . . 86 R CA . 17343 1 526 . 1 1 86 86 ARG CB C 13 29.082 . . 1 . . . . 86 R CB . 17343 1 527 . 1 1 86 86 ARG N N 15 120.034 . . 1 . . . . 86 R N . 17343 1 528 . 1 1 87 87 VAL H H 1 7.890 . . 1 . . . . 87 V HN . 17343 1 529 . 1 1 87 87 VAL HG11 H 1 0.758 . . 2 . . . . 87 V HG11 . 17343 1 530 . 1 1 87 87 VAL HG12 H 1 0.758 . . 2 . . . . 87 V HG11 . 17343 1 531 . 1 1 87 87 VAL HG13 H 1 0.758 . . 2 . . . . 87 V HG11 . 17343 1 532 . 1 1 87 87 VAL HG21 H 1 0.734 . . 2 . . . . 87 V HG21 . 17343 1 533 . 1 1 87 87 VAL HG22 H 1 0.734 . . 2 . . . . 87 V HG21 . 17343 1 534 . 1 1 87 87 VAL HG23 H 1 0.734 . . 2 . . . . 87 V HG21 . 17343 1 535 . 1 1 87 87 VAL C C 13 176.123 . . 1 . . . . 87 V C . 17343 1 536 . 1 1 87 87 VAL CA C 13 61.537 . . 1 . . . . 87 V CA . 17343 1 537 . 1 1 87 87 VAL CB C 13 31.755 . . 1 . . . . 87 V CB . 17343 1 538 . 1 1 87 87 VAL CG1 C 13 20.975 . . 2 . . . . 87 V CG1 . 17343 1 539 . 1 1 87 87 VAL CG2 C 13 19.967 . . 2 . . . . 87 V CG2 . 17343 1 540 . 1 1 87 87 VAL N N 15 119.992 . . 1 . . . . 87 V N . 17343 1 541 . 1 1 88 88 GLY H H 1 8.330 . . 1 . . . . 88 G HN . 17343 1 542 . 1 1 88 88 GLY C C 13 174.140 . . 1 . . . . 88 G C . 17343 1 543 . 1 1 88 88 GLY CA C 13 44.443 . . 1 . . . . 88 G CA . 17343 1 544 . 1 1 88 88 GLY N N 15 112.149 . . 1 . . . . 88 G N . 17343 1 545 . 1 1 89 89 ARG H H 1 8.684 . . 1 . . . . 89 R HN . 17343 1 546 . 1 1 89 89 ARG C C 13 179.359 . . 1 . . . . 89 R C . 17343 1 547 . 1 1 89 89 ARG CA C 13 58.470 . . 1 . . . . 89 R CA . 17343 1 548 . 1 1 89 89 ARG N N 15 121.204 . . 1 . . . . 89 R N . 17343 1 549 . 1 1 90 90 THR C C 13 175.474 . . 1 . . . . 90 T C . 17343 1 550 . 1 1 91 91 SER H H 1 8.250 . . 1 . . . . 91 S HN . 17343 1 551 . 1 1 91 91 SER C C 13 177.427 . . 1 . . . . 91 S C . 17343 1 552 . 1 1 91 91 SER CA C 13 60.952 . . 1 . . . . 91 S CA . 17343 1 553 . 1 1 91 91 SER CB C 13 61.866 . . 1 . . . . 91 S CB . 17343 1 554 . 1 1 91 91 SER N N 15 117.564 . . 1 . . . . 91 S N . 17343 1 555 . 1 1 92 92 ARG H H 1 8.207 . . 1 . . . . 92 R HN . 17343 1 556 . 1 1 92 92 ARG C C 13 178.343 . . 1 . . . . 92 R C . 17343 1 557 . 1 1 92 92 ARG CA C 13 59.006 . . 1 . . . . 92 R CA . 17343 1 558 . 1 1 92 92 ARG CB C 13 28.969 . . 1 . . . . 92 R CB . 17343 1 559 . 1 1 92 92 ARG N N 15 122.632 . . 1 . . . . 92 R N . 17343 1 560 . 1 1 93 93 GLY H H 1 8.252 . . 1 . . . . 93 G HN . 17343 1 561 . 1 1 93 93 GLY C C 13 175.695 . . 1 . . . . 93 G C . 17343 1 562 . 1 1 93 93 GLY CA C 13 47.239 . . 1 . . . . 93 G CA . 17343 1 563 . 1 1 93 93 GLY N N 15 107.648 . . 1 . . . . 93 G N . 17343 1 564 . 1 1 94 94 LEU H H 1 8.440 . . 1 . . . . 94 L HN . 17343 1 565 . 1 1 94 94 LEU HD11 H 1 0.723 . . 2 . . . . 94 L HD11 . 17343 1 566 . 1 1 94 94 LEU HD12 H 1 0.723 . . 2 . . . . 94 L HD11 . 17343 1 567 . 1 1 94 94 LEU HD13 H 1 0.723 . . 2 . . . . 94 L HD11 . 17343 1 568 . 1 1 94 94 LEU HD21 H 1 0.598 . . 2 . . . . 94 L HD21 . 17343 1 569 . 1 1 94 94 LEU HD22 H 1 0.598 . . 2 . . . . 94 L HD21 . 17343 1 570 . 1 1 94 94 LEU HD23 H 1 0.598 . . 2 . . . . 94 L HD21 . 17343 1 571 . 1 1 94 94 LEU C C 13 179.983 . . 1 . . . . 94 L C . 17343 1 572 . 1 1 94 94 LEU CA C 13 57.125 . . 1 . . . . 94 L CA . 17343 1 573 . 1 1 94 94 LEU CB C 13 40.038 . . 1 . . . . 94 L CB . 17343 1 574 . 1 1 94 94 LEU CD1 C 13 24.621 . . 1 . . . . 94 L CD1 . 17343 1 575 . 1 1 94 94 LEU CD2 C 13 21.949 . . 2 . . . . 94 L CD2 . 17343 1 576 . 1 1 94 94 LEU N N 15 122.674 . . 1 . . . . 94 L N . 17343 1 577 . 1 1 95 95 ALA H H 1 7.837 . . 1 . . . . 95 A HN . 17343 1 578 . 1 1 95 95 ALA C C 13 181.152 . . 1 . . . . 95 A C . 17343 1 579 . 1 1 95 95 ALA CA C 13 54.456 . . 1 . . . . 95 A CA . 17343 1 580 . 1 1 95 95 ALA CB C 13 17.007 . . 1 . . . . 95 A CB . 17343 1 581 . 1 1 95 95 ALA N N 15 123.285 . . 1 . . . . 95 A N . 17343 1 582 . 1 1 96 96 ARG H H 1 8.407 . . 1 . . . . 96 R HN . 17343 1 583 . 1 1 96 96 ARG C C 13 177.079 . . 1 . . . . 96 R C . 17343 1 584 . 1 1 96 96 ARG CA C 13 59.878 . . 1 . . . . 96 R CA . 17343 1 585 . 1 1 96 96 ARG CB C 13 30.248 . . 1 . . . . 96 R CB . 17343 1 586 . 1 1 96 96 ARG N N 15 119.139 . . 1 . . . . 96 R N . 17343 1 587 . 1 1 97 97 LEU H H 1 8.210 . . 1 . . . . 97 L HN . 17343 1 588 . 1 1 97 97 LEU HD11 H 1 0.594 . . 2 . . . . 97 L HD11 . 17343 1 589 . 1 1 97 97 LEU HD12 H 1 0.594 . . 2 . . . . 97 L HD11 . 17343 1 590 . 1 1 97 97 LEU HD13 H 1 0.594 . . 2 . . . . 97 L HD11 . 17343 1 591 . 1 1 97 97 LEU HD21 H 1 0.665 . . 2 . . . . 97 L HD21 . 17343 1 592 . 1 1 97 97 LEU HD22 H 1 0.665 . . 2 . . . . 97 L HD21 . 17343 1 593 . 1 1 97 97 LEU HD23 H 1 0.665 . . 2 . . . . 97 L HD21 . 17343 1 594 . 1 1 97 97 LEU C C 13 177.641 . . 1 . . . . 97 L C . 17343 1 595 . 1 1 97 97 LEU CA C 13 59.643 . . 1 . . . . 97 L CA . 17343 1 596 . 1 1 97 97 LEU CB C 13 40.737 . . 1 . . . . 97 L CB . 17343 1 597 . 1 1 97 97 LEU CD1 C 13 25.471 . . 2 . . . . 97 L CD1 . 17343 1 598 . 1 1 97 97 LEU CD2 C 13 23.363 . . 2 . . . . 97 L CD2 . 17343 1 599 . 1 1 97 97 LEU N N 15 120.198 . . 1 . . . . 97 L N . 17343 1 600 . 1 1 98 98 GLN H H 1 7.150 . . 1 . . . . 98 Q HN . 17343 1 601 . 1 1 98 98 GLN HE21 H 1 7.362 . . 2 . . . . 98 Q HE21 . 17343 1 602 . 1 1 98 98 GLN HE22 H 1 6.814 . . 2 . . . . 98 Q HE22 . 17343 1 603 . 1 1 98 98 GLN C C 13 178.855 . . 1 . . . . 98 Q C . 17343 1 604 . 1 1 98 98 GLN CA C 13 58.017 . . 1 . . . . 98 Q CA . 17343 1 605 . 1 1 98 98 GLN CB C 13 27.787 . . 1 . . . . 98 Q CB . 17343 1 606 . 1 1 98 98 GLN N N 15 116.171 . . 1 . . . . 98 Q N . 17343 1 607 . 1 1 98 98 GLN NE2 N 15 112.964 . . 1 . . . . 98 Q NE2 . 17343 1 608 . 1 1 99 99 LEU H H 1 7.999 . . 1 . . . . 99 L HN . 17343 1 609 . 1 1 99 99 LEU HD11 H 1 0.778 . . 2 . . . . 99 L HD11 . 17343 1 610 . 1 1 99 99 LEU HD12 H 1 0.778 . . 2 . . . . 99 L HD11 . 17343 1 611 . 1 1 99 99 LEU HD13 H 1 0.778 . . 2 . . . . 99 L HD11 . 17343 1 612 . 1 1 99 99 LEU HD21 H 1 0.804 . . 2 . . . . 99 L HD21 . 17343 1 613 . 1 1 99 99 LEU HD22 H 1 0.804 . . 2 . . . . 99 L HD21 . 17343 1 614 . 1 1 99 99 LEU HD23 H 1 0.804 . . 2 . . . . 99 L HD21 . 17343 1 615 . 1 1 99 99 LEU C C 13 180.841 . . 1 . . . . 99 L C . 17343 1 616 . 1 1 99 99 LEU CA C 13 57.710 . . 1 . . . . 99 L CA . 17343 1 617 . 1 1 99 99 LEU CB C 13 40.424 . . 1 . . . . 99 L CB . 17343 1 618 . 1 1 99 99 LEU CD1 C 13 25.227 . . 2 . . . . 99 L CD1 . 17343 1 619 . 1 1 99 99 LEU CD2 C 13 22.811 . . 2 . . . . 99 L CD2 . 17343 1 620 . 1 1 99 99 LEU N N 15 120.511 . . 1 . . . . 99 L N . 17343 1 621 . 1 1 100 100 LEU H H 1 8.621 . . 1 . . . . 100 L HN . 17343 1 622 . 1 1 100 100 LEU HD11 H 1 -0.065 . . 2 . . . . 100 L HD11 . 17343 1 623 . 1 1 100 100 LEU HD12 H 1 -0.065 . . 2 . . . . 100 L HD11 . 17343 1 624 . 1 1 100 100 LEU HD13 H 1 -0.065 . . 2 . . . . 100 L HD11 . 17343 1 625 . 1 1 100 100 LEU HD21 H 1 -0.837 . . 2 . . . . 100 L HD21 . 17343 1 626 . 1 1 100 100 LEU HD22 H 1 -0.837 . . 2 . . . . 100 L HD21 . 17343 1 627 . 1 1 100 100 LEU HD23 H 1 -0.837 . . 2 . . . . 100 L HD21 . 17343 1 628 . 1 1 100 100 LEU C C 13 180.372 . . 1 . . . . 100 L C . 17343 1 629 . 1 1 100 100 LEU CA C 13 56.482 . . 1 . . . . 100 L CA . 17343 1 630 . 1 1 100 100 LEU CB C 13 41.249 . . 1 . . . . 100 L CB . 17343 1 631 . 1 1 100 100 LEU CD1 C 13 25.044 . . 2 . . . . 100 L CD1 . 17343 1 632 . 1 1 100 100 LEU CD2 C 13 20.425 . . 2 . . . . 100 L CD2 . 17343 1 633 . 1 1 100 100 LEU N N 15 120.635 . . 1 . . . . 100 L N . 17343 1 634 . 1 1 101 101 GLU H H 1 8.520 . . 1 . . . . 101 E HN . 17343 1 635 . 1 1 101 101 GLU C C 13 177.420 . . 1 . . . . 101 E C . 17343 1 636 . 1 1 101 101 GLU CA C 13 60.344 . . 1 . . . . 101 E CA . 17343 1 637 . 1 1 101 101 GLU CB C 13 29.456 . . 1 . . . . 101 E CB . 17343 1 638 . 1 1 101 101 GLU N N 15 124.270 . . 1 . . . . 101 E N . 17343 1 639 . 1 1 102 102 THR H H 1 8.346 . . 1 . . . . 102 T HN . 17343 1 640 . 1 1 102 102 THR C C 13 175.214 . . 1 . . . . 102 T C . 17343 1 641 . 1 1 102 102 THR CA C 13 66.481 . . 1 . . . . 102 T CA . 17343 1 642 . 1 1 102 102 THR CB C 13 67.869 . . 1 . . . . 102 T CB . 17343 1 643 . 1 1 102 102 THR N N 15 116.814 . . 1 . . . . 102 T N . 17343 1 644 . 1 1 103 103 TYR H H 1 8.243 . . 1 . . . . 103 Y HN . 17343 1 645 . 1 1 103 103 TYR C C 13 176.522 . . 1 . . . . 103 Y C . 17343 1 646 . 1 1 103 103 TYR CA C 13 61.130 . . 1 . . . . 103 Y CA . 17343 1 647 . 1 1 103 103 TYR N N 15 121.884 . . 1 . . . . 103 Y N . 17343 1 648 . 1 1 104 104 SER H H 1 8.003 . . 1 . . . . 104 S HN . 17343 1 649 . 1 1 104 104 SER CA C 13 62.913 . . 1 . . . . 104 S CA . 17343 1 650 . 1 1 104 104 SER N N 15 113.373 . . 1 . . . . 104 S N . 17343 1 651 . 1 1 105 105 ARG C C 13 179.894 . . 1 . . . . 105 R C . 17343 1 652 . 1 1 105 105 ARG CA C 13 59.602 . . 1 . . . . 105 R CA . 17343 1 653 . 1 1 105 105 ARG CB C 13 28.855 . . 1 . . . . 105 R CB . 17343 1 654 . 1 1 106 106 ARG H H 1 8.175 . . 1 . . . . 106 R HN . 17343 1 655 . 1 1 106 106 ARG C C 13 180.131 . . 1 . . . . 106 R C . 17343 1 656 . 1 1 106 106 ARG CA C 13 58.568 . . 1 . . . . 106 R CA . 17343 1 657 . 1 1 106 106 ARG CB C 13 28.774 . . 1 . . . . 106 R CB . 17343 1 658 . 1 1 106 106 ARG N N 15 118.606 . . 1 . . . . 106 R N . 17343 1 659 . 1 1 107 107 LEU H H 1 8.181 . . 1 . . . . 107 L HN . 17343 1 660 . 1 1 107 107 LEU HD11 H 1 0.308 . . 2 . . . . 107 L HD11 . 17343 1 661 . 1 1 107 107 LEU HD12 H 1 0.308 . . 2 . . . . 107 L HD11 . 17343 1 662 . 1 1 107 107 LEU HD13 H 1 0.308 . . 2 . . . . 107 L HD11 . 17343 1 663 . 1 1 107 107 LEU HD21 H 1 0.354 . . 2 . . . . 107 L HD21 . 17343 1 664 . 1 1 107 107 LEU HD22 H 1 0.354 . . 2 . . . . 107 L HD21 . 17343 1 665 . 1 1 107 107 LEU HD23 H 1 0.354 . . 2 . . . . 107 L HD21 . 17343 1 666 . 1 1 107 107 LEU C C 13 178.633 . . 1 . . . . 107 L C . 17343 1 667 . 1 1 107 107 LEU CA C 13 57.074 . . 1 . . . . 107 L CA . 17343 1 668 . 1 1 107 107 LEU CB C 13 40.968 . . 1 . . . . 107 L CB . 17343 1 669 . 1 1 107 107 LEU CD1 C 13 24.576 . . 2 . . . . 107 L CD1 . 17343 1 670 . 1 1 107 107 LEU CD2 C 13 23.336 . . 2 . . . . 107 L CD2 . 17343 1 671 . 1 1 107 107 LEU N N 15 121.369 . . 1 . . . . 107 L N . 17343 1 672 . 1 1 108 108 LEU H H 1 7.468 . . 1 . . . . 108 L HN . 17343 1 673 . 1 1 108 108 LEU HD11 H 1 0.036 . . 2 . . . . 108 L HD11 . 17343 1 674 . 1 1 108 108 LEU HD12 H 1 0.036 . . 2 . . . . 108 L HD11 . 17343 1 675 . 1 1 108 108 LEU HD13 H 1 0.036 . . 2 . . . . 108 L HD11 . 17343 1 676 . 1 1 108 108 LEU HD21 H 1 0.304 . . 2 . . . . 108 L HD21 . 17343 1 677 . 1 1 108 108 LEU HD22 H 1 0.304 . . 2 . . . . 108 L HD21 . 17343 1 678 . 1 1 108 108 LEU HD23 H 1 0.304 . . 2 . . . . 108 L HD21 . 17343 1 679 . 1 1 108 108 LEU C C 13 176.390 . . 1 . . . . 108 L C . 17343 1 680 . 1 1 108 108 LEU CA C 13 55.676 . . 1 . . . . 108 L CA . 17343 1 681 . 1 1 108 108 LEU CB C 13 38.749 . . 1 . . . . 108 L CB . 17343 1 682 . 1 1 108 108 LEU CD1 C 13 23.965 . . 2 . . . . 108 L CD1 . 17343 1 683 . 1 1 108 108 LEU CD2 C 13 21.774 . . 2 . . . . 108 L CD2 . 17343 1 684 . 1 1 108 108 LEU N N 15 115.334 . . 1 . . . . 108 L N . 17343 1 685 . 1 1 109 109 ALA H H 1 7.026 . . 1 . . . . 109 A HN . 17343 1 686 . 1 1 109 109 ALA C C 13 177.739 . . 1 . . . . 109 A C . 17343 1 687 . 1 1 109 109 ALA CA C 13 50.943 . . 1 . . . . 109 A CA . 17343 1 688 . 1 1 109 109 ALA CB C 13 18.495 . . 1 . . . . 109 A CB . 17343 1 689 . 1 1 109 109 ALA N N 15 118.804 . . 1 . . . . 109 A N . 17343 1 690 . 1 1 110 110 THR H H 1 6.849 . . 1 . . . . 110 T HN . 17343 1 691 . 1 1 110 110 THR C C 13 172.635 . . 1 . . . . 110 T C . 17343 1 692 . 1 1 110 110 THR CA C 13 62.002 . . 1 . . . . 110 T CA . 17343 1 693 . 1 1 110 110 THR CB C 13 69.478 . . 1 . . . . 110 T CB . 17343 1 694 . 1 1 110 110 THR N N 15 111.464 . . 1 . . . . 110 T N . 17343 1 695 . 1 1 111 111 ALA H H 1 7.572 . . 1 . . . . 111 A HN . 17343 1 696 . 1 1 111 111 ALA C C 13 177.902 . . 1 . . . . 111 A C . 17343 1 697 . 1 1 111 111 ALA CA C 13 51.717 . . 1 . . . . 111 A CA . 17343 1 698 . 1 1 111 111 ALA CB C 13 18.523 . . 1 . . . . 111 A CB . 17343 1 699 . 1 1 111 111 ALA N N 15 118.871 . . 1 . . . . 111 A N . 17343 1 700 . 1 1 112 112 GLU H H 1 8.772 . . 1 . . . . 112 E HN . 17343 1 701 . 1 1 112 112 GLU C C 13 177.200 . . 1 . . . . 112 E C . 17343 1 702 . 1 1 112 112 GLU CA C 13 60.132 . . 1 . . . . 112 E CA . 17343 1 703 . 1 1 112 112 GLU CB C 13 28.450 . . 1 . . . . 112 E CB . 17343 1 704 . 1 1 112 112 GLU N N 15 123.745 . . 1 . . . . 112 E N . 17343 1 705 . 1 1 113 113 ARG H H 1 8.250 . . 1 . . . . 113 R HN . 17343 1 706 . 1 1 113 113 ARG C C 13 176.099 . . 1 . . . . 113 R C . 17343 1 707 . 1 1 113 113 ARG CA C 13 57.591 . . 1 . . . . 113 R CA . 17343 1 708 . 1 1 113 113 ARG CB C 13 28.405 . . 1 . . . . 113 R CB . 17343 1 709 . 1 1 113 113 ARG N N 15 114.831 . . 1 . . . . 113 R N . 17343 1 710 . 1 1 114 114 VAL H H 1 7.059 . . 1 . . . . 114 V HN . 17343 1 711 . 1 1 114 114 VAL HG11 H 1 0.211 . . 2 . . . . 114 V HG11 . 17343 1 712 . 1 1 114 114 VAL HG12 H 1 0.211 . . 2 . . . . 114 V HG11 . 17343 1 713 . 1 1 114 114 VAL HG13 H 1 0.211 . . 2 . . . . 114 V HG11 . 17343 1 714 . 1 1 114 114 VAL HG21 H 1 -0.226 . . 2 . . . . 114 V HG21 . 17343 1 715 . 1 1 114 114 VAL HG22 H 1 -0.226 . . 2 . . . . 114 V HG21 . 17343 1 716 . 1 1 114 114 VAL HG23 H 1 -0.226 . . 2 . . . . 114 V HG21 . 17343 1 717 . 1 1 114 114 VAL C C 13 178.455 . . 1 . . . . 114 V C . 17343 1 718 . 1 1 114 114 VAL CA C 13 63.472 . . 1 . . . . 114 V CA . 17343 1 719 . 1 1 114 114 VAL CB C 13 31.015 . . 1 . . . . 114 V CB . 17343 1 720 . 1 1 114 114 VAL CG1 C 13 20.227 . . 2 . . . . 114 V CG1 . 17343 1 721 . 1 1 114 114 VAL CG2 C 13 19.513 . . 2 . . . . 114 V CG2 . 17343 1 722 . 1 1 114 114 VAL N N 15 116.324 . . 1 . . . . 114 V N . 17343 1 723 . 1 1 115 115 ALA H H 1 7.806 . . 1 . . . . 115 A HN . 17343 1 724 . 1 1 115 115 ALA C C 13 176.713 . . 1 . . . . 115 A C . 17343 1 725 . 1 1 115 115 ALA CA C 13 55.230 . . 1 . . . . 115 A CA . 17343 1 726 . 1 1 115 115 ALA CB C 13 18.983 . . 1 . . . . 115 A CB . 17343 1 727 . 1 1 115 115 ALA N N 15 122.729 . . 1 . . . . 115 A N . 17343 1 728 . 1 1 116 116 ARG H H 1 7.506 . . 1 . . . . 116 R HN . 17343 1 729 . 1 1 116 116 ARG C C 13 176.501 . . 1 . . . . 116 R C . 17343 1 730 . 1 1 116 116 ARG CA C 13 53.543 . . 1 . . . . 116 R CA . 17343 1 731 . 1 1 116 116 ARG CB C 13 28.360 . . 1 . . . . 116 R CB . 17343 1 732 . 1 1 116 116 ARG N N 15 108.525 . . 1 . . . . 116 R N . 17343 1 733 . 1 1 117 117 SER H H 1 7.595 . . 1 . . . . 117 S HN . 17343 1 734 . 1 1 117 117 SER C C 13 176.560 . . 1 . . . . 117 S C . 17343 1 735 . 1 1 117 117 SER CA C 13 57.051 . . 1 . . . . 117 S CA . 17343 1 736 . 1 1 117 117 SER CB C 13 62.965 . . 1 . . . . 117 S CB . 17343 1 737 . 1 1 117 117 SER N N 15 117.115 . . 1 . . . . 117 S N . 17343 1 738 . 1 1 118 118 PRO C C 13 179.663 . . 1 . . . . 118 P C . 17343 1 739 . 1 1 118 118 PRO CA C 13 64.104 . . 1 . . . . 118 P CA . 17343 1 740 . 1 1 118 118 PRO CB C 13 30.575 . . 1 . . . . 118 P CB . 17343 1 741 . 1 1 119 119 THR H H 1 7.648 . . 1 . . . . 119 T HN . 17343 1 742 . 1 1 119 119 THR C C 13 175.543 . . 1 . . . . 119 T C . 17343 1 743 . 1 1 119 119 THR CA C 13 66.344 . . 1 . . . . 119 T CA . 17343 1 744 . 1 1 119 119 THR CB C 13 68.277 . . 1 . . . . 119 T CB . 17343 1 745 . 1 1 119 119 THR N N 15 113.233 . . 1 . . . . 119 T N . 17343 1 746 . 1 1 120 120 ILE H H 1 7.284 . . 1 . . . . 120 I HN . 17343 1 747 . 1 1 120 120 ILE HD11 H 1 0.548 . . 1 . . . . 120 I HD11 . 17343 1 748 . 1 1 120 120 ILE HD12 H 1 0.548 . . 1 . . . . 120 I HD11 . 17343 1 749 . 1 1 120 120 ILE HD13 H 1 0.548 . . 1 . . . . 120 I HD11 . 17343 1 750 . 1 1 120 120 ILE C C 13 177.899 . . 1 . . . . 120 I C . 17343 1 751 . 1 1 120 120 ILE CA C 13 62.553 . . 1 . . . . 120 I CA . 17343 1 752 . 1 1 120 120 ILE CB C 13 35.346 . . 1 . . . . 120 I CB . 17343 1 753 . 1 1 120 120 ILE CD1 C 13 11.661 . . 1 . . . . 120 I CD1 . 17343 1 754 . 1 1 120 120 ILE N N 15 121.162 . . 1 . . . . 120 I N . 17343 1 755 . 1 1 121 121 THR H H 1 8.825 . . 1 . . . . 121 T HN . 17343 1 756 . 1 1 121 121 THR C C 13 177.280 . . 1 . . . . 121 T C . 17343 1 757 . 1 1 121 121 THR CA C 13 66.705 . . 1 . . . . 121 T CA . 17343 1 758 . 1 1 121 121 THR N N 15 114.149 . . 1 . . . . 121 T N . 17343 1 759 . 1 1 122 122 GLY H H 1 8.391 . . 1 . . . . 122 G HN . 17343 1 760 . 1 1 122 122 GLY C C 13 175.678 . . 1 . . . . 122 G C . 17343 1 761 . 1 1 122 122 GLY CA C 13 45.642 . . 1 . . . . 122 G CA . 17343 1 762 . 1 1 122 122 GLY N N 15 106.791 . . 1 . . . . 122 G N . 17343 1 763 . 1 1 123 123 PHE H H 1 7.252 . . 1 . . . . 123 F HN . 17343 1 764 . 1 1 123 123 PHE C C 13 176.821 . . 1 . . . . 123 F C . 17343 1 765 . 1 1 123 123 PHE CA C 13 60.878 . . 1 . . . . 123 F CA . 17343 1 766 . 1 1 123 123 PHE CB C 13 38.256 . . 1 . . . . 123 F CB . 17343 1 767 . 1 1 123 123 PHE N N 15 121.622 . . 1 . . . . 123 F N . 17343 1 768 . 1 1 124 124 PHE H H 1 7.239 . . 1 . . . . 124 F HN . 17343 1 769 . 1 1 124 124 PHE C C 13 172.655 . . 1 . . . . 124 F C . 17343 1 770 . 1 1 124 124 PHE CA C 13 59.524 . . 1 . . . . 124 F CA . 17343 1 771 . 1 1 124 124 PHE CB C 13 38.969 . . 1 . . . . 124 F CB . 17343 1 772 . 1 1 124 124 PHE N N 15 112.800 . . 1 . . . . 124 F N . 17343 1 773 . 1 1 125 125 ALA H H 1 7.184 . . 1 . . . . 125 A HN . 17343 1 774 . 1 1 125 125 ALA C C 13 174.273 . . 1 . . . . 125 A C . 17343 1 775 . 1 1 125 125 ALA CA C 13 50.323 . . 1 . . . . 125 A CA . 17343 1 776 . 1 1 125 125 ALA CB C 13 16.523 . . 1 . . . . 125 A CB . 17343 1 777 . 1 1 125 125 ALA N N 15 122.979 . . 1 . . . . 125 A N . 17343 1 778 . 1 1 127 127 GLN H H 1 10.073 . . 1 . . . . 127 Q HN . 17343 1 779 . 1 1 127 127 GLN HE21 H 1 7.131 . . 2 . . . . 127 Q HE21 . 17343 1 780 . 1 1 127 127 GLN HE22 H 1 6.920 . . 2 . . . . 127 Q HE22 . 17343 1 781 . 1 1 127 127 GLN C C 13 175.568 . . 1 . . . . 127 Q C . 17343 1 782 . 1 1 127 127 GLN CA C 13 53.142 . . 1 . . . . 127 Q CA . 17343 1 783 . 1 1 127 127 GLN CB C 13 27.103 . . 1 . . . . 127 Q CB . 17343 1 784 . 1 1 127 127 GLN N N 15 126.769 . . 1 . . . . 127 Q N . 17343 1 785 . 1 1 127 127 GLN NE2 N 15 112.894 . . 1 . . . . 127 Q NE2 . 17343 1 786 . 1 1 128 128 PRO C C 13 179.838 . . 1 . . . . 128 P C . 17343 1 787 . 1 1 128 128 PRO CA C 13 66.614 . . 1 . . . . 128 P CA . 17343 1 788 . 1 1 128 128 PRO CB C 13 30.181 . . 1 . . . . 128 P CB . 17343 1 789 . 1 1 129 129 LEU H H 1 8.348 . . 1 . . . . 129 L HN . 17343 1 790 . 1 1 129 129 LEU HD11 H 1 0.749 . . 2 . . . . 129 L HD11 . 17343 1 791 . 1 1 129 129 LEU HD12 H 1 0.749 . . 2 . . . . 129 L HD11 . 17343 1 792 . 1 1 129 129 LEU HD13 H 1 0.749 . . 2 . . . . 129 L HD11 . 17343 1 793 . 1 1 129 129 LEU C C 13 178.347 . . 1 . . . . 129 L C . 17343 1 794 . 1 1 129 129 LEU CA C 13 57.076 . . 1 . . . . 129 L CA . 17343 1 795 . 1 1 129 129 LEU CB C 13 39.613 . . 1 . . . . 129 L CB . 17343 1 796 . 1 1 129 129 LEU CD1 C 13 24.625 . . 2 . . . . 129 L CD1 . 17343 1 797 . 1 1 129 129 LEU N N 15 115.980 . . 1 . . . . 129 L N . 17343 1 798 . 1 1 130 130 ASP H H 1 7.945 . . 1 . . . . 130 D HN . 17343 1 799 . 1 1 130 130 ASP C C 13 177.216 . . 1 . . . . 130 D C . 17343 1 800 . 1 1 130 130 ASP CA C 13 55.493 . . 1 . . . . 130 D CA . 17343 1 801 . 1 1 130 130 ASP CB C 13 40.864 . . 1 . . . . 130 D CB . 17343 1 802 . 1 1 130 130 ASP N N 15 117.457 . . 1 . . . . 130 D N . 17343 1 803 . 1 1 131 131 LEU H H 1 7.437 . . 1 . . . . 131 L HN . 17343 1 804 . 1 1 131 131 LEU HD11 H 1 0.685 . . 2 . . . . 131 L HD11 . 17343 1 805 . 1 1 131 131 LEU HD12 H 1 0.685 . . 2 . . . . 131 L HD11 . 17343 1 806 . 1 1 131 131 LEU HD13 H 1 0.685 . . 2 . . . . 131 L HD11 . 17343 1 807 . 1 1 131 131 LEU HD21 H 1 0.668 . . 2 . . . . 131 L HD21 . 17343 1 808 . 1 1 131 131 LEU HD22 H 1 0.668 . . 2 . . . . 131 L HD21 . 17343 1 809 . 1 1 131 131 LEU HD23 H 1 0.668 . . 2 . . . . 131 L HD21 . 17343 1 810 . 1 1 131 131 LEU C C 13 177.244 . . 1 . . . . 131 L C . 17343 1 811 . 1 1 131 131 LEU CA C 13 54.202 . . 1 . . . . 131 L CA . 17343 1 812 . 1 1 131 131 LEU CB C 13 40.889 . . 1 . . . . 131 L CB . 17343 1 813 . 1 1 131 131 LEU CD1 C 13 24.875 . . 2 . . . . 131 L CD1 . 17343 1 814 . 1 1 131 131 LEU CD2 C 13 22.057 . . 2 . . . . 131 L CD2 . 17343 1 815 . 1 1 131 131 LEU N N 15 118.440 . . 1 . . . . 131 L N . 17343 1 816 . 1 1 132 132 GLU H H 1 7.010 . . 1 . . . . 132 E HN . 17343 1 817 . 1 1 132 132 GLU C C 13 175.315 . . 1 . . . . 132 E C . 17343 1 818 . 1 1 132 132 GLU CA C 13 53.687 . . 1 . . . . 132 E CA . 17343 1 819 . 1 1 132 132 GLU CB C 13 28.858 . . 1 . . . . 132 E CB . 17343 1 820 . 1 1 132 132 GLU N N 15 120.449 . . 1 . . . . 132 E N . 17343 1 821 . 1 1 133 133 PRO C C 13 176.004 . . 1 . . . . 133 P C . 17343 1 822 . 1 1 133 133 PRO CA C 13 63.349 . . 1 . . . . 133 P CA . 17343 1 823 . 1 1 133 133 PRO CB C 13 30.994 . . 1 . . . . 133 P CB . 17343 1 824 . 1 1 134 134 ALA H H 1 7.624 . . 1 . . . . 134 A HN . 17343 1 825 . 1 1 134 134 ALA C C 13 176.716 . . 1 . . . . 134 A C . 17343 1 826 . 1 1 134 134 ALA CA C 13 50.749 . . 1 . . . . 134 A CA . 17343 1 827 . 1 1 134 134 ALA CB C 13 19.925 . . 1 . . . . 134 A CB . 17343 1 828 . 1 1 134 134 ALA N N 15 120.629 . . 1 . . . . 134 A N . 17343 1 829 . 1 1 135 135 LEU H H 1 8.184 . . 1 . . . . 135 L HN . 17343 1 830 . 1 1 135 135 LEU HD11 H 1 0.568 . . 2 . . . . 135 L HD11 . 17343 1 831 . 1 1 135 135 LEU HD12 H 1 0.568 . . 2 . . . . 135 L HD11 . 17343 1 832 . 1 1 135 135 LEU HD13 H 1 0.568 . . 2 . . . . 135 L HD11 . 17343 1 833 . 1 1 135 135 LEU HD21 H 1 0.600 . . 2 . . . . 135 L HD21 . 17343 1 834 . 1 1 135 135 LEU HD22 H 1 0.600 . . 2 . . . . 135 L HD21 . 17343 1 835 . 1 1 135 135 LEU HD23 H 1 0.600 . . 2 . . . . 135 L HD21 . 17343 1 836 . 1 1 135 135 LEU C C 13 176.319 . . 1 . . . . 135 L C . 17343 1 837 . 1 1 135 135 LEU CA C 13 52.218 . . 1 . . . . 135 L CA . 17343 1 838 . 1 1 135 135 LEU CB C 13 39.598 . . 1 . . . . 135 L CB . 17343 1 839 . 1 1 135 135 LEU CD1 C 13 25.804 . . 2 . . . . 135 L CD1 . 17343 1 840 . 1 1 135 135 LEU CD2 C 13 22.610 . . 2 . . . . 135 L CD2 . 17343 1 841 . 1 1 135 135 LEU N N 15 121.709 . . 1 . . . . 135 L N . 17343 1 842 . 1 1 137 137 PRO C C 13 174.972 . . 1 . . . . 137 P C . 17343 1 843 . 1 1 137 137 PRO CA C 13 63.279 . . 1 . . . . 137 P CA . 17343 1 844 . 1 1 138 138 GLY H H 1 8.739 . . 1 . . . . 138 G HN . 17343 1 845 . 1 1 138 138 GLY CA C 13 44.538 . . 1 . . . . 138 G CA . 17343 1 846 . 1 1 138 138 GLY N N 15 111.183 . . 1 . . . . 138 G N . 17343 1 847 . 1 1 139 139 SER H H 1 7.554 . . 1 . . . . 139 S HN . 17343 1 848 . 1 1 139 139 SER C C 13 173.237 . . 1 . . . . 139 S C . 17343 1 849 . 1 1 139 139 SER CA C 13 59.292 . . 1 . . . . 139 S CA . 17343 1 850 . 1 1 139 139 SER CB C 13 63.383 . . 1 . . . . 139 S CB . 17343 1 851 . 1 1 139 139 SER N N 15 116.217 . . 1 . . . . 139 S N . 17343 1 852 . 1 1 140 140 ARG H H 1 8.748 . . 1 . . . . 140 R HN . 17343 1 853 . 1 1 140 140 ARG C C 13 173.918 . . 1 . . . . 140 R C . 17343 1 854 . 1 1 140 140 ARG CA C 13 54.398 . . 1 . . . . 140 R CA . 17343 1 855 . 1 1 140 140 ARG CB C 13 31.736 . . 1 . . . . 140 R CB . 17343 1 856 . 1 1 140 140 ARG N N 15 123.530 . . 1 . . . . 140 R N . 17343 1 857 . 1 1 141 141 VAL H H 1 8.376 . . 1 . . . . 141 V HN . 17343 1 858 . 1 1 141 141 VAL HG11 H 1 0.618 . . 2 . . . . 141 V HG11 . 17343 1 859 . 1 1 141 141 VAL HG12 H 1 0.618 . . 2 . . . . 141 V HG11 . 17343 1 860 . 1 1 141 141 VAL HG13 H 1 0.618 . . 2 . . . . 141 V HG11 . 17343 1 861 . 1 1 141 141 VAL HG21 H 1 0.558 . . 2 . . . . 141 V HG21 . 17343 1 862 . 1 1 141 141 VAL HG22 H 1 0.558 . . 2 . . . . 141 V HG21 . 17343 1 863 . 1 1 141 141 VAL HG23 H 1 0.558 . . 2 . . . . 141 V HG21 . 17343 1 864 . 1 1 141 141 VAL C C 13 175.085 . . 1 . . . . 141 V C . 17343 1 865 . 1 1 141 141 VAL CA C 13 61.340 . . 1 . . . . 141 V CA . 17343 1 866 . 1 1 141 141 VAL CB C 13 31.830 . . 1 . . . . 141 V CB . 17343 1 867 . 1 1 141 141 VAL CG1 C 13 21.072 . . 2 . . . . 141 V CG1 . 17343 1 868 . 1 1 141 141 VAL CG2 C 13 21.065 . . 2 . . . . 141 V CG2 . 17343 1 869 . 1 1 141 141 VAL N N 15 124.628 . . 1 . . . . 141 V N . 17343 1 870 . 1 1 142 142 ILE H H 1 9.371 . . 1 . . . . 142 I HN . 17343 1 871 . 1 1 142 142 ILE HD11 H 1 0.589 . . 1 . . . . 142 I HD11 . 17343 1 872 . 1 1 142 142 ILE HD12 H 1 0.589 . . 1 . . . . 142 I HD11 . 17343 1 873 . 1 1 142 142 ILE HD13 H 1 0.589 . . 1 . . . . 142 I HD11 . 17343 1 874 . 1 1 142 142 ILE C C 13 174.278 . . 1 . . . . 142 I C . 17343 1 875 . 1 1 142 142 ILE CA C 13 59.919 . . 1 . . . . 142 I CA . 17343 1 876 . 1 1 142 142 ILE CB C 13 38.564 . . 1 . . . . 142 I CB . 17343 1 877 . 1 1 142 142 ILE CD1 C 13 13.394 . . 1 . . . . 142 I CD1 . 17343 1 878 . 1 1 142 142 ILE N N 15 130.384 . . 1 . . . . 142 I N . 17343 1 879 . 1 1 143 143 LEU H H 1 8.386 . . 1 . . . . 143 L HN . 17343 1 880 . 1 1 143 143 LEU HD11 H 1 0.781 . . 2 . . . . 143 L HD11 . 17343 1 881 . 1 1 143 143 LEU HD12 H 1 0.781 . . 2 . . . . 143 L HD11 . 17343 1 882 . 1 1 143 143 LEU HD13 H 1 0.781 . . 2 . . . . 143 L HD11 . 17343 1 883 . 1 1 143 143 LEU HD21 H 1 0.759 . . 2 . . . . 143 L HD21 . 17343 1 884 . 1 1 143 143 LEU HD22 H 1 0.759 . . 2 . . . . 143 L HD21 . 17343 1 885 . 1 1 143 143 LEU HD23 H 1 0.759 . . 2 . . . . 143 L HD21 . 17343 1 886 . 1 1 143 143 LEU C C 13 174.957 . . 1 . . . . 143 L C . 17343 1 887 . 1 1 143 143 LEU CA C 13 51.931 . . 1 . . . . 143 L CA . 17343 1 888 . 1 1 143 143 LEU CB C 13 39.767 . . 1 . . . . 143 L CB . 17343 1 889 . 1 1 143 143 LEU CD1 C 13 24.823 . . 2 . . . . 143 L CD1 . 17343 1 890 . 1 1 143 143 LEU CD2 C 13 22.592 . . 2 . . . . 143 L CD2 . 17343 1 891 . 1 1 143 143 LEU N N 15 126.928 . . 1 . . . . 143 L N . 17343 1 892 . 1 1 144 144 PRO C C 13 176.346 . . 1 . . . . 144 P C . 17343 1 893 . 1 1 144 144 PRO CA C 13 61.993 . . 1 . . . . 144 P CA . 17343 1 894 . 1 1 144 144 PRO CB C 13 31.025 . . 1 . . . . 144 P CB . 17343 1 895 . 1 1 145 145 THR H H 1 8.113 . . 1 . . . . 145 T HN . 17343 1 896 . 1 1 145 145 THR C C 13 172.843 . . 1 . . . . 145 T C . 17343 1 897 . 1 1 145 145 THR CA C 13 58.998 . . 1 . . . . 145 T CA . 17343 1 898 . 1 1 145 145 THR CB C 13 69.090 . . 1 . . . . 145 T CB . 17343 1 899 . 1 1 145 145 THR N N 15 116.578 . . 1 . . . . 145 T N . 17343 1 900 . 1 1 146 146 PRO C C 13 176.773 . . 1 . . . . 146 P C . 17343 1 901 . 1 1 146 146 PRO CA C 13 62.571 . . 1 . . . . 146 P CA . 17343 1 902 . 1 1 146 146 PRO CB C 13 31.081 . . 1 . . . . 146 P CB . 17343 1 903 . 1 1 147 147 GLU H H 1 8.396 . . 1 . . . . 147 E HN . 17343 1 904 . 1 1 147 147 GLU C C 13 176.346 . . 1 . . . . 147 E C . 17343 1 905 . 1 1 147 147 GLU CA C 13 56.059 . . 1 . . . . 147 E CA . 17343 1 906 . 1 1 147 147 GLU CB C 13 29.534 . . 1 . . . . 147 E CB . 17343 1 907 . 1 1 147 147 GLU N N 15 120.974 . . 1 . . . . 147 E N . 17343 1 908 . 1 1 148 148 GLU H H 1 8.269 . . 1 . . . . 148 E HN . 17343 1 909 . 1 1 148 148 GLU C C 13 175.342 . . 1 . . . . 148 E C . 17343 1 910 . 1 1 148 148 GLU CA C 13 55.906 . . 1 . . . . 148 E CA . 17343 1 911 . 1 1 148 148 GLU CB C 13 29.432 . . 1 . . . . 148 E CB . 17343 1 912 . 1 1 148 148 GLU N N 15 122.145 . . 1 . . . . 148 E N . 17343 1 913 . 1 1 149 149 GLN H H 1 7.904 . . 1 . . . . 149 Q HN . 17343 1 914 . 1 1 149 149 GLN HE21 H 1 7.409 . . 2 . . . . 149 Q HE21 . 17343 1 915 . 1 1 149 149 GLN HE22 H 1 6.691 . . 2 . . . . 149 Q HE22 . 17343 1 916 . 1 1 149 149 GLN C C 13 180.464 . . 1 . . . . 149 Q C . 17343 1 917 . 1 1 149 149 GLN CA C 13 56.684 . . 1 . . . . 149 Q CA . 17343 1 918 . 1 1 149 149 GLN N N 15 126.374 . . 1 . . . . 149 Q N . 17343 1 919 . 1 1 149 149 GLN NE2 N 15 112.573 . . 1 . . . . 149 Q NE2 . 17343 1 stop_ save_