data_26908 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26908 _Entry.Title ; Backbone 1H, 13C, 15N chemical shift assignments of portions of Thermotoga maritima flagellar motor proteins FliG (N-terminal domain; FliGN) and FliF (C-terminal domain; FliFC) in complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-09-23 _Entry.Accession_date 2016-09-23 _Entry.Last_release_date 2016-09-26 _Entry.Original_release_date 2016-09-26 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details ; Backbone 1H, 13C, 15N chemical shift assignments of portions of Thermotoga maritima flagellar motor proteins FliG (N-terminal domain; FliGN) and FliF (C-terminal domain; FliFC) in complex, produced from cleaved fusion protein. ; _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Robert Levenson . . . . 26908 2 Frederick Dahlquist . W. . . 26908 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' . 26908 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26908 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 267 26908 '15N chemical shifts' 131 26908 '1H chemical shifts' 131 26908 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-02-15 . original BMRB . 26908 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18309 'FliGn homodimer' 26908 BMRB 18310 'Labeled FliGn bound to unlabeled FliFc peptide' 26908 stop_ save_ ############### # Citations # ############### save_FliF-FliG _Citation.Sf_category citations _Citation.Sf_framecode FliF-FliG _Citation.Entry_ID 26908 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 28089452 _Citation.Full_citation . _Citation.Title ; Co-Folding of a FliF-FliG Split Domain Forms the Basis of the MS:C Ring Interface within the Bacterial Flagellar Motor ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 25 _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 317 _Citation.Page_last 328 _Citation.Year 2017 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Michael Lynch . J. . . 26908 1 2 Robert Levenson . W. . . 26908 1 3 Eun Kim . A. . . 26908 1 4 Ria Sircar . J. . . 26908 1 5 David Blair . F. . . 26908 1 6 Frederick Dahlquist . W. . . 26908 1 7 Brian Crane . R. . . 26908 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID NMR 26908 1 crystallography 26908 1 flagellum 26908 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26908 _Assembly.ID 1 _Assembly.Name FliGn-FliFc _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 18620 _Assembly.Enzyme_commission_number . _Assembly.Details ; 15N,13C uniformly labeled FliFc and FliGn bound in complex, produced as fusion protein in one polypeptide then cut by TEV to split. ; _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 FliGn 1 $FliGn A . yes native no no . . . 26908 1 2 FliFc 2 $FliFc B . no native no no . . . 26908 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Anchors and positions bacterial flagellar motor C-ring relative to MS-ring' 26908 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_FliGn _Entity.Sf_category entity _Entity.Sf_framecode FliGn _Entity.Entry_ID 26908 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name FliGn _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMPEKKIDGRRKAAVLLVA LGPEKAAQVMKHLDEETVEQ LVVEIANIGRVTPEEKKQVL EEFLSLAKAKEMISEGGIEY AKKVLEKAFGPERARKIIER LTSS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 104 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . no BMRB 18309 . FliGn . . . . . . . . . . . . . . 26908 1 . no GB AAD35312 . 'flagellar motor switch protein FliG [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 1 . no GB ABQ46724 . 'flagellar motor switch protein FliG [Thermotoga petrophila RKU-1]' . . . . . . . . . . . . . . 26908 1 . no GB ACB09081 . 'flagellar motor switch protein FliG [Thermotoga sp. RQ2]' . . . . . . . . . . . . . . 26908 1 . no GB ADA66942 . 'flagellar motor switch protein FliG [Thermotoga naphthophila RKU-10]' . . . . . . . . . . . . . . 26908 1 . no GB AGL49144 . 'Flagellar motor switch protein FliG [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 1 . no REF NP_228035 . 'flagellar motor switch protein G [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 1 . no REF WP_004082903 . 'flagellar motor switch protein FliG [Thermotoga maritima]' . . . . . . . . . . . . . . 26908 1 . no REF WP_008193872 . 'MULTISPECIES: flagellar motor switch protein FliG [Thermotoga]' . . . . . . . . . . . . . . 26908 1 . no REF WP_011943308 . 'MULTISPECIES: flagellar motor switch protein FliG [Thermotoga]' . . . . . . . . . . . . . . 26908 1 . no REF WP_012310706 . 'MULTISPECIES: flagellar motor switch protein FliG [Thermotoga]' . . . . . . . . . . . . . . 26908 1 . no SP Q9WY63 . 'RecName: Full=Flagellar motor switch protein FliG' . . . . . . . . . . . . . . 26908 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'flagellar assembly' 26908 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 -1 GLY . 26908 1 2 0 HIS . 26908 1 3 1 MET . 26908 1 4 2 PRO . 26908 1 5 3 GLU . 26908 1 6 4 LYS . 26908 1 7 5 LYS . 26908 1 8 6 ILE . 26908 1 9 7 ASP . 26908 1 10 8 GLY . 26908 1 11 9 ARG . 26908 1 12 10 ARG . 26908 1 13 11 LYS . 26908 1 14 12 ALA . 26908 1 15 13 ALA . 26908 1 16 14 VAL . 26908 1 17 15 LEU . 26908 1 18 16 LEU . 26908 1 19 17 VAL . 26908 1 20 18 ALA . 26908 1 21 19 LEU . 26908 1 22 20 GLY . 26908 1 23 21 PRO . 26908 1 24 22 GLU . 26908 1 25 23 LYS . 26908 1 26 24 ALA . 26908 1 27 25 ALA . 26908 1 28 26 GLN . 26908 1 29 27 VAL . 26908 1 30 28 MET . 26908 1 31 29 LYS . 26908 1 32 30 HIS . 26908 1 33 31 LEU . 26908 1 34 32 ASP . 26908 1 35 33 GLU . 26908 1 36 34 GLU . 26908 1 37 35 THR . 26908 1 38 36 VAL . 26908 1 39 37 GLU . 26908 1 40 38 GLN . 26908 1 41 39 LEU . 26908 1 42 40 VAL . 26908 1 43 41 VAL . 26908 1 44 42 GLU . 26908 1 45 43 ILE . 26908 1 46 44 ALA . 26908 1 47 45 ASN . 26908 1 48 46 ILE . 26908 1 49 47 GLY . 26908 1 50 48 ARG . 26908 1 51 49 VAL . 26908 1 52 50 THR . 26908 1 53 51 PRO . 26908 1 54 52 GLU . 26908 1 55 53 GLU . 26908 1 56 54 LYS . 26908 1 57 55 LYS . 26908 1 58 56 GLN . 26908 1 59 57 VAL . 26908 1 60 58 LEU . 26908 1 61 59 GLU . 26908 1 62 60 GLU . 26908 1 63 61 PHE . 26908 1 64 62 LEU . 26908 1 65 63 SER . 26908 1 66 64 LEU . 26908 1 67 65 ALA . 26908 1 68 66 LYS . 26908 1 69 67 ALA . 26908 1 70 68 LYS . 26908 1 71 69 GLU . 26908 1 72 70 MET . 26908 1 73 71 ILE . 26908 1 74 72 SER . 26908 1 75 73 GLU . 26908 1 76 74 GLY . 26908 1 77 75 GLY . 26908 1 78 76 ILE . 26908 1 79 77 GLU . 26908 1 80 78 TYR . 26908 1 81 79 ALA . 26908 1 82 80 LYS . 26908 1 83 81 LYS . 26908 1 84 82 VAL . 26908 1 85 83 LEU . 26908 1 86 84 GLU . 26908 1 87 85 LYS . 26908 1 88 86 ALA . 26908 1 89 87 PHE . 26908 1 90 88 GLY . 26908 1 91 89 PRO . 26908 1 92 90 GLU . 26908 1 93 91 ARG . 26908 1 94 92 ALA . 26908 1 95 93 ARG . 26908 1 96 94 LYS . 26908 1 97 95 ILE . 26908 1 98 96 ILE . 26908 1 99 97 GLU . 26908 1 100 98 ARG . 26908 1 101 99 LEU . 26908 1 102 100 THR . 26908 1 103 101 SER . 26908 1 104 102 SER . 26908 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 26908 1 . HIS 2 2 26908 1 . MET 3 3 26908 1 . PRO 4 4 26908 1 . GLU 5 5 26908 1 . LYS 6 6 26908 1 . LYS 7 7 26908 1 . ILE 8 8 26908 1 . ASP 9 9 26908 1 . GLY 10 10 26908 1 . ARG 11 11 26908 1 . ARG 12 12 26908 1 . LYS 13 13 26908 1 . ALA 14 14 26908 1 . ALA 15 15 26908 1 . VAL 16 16 26908 1 . LEU 17 17 26908 1 . LEU 18 18 26908 1 . VAL 19 19 26908 1 . ALA 20 20 26908 1 . LEU 21 21 26908 1 . GLY 22 22 26908 1 . PRO 23 23 26908 1 . GLU 24 24 26908 1 . LYS 25 25 26908 1 . ALA 26 26 26908 1 . ALA 27 27 26908 1 . GLN 28 28 26908 1 . VAL 29 29 26908 1 . MET 30 30 26908 1 . LYS 31 31 26908 1 . HIS 32 32 26908 1 . LEU 33 33 26908 1 . ASP 34 34 26908 1 . GLU 35 35 26908 1 . GLU 36 36 26908 1 . THR 37 37 26908 1 . VAL 38 38 26908 1 . GLU 39 39 26908 1 . GLN 40 40 26908 1 . LEU 41 41 26908 1 . VAL 42 42 26908 1 . VAL 43 43 26908 1 . GLU 44 44 26908 1 . ILE 45 45 26908 1 . ALA 46 46 26908 1 . ASN 47 47 26908 1 . ILE 48 48 26908 1 . GLY 49 49 26908 1 . ARG 50 50 26908 1 . VAL 51 51 26908 1 . THR 52 52 26908 1 . PRO 53 53 26908 1 . GLU 54 54 26908 1 . GLU 55 55 26908 1 . LYS 56 56 26908 1 . LYS 57 57 26908 1 . GLN 58 58 26908 1 . VAL 59 59 26908 1 . LEU 60 60 26908 1 . GLU 61 61 26908 1 . GLU 62 62 26908 1 . PHE 63 63 26908 1 . LEU 64 64 26908 1 . SER 65 65 26908 1 . LEU 66 66 26908 1 . ALA 67 67 26908 1 . LYS 68 68 26908 1 . ALA 69 69 26908 1 . LYS 70 70 26908 1 . GLU 71 71 26908 1 . MET 72 72 26908 1 . ILE 73 73 26908 1 . SER 74 74 26908 1 . GLU 75 75 26908 1 . GLY 76 76 26908 1 . GLY 77 77 26908 1 . ILE 78 78 26908 1 . GLU 79 79 26908 1 . TYR 80 80 26908 1 . ALA 81 81 26908 1 . LYS 82 82 26908 1 . LYS 83 83 26908 1 . VAL 84 84 26908 1 . LEU 85 85 26908 1 . GLU 86 86 26908 1 . LYS 87 87 26908 1 . ALA 88 88 26908 1 . PHE 89 89 26908 1 . GLY 90 90 26908 1 . PRO 91 91 26908 1 . GLU 92 92 26908 1 . ARG 93 93 26908 1 . ALA 94 94 26908 1 . ARG 95 95 26908 1 . LYS 96 96 26908 1 . ILE 97 97 26908 1 . ILE 98 98 26908 1 . GLU 99 99 26908 1 . ARG 100 100 26908 1 . LEU 101 101 26908 1 . THR 102 102 26908 1 . SER 103 103 26908 1 . SER 104 104 26908 1 stop_ save_ save_FliFc _Entity.Sf_category entity _Entity.Sf_framecode FliFc _Entity.Entry_ID 26908 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name FliFc _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MVSPEEKELLELLEELENIF SRSPSDIAEIVRLWFFERGL EDHHHHHHHHASENLYFQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 58 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . no GB AAD35313 . 'flagellar M-ring protein [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 2 . no GB ABQ46723 . 'flagellar M-ring protein FliF [Thermotoga petrophila RKU-1]' . . . . . . . . . . . . . . 26908 2 . no GB ACB09080 . 'flagellar M-ring protein FliF [Thermotoga sp. RQ2]' . . . . . . . . . . . . . . 26908 2 . no GB ADA66943 . 'flagellar M-ring protein FliF [Thermotoga naphthophila RKU-10]' . . . . . . . . . . . . . . 26908 2 . no GB AGL49145 . 'Flagellar M-ring protein FliF [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 2 . no REF NP_228036 . 'flagellar M-ring protein [Thermotoga maritima MSB8]' . . . . . . . . . . . . . . 26908 2 . no REF WP_004082905 . 'flagellar M-ring protein FliF [Thermotoga maritima]' . . . . . . . . . . . . . . 26908 2 . no REF WP_008193870 . 'flagellar M-ring protein FliF [Thermotoga sp. EMP]' . . . . . . . . . . . . . . 26908 2 . no REF WP_011943307 . 'MULTISPECIES: flagellar M-ring protein FliF [Thermotoga]' . . . . . . . . . . . . . . 26908 2 . no REF WP_012310705 . 'flagellar M-ring protein FliF [Thermotoga sp. RQ2]' . . . . . . . . . . . . . . 26908 2 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'flagellar assembly' 26908 2 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 . MET . 26908 2 2 . VAL . 26908 2 3 . SER . 26908 2 4 . PRO . 26908 2 5 . GLU . 26908 2 6 . GLU . 26908 2 7 . LYS . 26908 2 8 . GLU . 26908 2 9 . LEU . 26908 2 10 . LEU . 26908 2 11 . GLU . 26908 2 12 . LEU . 26908 2 13 . LEU . 26908 2 14 . GLU . 26908 2 15 . GLU . 26908 2 16 . LEU . 26908 2 17 . GLU . 26908 2 18 . ASN . 26908 2 19 . ILE . 26908 2 20 . PHE . 26908 2 21 . SER . 26908 2 22 . ARG . 26908 2 23 . SER . 26908 2 24 . PRO . 26908 2 25 . SER . 26908 2 26 . ASP . 26908 2 27 . ILE . 26908 2 28 . ALA . 26908 2 29 . GLU . 26908 2 30 . ILE . 26908 2 31 . VAL . 26908 2 32 . ARG . 26908 2 33 . LEU . 26908 2 34 . TRP . 26908 2 35 . PHE . 26908 2 36 . PHE . 26908 2 37 . GLU . 26908 2 38 . ARG . 26908 2 39 . GLY . 26908 2 40 . LEU . 26908 2 41 . GLU . 26908 2 42 . ASP . 26908 2 43 . HIS . 26908 2 44 . HIS . 26908 2 45 . HIS . 26908 2 46 . HIS . 26908 2 47 . HIS . 26908 2 48 . HIS . 26908 2 49 . HIS . 26908 2 50 . HIS . 26908 2 51 . ALA . 26908 2 52 . SER . 26908 2 53 . GLU . 26908 2 54 . ASN . 26908 2 55 . LEU . 26908 2 56 . TYR . 26908 2 57 . PHE . 26908 2 58 . GLN . 26908 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26908 2 . VAL 2 2 26908 2 . SER 3 3 26908 2 . PRO 4 4 26908 2 . GLU 5 5 26908 2 . GLU 6 6 26908 2 . LYS 7 7 26908 2 . GLU 8 8 26908 2 . LEU 9 9 26908 2 . LEU 10 10 26908 2 . GLU 11 11 26908 2 . LEU 12 12 26908 2 . LEU 13 13 26908 2 . GLU 14 14 26908 2 . GLU 15 15 26908 2 . LEU 16 16 26908 2 . GLU 17 17 26908 2 . ASN 18 18 26908 2 . ILE 19 19 26908 2 . PHE 20 20 26908 2 . SER 21 21 26908 2 . ARG 22 22 26908 2 . SER 23 23 26908 2 . PRO 24 24 26908 2 . SER 25 25 26908 2 . ASP 26 26 26908 2 . ILE 27 27 26908 2 . ALA 28 28 26908 2 . GLU 29 29 26908 2 . ILE 30 30 26908 2 . VAL 31 31 26908 2 . ARG 32 32 26908 2 . LEU 33 33 26908 2 . TRP 34 34 26908 2 . PHE 35 35 26908 2 . PHE 36 36 26908 2 . GLU 37 37 26908 2 . ARG 38 38 26908 2 . GLY 39 39 26908 2 . LEU 40 40 26908 2 . GLU 41 41 26908 2 . ASP 42 42 26908 2 . HIS 43 43 26908 2 . HIS 44 44 26908 2 . HIS 45 45 26908 2 . HIS 46 46 26908 2 . HIS 47 47 26908 2 . HIS 48 48 26908 2 . HIS 49 49 26908 2 . HIS 50 50 26908 2 . ALA 51 51 26908 2 . SER 52 52 26908 2 . GLU 53 53 26908 2 . ASN 54 54 26908 2 . LEU 55 55 26908 2 . TYR 56 56 26908 2 . PHE 57 57 26908 2 . GLN 58 58 26908 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26908 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $FliGn . 2336 organism . 'Thermotoga maritima' 'Thermotoga maritima' . . Bacteria . Thermotoga maritima . . . . . . . . . . . . . 26908 1 2 2 $FliFc . 2336 organism . 'Thermotoga maritima' 'Thermotoga maritima' . . Bacteria . Thermotoga maritima . . . . . . . . . . . . . 26908 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 26908 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $FliGn . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pJY5 . . 'complex expressed fusion protein, polypeptide split by TEV protease during purification' 26908 1 2 2 $FliFc . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pJY5 . . 'complex expressed fusion protein, polypeptide split by TEV protease during purification' 26908 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26908 _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 FliGn '[U-13C; U-15N; U-2H]' . . 1 $FliGn . . 400 . . uM 100 . . . 26908 1 2 FliFc '[U-13C; U-15N; U-2H]' . . 2 $FliFc . . 400 . . uM 100 . . . 26908 1 3 'Sodium Phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 26908 1 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 26908 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26908 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26908 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 26908 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 125 . mM 26908 1 pH 6.5 . pH 26908 1 pressure 1 . atm 26908 1 temperature 313 . K 26908 1 stop_ save_ ############################ # Computer software used # ############################ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 26908 _Software.ID 1 _Software.Name ANSIG _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kraulis . . 26908 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26908 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26908 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26908 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26908 2 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 26908 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26908 _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 . 800 . . . 26908 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 26908 _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 . . . . . . . . . . . . . . . . 26908 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26908 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26908 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26908 1 5 '3D HN(COCA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26908 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 26908 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26908 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26908 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26908 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 26908 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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' . . . 26908 1 2 '3D HNCA' . . . 26908 1 3 '3D HNCACB' . . . 26908 1 4 '3D HN(CO)CA' . . . 26908 1 5 '3D HN(COCA)CB' . . . 26908 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $ANSIG . . 26908 1 2 $NMRPipe . . 26908 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 4 4 PRO CA C 13 60.23 0.1 . 1 . . . . 2 PRO CA . 26908 1 2 . 1 1 4 4 PRO CB C 13 28.59 0.1 . 1 . . . . 2 PRO CB . 26908 1 3 . 1 1 5 5 GLU H H 1 8.463 0.02 . 1 . . . . 3 GLU H . 26908 1 4 . 1 1 5 5 GLU CA C 13 53.65 0.1 . 1 . . . . 3 GLU CA . 26908 1 5 . 1 1 5 5 GLU CB C 13 27.06 0.1 . 1 . . . . 3 GLU CB . 26908 1 6 . 1 1 5 5 GLU N N 15 121.85 0.1 . 1 . . . . 3 GLU N . 26908 1 7 . 1 1 6 6 LYS H H 1 8.256 0.02 . 1 . . . . 4 LYS H . 26908 1 8 . 1 1 6 6 LYS CA C 13 52.96 0.1 . 1 . . . . 4 LYS CA . 26908 1 9 . 1 1 6 6 LYS CB C 13 29.57 0.1 . 1 . . . . 4 LYS CB . 26908 1 10 . 1 1 6 6 LYS N N 15 123.16 0.1 . 1 . . . . 4 LYS N . 26908 1 11 . 1 1 7 7 LYS H H 1 8.284 0.02 . 1 . . . . 5 LYS H . 26908 1 12 . 1 1 7 7 LYS CA C 13 52.96 0.1 . 1 . . . . 5 LYS CA . 26908 1 13 . 1 1 7 7 LYS CB C 13 29.52 0.1 . 1 . . . . 5 LYS CB . 26908 1 14 . 1 1 7 7 LYS N N 15 124.35 0.1 . 1 . . . . 5 LYS N . 26908 1 15 . 1 1 8 8 ILE H H 1 8.154 0.02 . 1 . . . . 6 ILE H . 26908 1 16 . 1 1 8 8 ILE CA C 13 57.87 0.1 . 1 . . . . 6 ILE CA . 26908 1 17 . 1 1 8 8 ILE CB C 13 35.72 0.1 . 1 . . . . 6 ILE CB . 26908 1 18 . 1 1 8 8 ILE N N 15 123.86 0.1 . 1 . . . . 6 ILE N . 26908 1 19 . 1 1 9 9 ASP H H 1 8.339 0.02 . 1 . . . . 7 ASP H . 26908 1 20 . 1 1 9 9 ASP CA C 13 51.18 0.1 . 1 . . . . 7 ASP CA . 26908 1 21 . 1 1 9 9 ASP CB C 13 39.65 0.1 . 1 . . . . 7 ASP CB . 26908 1 22 . 1 1 9 9 ASP N N 15 126.69 0.1 . 1 . . . . 7 ASP N . 26908 1 23 . 1 1 10 10 GLY H H 1 8.761 0.02 . 1 . . . . 8 GLY H . 26908 1 24 . 1 1 10 10 GLY CA C 13 44.84 0.1 . 1 . . . . 8 GLY CA . 26908 1 25 . 1 1 10 10 GLY N N 15 111.1 0.1 . 1 . . . . 8 GLY N . 26908 1 26 . 1 1 11 11 ARG H H 1 7.899 0.02 . 1 . . . . 9 ARG H . 26908 1 27 . 1 1 11 11 ARG CA C 13 56.75 0.1 . 1 . . . . 9 ARG CA . 26908 1 28 . 1 1 11 11 ARG CB C 13 26.14 0.1 . 1 . . . . 9 ARG CB . 26908 1 29 . 1 1 11 11 ARG N N 15 118.95 0.1 . 1 . . . . 9 ARG N . 26908 1 30 . 1 1 12 12 ARG H H 1 7.223 0.02 . 1 . . . . 10 ARG H . 26908 1 31 . 1 1 12 12 ARG CA C 13 55.79 0.1 . 1 . . . . 10 ARG CA . 26908 1 32 . 1 1 12 12 ARG CB C 13 25.67 0.1 . 1 . . . . 10 ARG CB . 26908 1 33 . 1 1 12 12 ARG N N 15 119.47 0.1 . 1 . . . . 10 ARG N . 26908 1 34 . 1 1 13 13 LYS H H 1 7.923 0.02 . 1 . . . . 11 LYS H . 26908 1 35 . 1 1 13 13 LYS CA C 13 57.5 0.1 . 1 . . . . 11 LYS CA . 26908 1 36 . 1 1 13 13 LYS CB C 13 27.43 0.1 . 1 . . . . 11 LYS CB . 26908 1 37 . 1 1 13 13 LYS N N 15 118.36 0.1 . 1 . . . . 11 LYS N . 26908 1 38 . 1 1 14 14 ALA H H 1 7.638 0.02 . 1 . . . . 12 ALA H . 26908 1 39 . 1 1 14 14 ALA CA C 13 52.34 0.1 . 1 . . . . 12 ALA CA . 26908 1 40 . 1 1 14 14 ALA CB C 13 16.55 0.1 . 1 . . . . 12 ALA CB . 26908 1 41 . 1 1 14 14 ALA N N 15 118.01 0.1 . 1 . . . . 12 ALA N . 26908 1 42 . 1 1 15 15 ALA H H 1 7.794 0.02 . 1 . . . . 13 ALA H . 26908 1 43 . 1 1 15 15 ALA CA C 13 52.51 0.1 . 1 . . . . 13 ALA CA . 26908 1 44 . 1 1 15 15 ALA CB C 13 15.76 0.1 . 1 . . . . 13 ALA CB . 26908 1 45 . 1 1 15 15 ALA N N 15 119.24 0.1 . 1 . . . . 13 ALA N . 26908 1 46 . 1 1 16 16 VAL H H 1 8.815 0.02 . 1 . . . . 14 VAL H . 26908 1 47 . 1 1 16 16 VAL CA C 13 64 0.1 . 1 . . . . 14 VAL CA . 26908 1 48 . 1 1 16 16 VAL CB C 13 27.99 0.1 . 1 . . . . 14 VAL CB . 26908 1 49 . 1 1 16 16 VAL N N 15 118.59 0.1 . 1 . . . . 14 VAL N . 26908 1 50 . 1 1 17 17 LEU H H 1 8.226 0.02 . 1 . . . . 15 LEU H . 26908 1 51 . 1 1 17 17 LEU CA C 13 54.86 0.1 . 1 . . . . 15 LEU CA . 26908 1 52 . 1 1 17 17 LEU CB C 13 38.61 0.1 . 1 . . . . 15 LEU CB . 26908 1 53 . 1 1 17 17 LEU N N 15 120.78 0.1 . 1 . . . . 15 LEU N . 26908 1 54 . 1 1 18 18 LEU H H 1 7.949 0.02 . 1 . . . . 16 LEU H . 26908 1 55 . 1 1 18 18 LEU CA C 13 55.15 0.1 . 1 . . . . 16 LEU CA . 26908 1 56 . 1 1 18 18 LEU CB C 13 36.84 0.1 . 1 . . . . 16 LEU CB . 26908 1 57 . 1 1 18 18 LEU N N 15 117.19 0.1 . 1 . . . . 16 LEU N . 26908 1 58 . 1 1 19 19 VAL H H 1 8.68 0.02 . 1 . . . . 17 VAL H . 26908 1 59 . 1 1 19 19 VAL CA C 13 63.26 0.1 . 1 . . . . 17 VAL CA . 26908 1 60 . 1 1 19 19 VAL CB C 13 27.94 0.1 . 1 . . . . 17 VAL CB . 26908 1 61 . 1 1 19 19 VAL N N 15 122.75 0.1 . 1 . . . . 17 VAL N . 26908 1 62 . 1 1 20 20 ALA H H 1 8.277 0.02 . 1 . . . . 18 ALA H . 26908 1 63 . 1 1 20 20 ALA CA C 13 51.48 0.1 . 1 . . . . 18 ALA CA . 26908 1 64 . 1 1 20 20 ALA CB C 13 13.68 0.1 . 1 . . . . 18 ALA CB . 26908 1 65 . 1 1 20 20 ALA N N 15 123.93 0.1 . 1 . . . . 18 ALA N . 26908 1 66 . 1 1 21 21 LEU H H 1 7.529 0.02 . 1 . . . . 19 LEU H . 26908 1 67 . 1 1 21 21 LEU CA C 13 53.61 0.1 . 1 . . . . 19 LEU CA . 26908 1 68 . 1 1 21 21 LEU CB C 13 44.3 0.1 . 1 . . . . 19 LEU CB . 26908 1 69 . 1 1 21 21 LEU N N 15 116.57 0.1 . 1 . . . . 19 LEU N . 26908 1 70 . 1 1 22 22 GLY H H 1 7.233 0.02 . 1 . . . . 20 GLY H . 26908 1 71 . 1 1 22 22 GLY CA C 13 40.86 0.1 . 1 . . . . 20 GLY CA . 26908 1 72 . 1 1 22 22 GLY N N 15 106.98 0.1 . 1 . . . . 20 GLY N . 26908 1 73 . 1 1 23 23 PRO CA C 13 63.1 0.1 . 1 . . . . 21 PRO CA . 26908 1 74 . 1 1 24 24 GLU H H 1 8.309 0.02 . 1 . . . . 22 GLU H . 26908 1 75 . 1 1 24 24 GLU CA C 13 56.99 0.1 . 1 . . . . 22 GLU CA . 26908 1 76 . 1 1 24 24 GLU CB C 13 25.77 0.1 . 1 . . . . 22 GLU CB . 26908 1 77 . 1 1 24 24 GLU N N 15 120.2 0.1 . 1 . . . . 22 GLU N . 26908 1 78 . 1 1 25 25 LYS H H 1 8.378 0.02 . 1 . . . . 23 LYS H . 26908 1 79 . 1 1 25 25 LYS CA C 13 56.51 0.1 . 1 . . . . 23 LYS CA . 26908 1 80 . 1 1 25 25 LYS CB C 13 29.61 0.1 . 1 . . . . 23 LYS CB . 26908 1 81 . 1 1 25 25 LYS N N 15 120.62 0.1 . 1 . . . . 23 LYS N . 26908 1 82 . 1 1 26 26 ALA H H 1 8.986 0.02 . 1 . . . . 24 ALA H . 26908 1 83 . 1 1 26 26 ALA CA C 13 52.71 0.1 . 1 . . . . 24 ALA CA . 26908 1 84 . 1 1 26 26 ALA CB C 13 15.33 0.1 . 1 . . . . 24 ALA CB . 26908 1 85 . 1 1 26 26 ALA N N 15 121.3 0.1 . 1 . . . . 24 ALA N . 26908 1 86 . 1 1 27 27 ALA H H 1 7.74 0.02 . 1 . . . . 25 ALA H . 26908 1 87 . 1 1 27 27 ALA CA C 13 52.3 0.1 . 1 . . . . 25 ALA CA . 26908 1 88 . 1 1 27 27 ALA CB C 13 14.72 0.1 . 1 . . . . 25 ALA CB . 26908 1 89 . 1 1 27 27 ALA N N 15 118.96 0.1 . 1 . . . . 25 ALA N . 26908 1 90 . 1 1 28 28 GLN H H 1 7.354 0.02 . 1 . . . . 26 GLN H . 26908 1 91 . 1 1 28 28 GLN CA C 13 55.34 0.1 . 1 . . . . 26 GLN CA . 26908 1 92 . 1 1 28 28 GLN CB C 13 25.23 0.1 . 1 . . . . 26 GLN CB . 26908 1 93 . 1 1 28 28 GLN N N 15 115.96 0.1 . 1 . . . . 26 GLN N . 26908 1 94 . 1 1 29 29 VAL H H 1 7.781 0.02 . 1 . . . . 27 VAL H . 26908 1 95 . 1 1 29 29 VAL CA C 13 63.83 0.1 . 1 . . . . 27 VAL CA . 26908 1 96 . 1 1 29 29 VAL CB C 13 28.38 0.1 . 1 . . . . 27 VAL CB . 26908 1 97 . 1 1 29 29 VAL N N 15 119.25 0.1 . 1 . . . . 27 VAL N . 26908 1 98 . 1 1 30 30 MET H H 1 8.428 0.02 . 1 . . . . 28 MET H . 26908 1 99 . 1 1 30 30 MET CA C 13 56.63 0.1 . 1 . . . . 28 MET CA . 26908 1 100 . 1 1 30 30 MET CB C 13 29.92 0.1 . 1 . . . . 28 MET CB . 26908 1 101 . 1 1 30 30 MET N N 15 116.25 0.1 . 1 . . . . 28 MET N . 26908 1 102 . 1 1 31 31 LYS H H 1 7.095 0.02 . 1 . . . . 29 LYS H . 26908 1 103 . 1 1 31 31 LYS CA C 13 55.12 0.1 . 1 . . . . 29 LYS CA . 26908 1 104 . 1 1 31 31 LYS CB C 13 28.56 0.1 . 1 . . . . 29 LYS CB . 26908 1 105 . 1 1 31 31 LYS N N 15 117.06 0.1 . 1 . . . . 29 LYS N . 26908 1 106 . 1 1 32 32 HIS H H 1 7.497 0.02 . 1 . . . . 30 HIS H . 26908 1 107 . 1 1 32 32 HIS CA C 13 53.49 0.1 . 1 . . . . 30 HIS CA . 26908 1 108 . 1 1 32 32 HIS CB C 13 27.19 0.1 . 1 . . . . 30 HIS CB . 26908 1 109 . 1 1 32 32 HIS N N 15 115.97 0.1 . 1 . . . . 30 HIS N . 26908 1 110 . 1 1 33 33 LEU H H 1 7.412 0.02 . 1 . . . . 31 LEU H . 26908 1 111 . 1 1 33 33 LEU CA C 13 49.93 0.1 . 1 . . . . 31 LEU CA . 26908 1 112 . 1 1 33 33 LEU CB C 13 41.34 0.1 . 1 . . . . 31 LEU CB . 26908 1 113 . 1 1 33 33 LEU N N 15 120.35 0.1 . 1 . . . . 31 LEU N . 26908 1 114 . 1 1 34 34 ASP H H 1 8.13 0.02 . 1 . . . . 32 ASP H . 26908 1 115 . 1 1 34 34 ASP CA C 13 50.32 0.1 . 1 . . . . 32 ASP CA . 26908 1 116 . 1 1 34 34 ASP CB C 13 38.7 0.1 . 1 . . . . 32 ASP CB . 26908 1 117 . 1 1 34 34 ASP N N 15 118.74 0.1 . 1 . . . . 32 ASP N . 26908 1 118 . 1 1 35 35 GLU H H 1 8.751 0.02 . 1 . . . . 33 GLU H . 26908 1 119 . 1 1 35 35 GLU CA C 13 57.32 0.1 . 1 . . . . 33 GLU CA . 26908 1 120 . 1 1 35 35 GLU CB C 13 26.27 0.1 . 1 . . . . 33 GLU CB . 26908 1 121 . 1 1 35 35 GLU N N 15 120.58 0.1 . 1 . . . . 33 GLU N . 26908 1 122 . 1 1 36 36 GLU H H 1 8.541 0.02 . 1 . . . . 34 GLU H . 26908 1 123 . 1 1 36 36 GLU CA C 13 56.76 0.1 . 1 . . . . 34 GLU CA . 26908 1 124 . 1 1 36 36 GLU CB C 13 25.92 0.1 . 1 . . . . 34 GLU CB . 26908 1 125 . 1 1 36 36 GLU N N 15 119.55 0.1 . 1 . . . . 34 GLU N . 26908 1 126 . 1 1 37 37 THR H H 1 7.87 0.02 . 1 . . . . 35 THR H . 26908 1 127 . 1 1 37 37 THR CA C 13 63.73 0.1 . 1 . . . . 35 THR CA . 26908 1 128 . 1 1 37 37 THR N N 15 119.28 0.1 . 1 . . . . 35 THR N . 26908 1 129 . 1 1 38 38 VAL H H 1 8.174 0.02 . 1 . . . . 36 VAL H . 26908 1 130 . 1 1 38 38 VAL CA C 13 65.16 0.1 . 1 . . . . 36 VAL CA . 26908 1 131 . 1 1 38 38 VAL CB C 13 28.35 0.1 . 1 . . . . 36 VAL CB . 26908 1 132 . 1 1 38 38 VAL N N 15 121.81 0.1 . 1 . . . . 36 VAL N . 26908 1 133 . 1 1 39 39 GLU H H 1 8.076 0.02 . 1 . . . . 37 GLU H . 26908 1 134 . 1 1 39 39 GLU CA C 13 56.67 0.1 . 1 . . . . 37 GLU CA . 26908 1 135 . 1 1 39 39 GLU CB C 13 25.95 0.1 . 1 . . . . 37 GLU CB . 26908 1 136 . 1 1 39 39 GLU N N 15 117.45 0.1 . 1 . . . . 37 GLU N . 26908 1 137 . 1 1 40 40 GLN H H 1 7.386 0.02 . 1 . . . . 38 GLN H . 26908 1 138 . 1 1 40 40 GLN CA C 13 55.5 0.1 . 1 . . . . 38 GLN CA . 26908 1 139 . 1 1 40 40 GLN CB C 13 26.22 0.1 . 1 . . . . 38 GLN CB . 26908 1 140 . 1 1 40 40 GLN N N 15 115.65 0.1 . 1 . . . . 38 GLN N . 26908 1 141 . 1 1 41 41 LEU H H 1 8.599 0.02 . 1 . . . . 39 LEU H . 26908 1 142 . 1 1 41 41 LEU CA C 13 55.11 0.1 . 1 . . . . 39 LEU CA . 26908 1 143 . 1 1 41 41 LEU CB C 13 38.83 0.1 . 1 . . . . 39 LEU CB . 26908 1 144 . 1 1 41 41 LEU N N 15 122.88 0.1 . 1 . . . . 39 LEU N . 26908 1 145 . 1 1 42 42 VAL H H 1 8.702 0.02 . 1 . . . . 40 VAL H . 26908 1 146 . 1 1 42 42 VAL CA C 13 63.99 0.1 . 1 . . . . 40 VAL CA . 26908 1 147 . 1 1 42 42 VAL CB C 13 28.18 0.1 . 1 . . . . 40 VAL CB . 26908 1 148 . 1 1 42 42 VAL N N 15 118.48 0.1 . 1 . . . . 40 VAL N . 26908 1 149 . 1 1 43 43 VAL H H 1 7.04 0.02 . 1 . . . . 41 VAL H . 26908 1 150 . 1 1 43 43 VAL CA C 13 63.19 0.1 . 1 . . . . 41 VAL CA . 26908 1 151 . 1 1 43 43 VAL CB C 13 28.46 0.1 . 1 . . . . 41 VAL CB . 26908 1 152 . 1 1 43 43 VAL N N 15 120.92 0.1 . 1 . . . . 41 VAL N . 26908 1 153 . 1 1 44 44 GLU H H 1 7.849 0.02 . 1 . . . . 42 GLU H . 26908 1 154 . 1 1 44 44 GLU CA C 13 55.99 0.1 . 1 . . . . 42 GLU CA . 26908 1 155 . 1 1 44 44 GLU CB C 13 25.88 0.1 . 1 . . . . 42 GLU CB . 26908 1 156 . 1 1 44 44 GLU N N 15 121.19 0.1 . 1 . . . . 42 GLU N . 26908 1 157 . 1 1 45 45 ILE H H 1 8.668 0.02 . 1 . . . . 43 ILE H . 26908 1 158 . 1 1 45 45 ILE CA C 13 62.9 0.1 . 1 . . . . 43 ILE CA . 26908 1 159 . 1 1 45 45 ILE CB C 13 35.28 0.1 . 1 . . . . 43 ILE CB . 26908 1 160 . 1 1 45 45 ILE N N 15 118.63 0.1 . 1 . . . . 43 ILE N . 26908 1 161 . 1 1 46 46 ALA H H 1 7.818 0.02 . 1 . . . . 44 ALA H . 26908 1 162 . 1 1 46 46 ALA CA C 13 51.65 0.1 . 1 . . . . 44 ALA CA . 26908 1 163 . 1 1 46 46 ALA CB C 13 14.77 0.1 . 1 . . . . 44 ALA CB . 26908 1 164 . 1 1 46 46 ALA N N 15 122.37 0.1 . 1 . . . . 44 ALA N . 26908 1 165 . 1 1 47 47 ASN H H 1 7.518 0.02 . 1 . . . . 45 ASN H . 26908 1 166 . 1 1 47 47 ASN CA C 13 49.78 0.1 . 1 . . . . 45 ASN CA . 26908 1 167 . 1 1 47 47 ASN CB C 13 36.49 0.1 . 1 . . . . 45 ASN CB . 26908 1 168 . 1 1 47 47 ASN N N 15 114.87 0.1 . 1 . . . . 45 ASN N . 26908 1 169 . 1 1 48 48 ILE H H 1 7.229 0.02 . 1 . . . . 46 ILE H . 26908 1 170 . 1 1 48 48 ILE CA C 13 60.04 0.1 . 1 . . . . 46 ILE CA . 26908 1 171 . 1 1 48 48 ILE CB C 13 35.74 0.1 . 1 . . . . 46 ILE CB . 26908 1 172 . 1 1 48 48 ILE N N 15 122.41 0.1 . 1 . . . . 46 ILE N . 26908 1 173 . 1 1 49 49 GLY H H 1 8.276 0.02 . 1 . . . . 47 GLY H . 26908 1 174 . 1 1 49 49 GLY CA C 13 42.7 0.1 . 1 . . . . 47 GLY CA . 26908 1 175 . 1 1 49 49 GLY N N 15 110.28 0.1 . 1 . . . . 47 GLY N . 26908 1 176 . 1 1 50 50 ARG H H 1 8.217 0.02 . 1 . . . . 48 ARG H . 26908 1 177 . 1 1 50 50 ARG CA C 13 53.11 0.1 . 1 . . . . 48 ARG CA . 26908 1 178 . 1 1 50 50 ARG CB C 13 27.23 0.1 . 1 . . . . 48 ARG CB . 26908 1 179 . 1 1 50 50 ARG N N 15 124.3 0.1 . 1 . . . . 48 ARG N . 26908 1 180 . 1 1 51 51 VAL H H 1 8.368 0.02 . 1 . . . . 49 VAL H . 26908 1 181 . 1 1 51 51 VAL CA C 13 58.18 0.1 . 1 . . . . 49 VAL CA . 26908 1 182 . 1 1 51 51 VAL CB C 13 29.77 0.1 . 1 . . . . 49 VAL CB . 26908 1 183 . 1 1 51 51 VAL N N 15 127.16 0.1 . 1 . . . . 49 VAL N . 26908 1 184 . 1 1 52 52 THR H H 1 8.989 0.02 . 1 . . . . 50 THR H . 26908 1 185 . 1 1 52 52 THR CA C 13 57.41 0.1 . 1 . . . . 50 THR CA . 26908 1 186 . 1 1 52 52 THR CB C 13 65.78 0.1 . 1 . . . . 50 THR CB . 26908 1 187 . 1 1 52 52 THR N N 15 121.13 0.1 . 1 . . . . 50 THR N . 26908 1 188 . 1 1 53 53 PRO CA C 13 62.54 0.1 . 1 . . . . 51 PRO CA . 26908 1 189 . 1 1 53 53 PRO CB C 13 28.23 0.1 . 1 . . . . 51 PRO CB . 26908 1 190 . 1 1 54 54 GLU H H 1 8.651 0.02 . 1 . . . . 52 GLU H . 26908 1 191 . 1 1 54 54 GLU CA C 13 57.44 0.1 . 1 . . . . 52 GLU CA . 26908 1 192 . 1 1 54 54 GLU CB C 13 25.45 0.1 . 1 . . . . 52 GLU CB . 26908 1 193 . 1 1 54 54 GLU N N 15 116.69 0.1 . 1 . . . . 52 GLU N . 26908 1 194 . 1 1 55 55 GLU H H 1 7.82 0.02 . 1 . . . . 53 GLU H . 26908 1 195 . 1 1 55 55 GLU CA C 13 56.45 0.1 . 1 . . . . 53 GLU CA . 26908 1 196 . 1 1 55 55 GLU CB C 13 26.14 0.1 . 1 . . . . 53 GLU CB . 26908 1 197 . 1 1 55 55 GLU N N 15 122.78 0.1 . 1 . . . . 53 GLU N . 26908 1 198 . 1 1 56 56 LYS H H 1 8.05 0.02 . 1 . . . . 54 LYS H . 26908 1 199 . 1 1 56 56 LYS CA C 13 57.76 0.1 . 1 . . . . 54 LYS CA . 26908 1 200 . 1 1 56 56 LYS CB C 13 29.52 0.1 . 1 . . . . 54 LYS CB . 26908 1 201 . 1 1 56 56 LYS N N 15 118.77 0.1 . 1 . . . . 54 LYS N . 26908 1 202 . 1 1 57 57 LYS H H 1 8.377 0.02 . 1 . . . . 55 LYS H . 26908 1 203 . 1 1 57 57 LYS CA C 13 57.54 0.1 . 1 . . . . 55 LYS CA . 26908 1 204 . 1 1 57 57 LYS CB C 13 29.2 0.1 . 1 . . . . 55 LYS CB . 26908 1 205 . 1 1 57 57 LYS N N 15 117.97 0.1 . 1 . . . . 55 LYS N . 26908 1 206 . 1 1 58 58 GLN H H 1 7.827 0.02 . 1 . . . . 56 GLN H . 26908 1 207 . 1 1 58 58 GLN CA C 13 56.27 0.1 . 1 . . . . 56 GLN CA . 26908 1 208 . 1 1 58 58 GLN CB C 13 25.17 0.1 . 1 . . . . 56 GLN CB . 26908 1 209 . 1 1 58 58 GLN N N 15 117.86 0.1 . 1 . . . . 56 GLN N . 26908 1 210 . 1 1 59 59 VAL H H 1 8.306 0.02 . 1 . . . . 57 VAL H . 26908 1 211 . 1 1 59 59 VAL CA C 13 64.32 0.1 . 1 . . . . 57 VAL CA . 26908 1 212 . 1 1 59 59 VAL CB C 13 28.51 0.1 . 1 . . . . 57 VAL CB . 26908 1 213 . 1 1 59 59 VAL N N 15 120.92 0.1 . 1 . . . . 57 VAL N . 26908 1 214 . 1 1 60 60 LEU H H 1 8.592 0.02 . 1 . . . . 58 LEU H . 26908 1 215 . 1 1 60 60 LEU CA C 13 55.66 0.1 . 1 . . . . 58 LEU CA . 26908 1 216 . 1 1 60 60 LEU CB C 13 38.44 0.1 . 1 . . . . 58 LEU CB . 26908 1 217 . 1 1 60 60 LEU N N 15 120.29 0.1 . 1 . . . . 58 LEU N . 26908 1 218 . 1 1 61 61 GLU H H 1 8.908 0.02 . 1 . . . . 59 GLU H . 26908 1 219 . 1 1 61 61 GLU CA C 13 57.4 0.1 . 1 . . . . 59 GLU CA . 26908 1 220 . 1 1 61 61 GLU CB C 13 26.19 0.1 . 1 . . . . 59 GLU CB . 26908 1 221 . 1 1 61 61 GLU N N 15 118.63 0.1 . 1 . . . . 59 GLU N . 26908 1 222 . 1 1 62 62 GLU H H 1 7.989 0.02 . 1 . . . . 60 GLU H . 26908 1 223 . 1 1 62 62 GLU CA C 13 57.26 0.1 . 1 . . . . 60 GLU CA . 26908 1 224 . 1 1 62 62 GLU CB C 13 26.04 0.1 . 1 . . . . 60 GLU CB . 26908 1 225 . 1 1 62 62 GLU N N 15 121.48 0.1 . 1 . . . . 60 GLU N . 26908 1 226 . 1 1 63 63 PHE H H 1 9.319 0.02 . 1 . . . . 61 PHE H . 26908 1 227 . 1 1 63 63 PHE CA C 13 59.48 0.1 . 1 . . . . 61 PHE CA . 26908 1 228 . 1 1 63 63 PHE CB C 13 36.18 0.1 . 1 . . . . 61 PHE CB . 26908 1 229 . 1 1 63 63 PHE N N 15 119.84 0.1 . 1 . . . . 61 PHE N . 26908 1 230 . 1 1 64 64 LEU H H 1 8.822 0.02 . 1 . . . . 62 LEU H . 26908 1 231 . 1 1 64 64 LEU CA C 13 54.93 0.1 . 1 . . . . 62 LEU CA . 26908 1 232 . 1 1 64 64 LEU CB C 13 37.8 0.1 . 1 . . . . 62 LEU CB . 26908 1 233 . 1 1 64 64 LEU N N 15 118.87 0.1 . 1 . . . . 62 LEU N . 26908 1 234 . 1 1 65 65 SER H H 1 7.854 0.02 . 1 . . . . 63 SER H . 26908 1 235 . 1 1 65 65 SER CA C 13 59.49 0.1 . 1 . . . . 63 SER CA . 26908 1 236 . 1 1 65 65 SER CB C 13 60.64 0.1 . 1 . . . . 63 SER CB . 26908 1 237 . 1 1 65 65 SER N N 15 116.25 0.1 . 1 . . . . 63 SER N . 26908 1 238 . 1 1 66 66 LEU H H 1 7.796 0.02 . 1 . . . . 64 LEU H . 26908 1 239 . 1 1 66 66 LEU CA C 13 54.93 0.1 . 1 . . . . 64 LEU CA . 26908 1 240 . 1 1 66 66 LEU CB C 13 38.57 0.1 . 1 . . . . 64 LEU CB . 26908 1 241 . 1 1 66 66 LEU N N 15 122.29 0.1 . 1 . . . . 64 LEU N . 26908 1 242 . 1 1 67 67 ALA H H 1 8.72 0.02 . 1 . . . . 65 ALA H . 26908 1 243 . 1 1 67 67 ALA CA C 13 52.05 0.1 . 1 . . . . 65 ALA CA . 26908 1 244 . 1 1 67 67 ALA CB C 13 14.09 0.1 . 1 . . . . 65 ALA CB . 26908 1 245 . 1 1 67 67 ALA N N 15 121.69 0.1 . 1 . . . . 65 ALA N . 26908 1 246 . 1 1 68 68 LYS H H 1 8.173 0.02 . 1 . . . . 66 LYS H . 26908 1 247 . 1 1 68 68 LYS CA C 13 55.48 0.1 . 1 . . . . 66 LYS CA . 26908 1 248 . 1 1 68 68 LYS CB C 13 27.9 0.1 . 1 . . . . 66 LYS CB . 26908 1 249 . 1 1 68 68 LYS N N 15 118.98 0.1 . 1 . . . . 66 LYS N . 26908 1 250 . 1 1 69 69 ALA H H 1 7.847 0.02 . 1 . . . . 67 ALA H . 26908 1 251 . 1 1 69 69 ALA CA C 13 52.42 0.1 . 1 . . . . 67 ALA CA . 26908 1 252 . 1 1 69 69 ALA CB C 13 15.31 0.1 . 1 . . . . 67 ALA CB . 26908 1 253 . 1 1 69 69 ALA N N 15 121.79 0.1 . 1 . . . . 67 ALA N . 26908 1 254 . 1 1 70 70 LYS H H 1 8.31 0.02 . 1 . . . . 68 LYS H . 26908 1 255 . 1 1 70 70 LYS CA C 13 56.75 0.1 . 1 . . . . 68 LYS CA . 26908 1 256 . 1 1 70 70 LYS CB C 13 28.39 0.1 . 1 . . . . 68 LYS CB . 26908 1 257 . 1 1 70 70 LYS N N 15 118.22 0.1 . 1 . . . . 68 LYS N . 26908 1 258 . 1 1 71 71 GLU H H 1 7.808 0.02 . 1 . . . . 69 GLU H . 26908 1 259 . 1 1 71 71 GLU CA C 13 56.4 0.1 . 1 . . . . 69 GLU CA . 26908 1 260 . 1 1 71 71 GLU CB C 13 26.09 0.1 . 1 . . . . 69 GLU CB . 26908 1 261 . 1 1 71 71 GLU N N 15 120.83 0.1 . 1 . . . . 69 GLU N . 26908 1 262 . 1 1 72 72 MET H H 1 8.117 0.02 . 1 . . . . 70 MET H . 26908 1 263 . 1 1 72 72 MET CA C 13 56.14 0.1 . 1 . . . . 70 MET CA . 26908 1 264 . 1 1 72 72 MET CB C 13 30.16 0.1 . 1 . . . . 70 MET CB . 26908 1 265 . 1 1 72 72 MET N N 15 118.62 0.1 . 1 . . . . 70 MET N . 26908 1 266 . 1 1 73 73 ILE H H 1 8.434 0.02 . 1 . . . . 71 ILE H . 26908 1 267 . 1 1 73 73 ILE CA C 13 62.84 0.1 . 1 . . . . 71 ILE CA . 26908 1 268 . 1 1 73 73 ILE CB C 13 34.59 0.1 . 1 . . . . 71 ILE CB . 26908 1 269 . 1 1 73 73 ILE N N 15 120.96 0.1 . 1 . . . . 71 ILE N . 26908 1 270 . 1 1 74 74 SER H H 1 8.064 0.02 . 1 . . . . 72 SER H . 26908 1 271 . 1 1 74 74 SER CA C 13 58.67 0.1 . 1 . . . . 72 SER CA . 26908 1 272 . 1 1 74 74 SER CB C 13 60.3 0.1 . 1 . . . . 72 SER CB . 26908 1 273 . 1 1 74 74 SER N N 15 116.91 0.1 . 1 . . . . 72 SER N . 26908 1 274 . 1 1 75 75 GLU H H 1 7.727 0.02 . 1 . . . . 73 GLU H . 26908 1 275 . 1 1 75 75 GLU CA C 13 54.23 0.1 . 1 . . . . 73 GLU CA . 26908 1 276 . 1 1 75 75 GLU CB C 13 26.85 0.1 . 1 . . . . 73 GLU CB . 26908 1 277 . 1 1 75 75 GLU N N 15 119.32 0.1 . 1 . . . . 73 GLU N . 26908 1 278 . 1 1 76 76 GLY H H 1 8.102 0.02 . 1 . . . . 74 GLY H . 26908 1 279 . 1 1 76 76 GLY CA C 13 42.37 0.1 . 1 . . . . 74 GLY CA . 26908 1 280 . 1 1 76 76 GLY N N 15 105.05 0.1 . 1 . . . . 74 GLY N . 26908 1 281 . 1 1 77 77 GLY H H 1 8.403 0.02 . 1 . . . . 75 GLY H . 26908 1 282 . 1 1 77 77 GLY CA C 13 42.65 0.1 . 1 . . . . 75 GLY CA . 26908 1 283 . 1 1 77 77 GLY N N 15 112.23 0.1 . 1 . . . . 75 GLY N . 26908 1 284 . 1 1 78 78 ILE H H 1 8.248 0.02 . 1 . . . . 76 ILE H . 26908 1 285 . 1 1 78 78 ILE CA C 13 62.06 0.1 . 1 . . . . 76 ILE CA . 26908 1 286 . 1 1 78 78 ILE CB C 13 34.49 0.1 . 1 . . . . 76 ILE CB . 26908 1 287 . 1 1 78 78 ILE N N 15 120.58 0.1 . 1 . . . . 76 ILE N . 26908 1 288 . 1 1 79 79 GLU H H 1 8.547 0.02 . 1 . . . . 77 GLU H . 26908 1 289 . 1 1 79 79 GLU CA C 13 56.7 0.1 . 1 . . . . 77 GLU CA . 26908 1 290 . 1 1 79 79 GLU CB C 13 25.27 0.1 . 1 . . . . 77 GLU CB . 26908 1 291 . 1 1 79 79 GLU N N 15 119.84 0.1 . 1 . . . . 77 GLU N . 26908 1 292 . 1 1 80 80 TYR H H 1 7.643 0.02 . 1 . . . . 78 TYR H . 26908 1 293 . 1 1 80 80 TYR CA C 13 57.25 0.1 . 1 . . . . 78 TYR CA . 26908 1 294 . 1 1 80 80 TYR CB C 13 34.95 0.1 . 1 . . . . 78 TYR CB . 26908 1 295 . 1 1 80 80 TYR N N 15 120.4 0.1 . 1 . . . . 78 TYR N . 26908 1 296 . 1 1 81 81 ALA H H 1 8.027 0.02 . 1 . . . . 79 ALA H . 26908 1 297 . 1 1 81 81 ALA CA C 13 51.85 0.1 . 1 . . . . 79 ALA CA . 26908 1 298 . 1 1 81 81 ALA CB C 13 15.99 0.1 . 1 . . . . 79 ALA CB . 26908 1 299 . 1 1 81 81 ALA N N 15 121.33 0.1 . 1 . . . . 79 ALA N . 26908 1 300 . 1 1 82 82 LYS H H 1 8.539 0.02 . 1 . . . . 80 LYS H . 26908 1 301 . 1 1 82 82 LYS CA C 13 57.77 0.1 . 1 . . . . 80 LYS CA . 26908 1 302 . 1 1 82 82 LYS CB C 13 28.99 0.1 . 1 . . . . 80 LYS CB . 26908 1 303 . 1 1 82 82 LYS N N 15 117.24 0.1 . 1 . . . . 80 LYS N . 26908 1 304 . 1 1 83 83 LYS H H 1 7.358 0.02 . 1 . . . . 81 LYS H . 26908 1 305 . 1 1 83 83 LYS CA C 13 56.28 0.1 . 1 . . . . 81 LYS CA . 26908 1 306 . 1 1 83 83 LYS CB C 13 28.61 0.1 . 1 . . . . 81 LYS CB . 26908 1 307 . 1 1 83 83 LYS N N 15 118 0.1 . 1 . . . . 81 LYS N . 26908 1 308 . 1 1 84 84 VAL H H 1 7.678 0.02 . 1 . . . . 82 VAL H . 26908 1 309 . 1 1 84 84 VAL CA C 13 63.2 0.1 . 1 . . . . 82 VAL CA . 26908 1 310 . 1 1 84 84 VAL CB C 13 28.52 0.1 . 1 . . . . 82 VAL CB . 26908 1 311 . 1 1 84 84 VAL N N 15 119.81 0.1 . 1 . . . . 82 VAL N . 26908 1 312 . 1 1 85 85 LEU H H 1 8.468 0.02 . 1 . . . . 83 LEU H . 26908 1 313 . 1 1 85 85 LEU CA C 13 54.5 0.1 . 1 . . . . 83 LEU CA . 26908 1 314 . 1 1 85 85 LEU CB C 13 39.01 0.1 . 1 . . . . 83 LEU CB . 26908 1 315 . 1 1 85 85 LEU N N 15 119.52 0.1 . 1 . . . . 83 LEU N . 26908 1 316 . 1 1 86 86 GLU H H 1 8.728 0.02 . 1 . . . . 84 GLU H . 26908 1 317 . 1 1 86 86 GLU CA C 13 56.69 0.1 . 1 . . . . 84 GLU CA . 26908 1 318 . 1 1 86 86 GLU CB C 13 25.82 0.1 . 1 . . . . 84 GLU CB . 26908 1 319 . 1 1 86 86 GLU N N 15 120.94 0.1 . 1 . . . . 84 GLU N . 26908 1 320 . 1 1 87 87 LYS H H 1 7.392 0.02 . 1 . . . . 85 LYS H . 26908 1 321 . 1 1 87 87 LYS CA C 13 55.8 0.1 . 1 . . . . 85 LYS CA . 26908 1 322 . 1 1 87 87 LYS CB C 13 28.64 0.1 . 1 . . . . 85 LYS CB . 26908 1 323 . 1 1 87 87 LYS N N 15 119.65 0.1 . 1 . . . . 85 LYS N . 26908 1 324 . 1 1 88 88 ALA H H 1 7.263 0.02 . 1 . . . . 86 ALA H . 26908 1 325 . 1 1 88 88 ALA CA C 13 51.23 0.1 . 1 . . . . 86 ALA CA . 26908 1 326 . 1 1 88 88 ALA CB C 13 15.47 0.1 . 1 . . . . 86 ALA CB . 26908 1 327 . 1 1 88 88 ALA N N 15 118.91 0.1 . 1 . . . . 86 ALA N . 26908 1 328 . 1 1 89 89 PHE H H 1 8.449 0.02 . 1 . . . . 87 PHE H . 26908 1 329 . 1 1 89 89 PHE CA C 13 54.02 0.1 . 1 . . . . 87 PHE CA . 26908 1 330 . 1 1 89 89 PHE CB C 13 38.7 0.1 . 1 . . . . 87 PHE CB . 26908 1 331 . 1 1 89 89 PHE N N 15 112.62 0.1 . 1 . . . . 87 PHE N . 26908 1 332 . 1 1 90 90 GLY H H 1 7.866 0.02 . 1 . . . . 88 GLY H . 26908 1 333 . 1 1 90 90 GLY CA C 13 41.38 0.1 . 1 . . . . 88 GLY CA . 26908 1 334 . 1 1 90 90 GLY N N 15 111.01 0.1 . 1 . . . . 88 GLY N . 26908 1 335 . 1 1 91 91 PRO CA C 13 63.19 0.1 . 1 . . . . 89 PRO CA . 26908 1 336 . 1 1 91 91 PRO CB C 13 28.62 0.1 . 1 . . . . 89 PRO CB . 26908 1 337 . 1 1 92 92 GLU H H 1 8.262 0.02 . 1 . . . . 90 GLU H . 26908 1 338 . 1 1 92 92 GLU CA C 13 56.92 0.1 . 1 . . . . 90 GLU CA . 26908 1 339 . 1 1 92 92 GLU CB C 13 25.68 0.1 . 1 . . . . 90 GLU CB . 26908 1 340 . 1 1 92 92 GLU N N 15 119.6 0.1 . 1 . . . . 90 GLU N . 26908 1 341 . 1 1 93 93 ARG H H 1 8.856 0.02 . 1 . . . . 91 ARG H . 26908 1 342 . 1 1 93 93 ARG CA C 13 55.98 0.1 . 1 . . . . 91 ARG CA . 26908 1 343 . 1 1 93 93 ARG CB C 13 26.07 0.1 . 1 . . . . 91 ARG CB . 26908 1 344 . 1 1 93 93 ARG N N 15 120.21 0.1 . 1 . . . . 91 ARG N . 26908 1 345 . 1 1 94 94 ALA H H 1 8.058 0.02 . 1 . . . . 92 ALA H . 26908 1 346 . 1 1 94 94 ALA CA C 13 52.95 0.1 . 1 . . . . 92 ALA CA . 26908 1 347 . 1 1 94 94 ALA CB C 13 16.12 0.1 . 1 . . . . 92 ALA CB . 26908 1 348 . 1 1 94 94 ALA N N 15 118.77 0.1 . 1 . . . . 92 ALA N . 26908 1 349 . 1 1 95 95 ARG H H 1 7.645 0.02 . 1 . . . . 93 ARG H . 26908 1 350 . 1 1 95 95 ARG CA C 13 56.63 0.1 . 1 . . . . 93 ARG CA . 26908 1 351 . 1 1 95 95 ARG CB C 13 26.17 0.1 . 1 . . . . 93 ARG CB . 26908 1 352 . 1 1 95 95 ARG N N 15 116.09 0.1 . 1 . . . . 93 ARG N . 26908 1 353 . 1 1 96 96 LYS H H 1 7.468 0.02 . 1 . . . . 94 LYS H . 26908 1 354 . 1 1 96 96 LYS CA C 13 55.74 0.1 . 1 . . . . 94 LYS CA . 26908 1 355 . 1 1 96 96 LYS CB C 13 28.66 0.1 . 1 . . . . 94 LYS CB . 26908 1 356 . 1 1 96 96 LYS N N 15 118.86 0.1 . 1 . . . . 94 LYS N . 26908 1 357 . 1 1 97 97 ILE H H 1 8.184 0.02 . 1 . . . . 95 ILE H . 26908 1 358 . 1 1 97 97 ILE CA C 13 62.56 0.1 . 1 . . . . 95 ILE CA . 26908 1 359 . 1 1 97 97 ILE CB C 13 34.58 0.1 . 1 . . . . 95 ILE CB . 26908 1 360 . 1 1 97 97 ILE N N 15 120.34 0.1 . 1 . . . . 95 ILE N . 26908 1 361 . 1 1 98 98 ILE H H 1 8.058 0.02 . 1 . . . . 96 ILE H . 26908 1 362 . 1 1 98 98 ILE CA C 13 61.11 0.1 . 1 . . . . 96 ILE CA . 26908 1 363 . 1 1 98 98 ILE CB C 13 33.1 0.1 . 1 . . . . 96 ILE CB . 26908 1 364 . 1 1 98 98 ILE N N 15 118.96 0.1 . 1 . . . . 96 ILE N . 26908 1 365 . 1 1 99 99 GLU H H 1 8.202 0.02 . 1 . . . . 97 GLU H . 26908 1 366 . 1 1 99 99 GLU CA C 13 56.66 0.1 . 1 . . . . 97 GLU CA . 26908 1 367 . 1 1 99 99 GLU CB C 13 26.12 0.1 . 1 . . . . 97 GLU CB . 26908 1 368 . 1 1 99 99 GLU N N 15 121.4 0.1 . 1 . . . . 97 GLU N . 26908 1 369 . 1 1 100 100 ARG H H 1 7.747 0.02 . 1 . . . . 98 ARG H . 26908 1 370 . 1 1 100 100 ARG CA C 13 55.17 0.1 . 1 . . . . 98 ARG CA . 26908 1 371 . 1 1 100 100 ARG CB C 13 26.66 0.1 . 1 . . . . 98 ARG CB . 26908 1 372 . 1 1 100 100 ARG N N 15 118.46 0.1 . 1 . . . . 98 ARG N . 26908 1 373 . 1 1 101 101 LEU H H 1 8.028 0.02 . 1 . . . . 99 LEU H . 26908 1 374 . 1 1 101 101 LEU CA C 13 53.3 0.1 . 1 . . . . 99 LEU CA . 26908 1 375 . 1 1 101 101 LEU CB C 13 39.51 0.1 . 1 . . . . 99 LEU CB . 26908 1 376 . 1 1 101 101 LEU N N 15 116.89 0.1 . 1 . . . . 99 LEU N . 26908 1 377 . 1 1 102 102 THR H H 1 7.662 0.02 . 1 . . . . 100 THR H . 26908 1 378 . 1 1 102 102 THR CA C 13 58.91 0.1 . 1 . . . . 100 THR CA . 26908 1 379 . 1 1 102 102 THR CB C 13 67.3 0.1 . 1 . . . . 100 THR CB . 26908 1 380 . 1 1 102 102 THR N N 15 128.28 0.1 . 1 . . . . 100 THR N . 26908 1 381 . 1 1 103 103 SER H H 1 7.665 0.02 . 1 . . . . 101 SER H . 26908 1 382 . 1 1 103 103 SER CA C 13 55.91 0.1 . 1 . . . . 101 SER CA . 26908 1 383 . 1 1 103 103 SER CB C 13 61.4 0.1 . 1 . . . . 101 SER CB . 26908 1 384 . 1 1 103 103 SER N N 15 118.06 0.1 . 1 . . . . 101 SER N . 26908 1 385 . 1 1 104 104 SER H H 1 7.881 0.02 . 1 . . . . 102 SER H . 26908 1 386 . 1 1 104 104 SER CA C 13 57.17 0.1 . 1 . . . . 102 SER CA . 26908 1 387 . 1 1 104 104 SER CB C 13 62.16 0.1 . 1 . . . . 102 SER CB . 26908 1 388 . 1 1 104 104 SER N N 15 123.37 0.1 . 1 . . . . 102 SER N . 26908 1 389 . 2 2 2 2 VAL CA C 13 58.99 0.1 . 1 . . . . 2 VAL CA . 26908 1 390 . 2 2 2 2 VAL CB C 13 29.55 0.1 . 1 . . . . 2 VAL CB . 26908 1 391 . 2 2 3 3 SER H H 1 8.651 0.02 . 1 . . . . 3 SER HN . 26908 1 392 . 2 2 3 3 SER CA C 13 53.81 0.1 . 1 . . . . 3 SER CA . 26908 1 393 . 2 2 3 3 SER CB C 13 60.66 0.1 . 1 . . . . 3 SER CB . 26908 1 394 . 2 2 3 3 SER N N 15 122.69 0.1 . 1 . . . . 3 SER N . 26908 1 395 . 2 2 4 4 PRO CA C 13 62.03 0.1 . 1 . . . . 4 PRO CA . 26908 1 396 . 2 2 4 4 PRO CB C 13 28.46 0.1 . 1 . . . . 4 PRO CB . 26908 1 397 . 2 2 5 5 GLU H H 1 8.65 0.02 . 1 . . . . 5 GLU HN . 26908 1 398 . 2 2 5 5 GLU CA C 13 55.71 0.1 . 1 . . . . 5 GLU CA . 26908 1 399 . 2 2 5 5 GLU CB C 13 26 0.1 . 1 . . . . 5 GLU CB . 26908 1 400 . 2 2 5 5 GLU N N 15 118.33 0.1 . 1 . . . . 5 GLU N . 26908 1 401 . 2 2 6 6 GLU H H 1 7.961 0.02 . 1 . . . . 6 GLU HN . 26908 1 402 . 2 2 6 6 GLU CA C 13 55.19 0.1 . 1 . . . . 6 GLU CA . 26908 1 403 . 2 2 6 6 GLU CB C 13 26.56 0.1 . 1 . . . . 6 GLU CB . 26908 1 404 . 2 2 6 6 GLU N N 15 121.33 0.1 . 1 . . . . 6 GLU N . 26908 1 405 . 2 2 7 7 LYS H H 1 8.183 0.02 . 1 . . . . 7 LYS HN . 26908 1 406 . 2 2 7 7 LYS CA C 13 56.28 0.1 . 1 . . . . 7 LYS CA . 26908 1 407 . 2 2 7 7 LYS CB C 13 29.14 0.1 . 1 . . . . 7 LYS CB . 26908 1 408 . 2 2 7 7 LYS N N 15 121.58 0.1 . 1 . . . . 7 LYS N . 26908 1 409 . 2 2 8 8 GLU H H 1 8.153 0.02 . 1 . . . . 8 GLU HN . 26908 1 410 . 2 2 8 8 GLU CB C 13 26.39 0.1 . 1 . . . . 8 GLU CB . 26908 1 411 . 2 2 8 8 GLU N N 15 118.5 0.1 . 1 . . . . 8 GLU N . 26908 1 412 . 2 2 11 11 GLU CA C 13 55.7 0.1 . 1 . . . . 11 GLU CA . 26908 1 413 . 2 2 11 11 GLU CB C 13 26.34 0.1 . 1 . . . . 11 GLU CB . 26908 1 414 . 2 2 12 12 LEU H H 1 7.815 0.02 . 1 . . . . 12 LEU HN . 26908 1 415 . 2 2 12 12 LEU CA C 13 54.78 0.1 . 1 . . . . 12 LEU CA . 26908 1 416 . 2 2 12 12 LEU CB C 13 38.22 0.1 . 1 . . . . 12 LEU CB . 26908 1 417 . 2 2 12 12 LEU N N 15 119.58 0.1 . 1 . . . . 12 LEU N . 26908 1 418 . 2 2 13 13 LEU H H 1 8.041 0.02 . 1 . . . . 13 LEU HN . 26908 1 419 . 2 2 13 13 LEU CA C 13 55.71 0.1 . 1 . . . . 13 LEU CA . 26908 1 420 . 2 2 13 13 LEU CB C 13 37.85 0.1 . 1 . . . . 13 LEU CB . 26908 1 421 . 2 2 13 13 LEU N N 15 118.74 0.1 . 1 . . . . 13 LEU N . 26908 1 422 . 2 2 14 14 GLU H H 1 7.961 0.02 . 1 . . . . 14 GLU HN . 26908 1 423 . 2 2 14 14 GLU CA C 13 56.56 0.1 . 1 . . . . 14 GLU CA . 26908 1 424 . 2 2 14 14 GLU CB C 13 25.94 0.1 . 1 . . . . 14 GLU CB . 26908 1 425 . 2 2 14 14 GLU N N 15 119.16 0.1 . 1 . . . . 14 GLU N . 26908 1 426 . 2 2 15 15 GLU H H 1 7.703 0.02 . 1 . . . . 15 GLU HN . 26908 1 427 . 2 2 15 15 GLU CA C 13 56.46 0.1 . 1 . . . . 15 GLU CA . 26908 1 428 . 2 2 15 15 GLU CB C 13 25.99 0.1 . 1 . . . . 15 GLU CB . 26908 1 429 . 2 2 15 15 GLU N N 15 120.2 0.1 . 1 . . . . 15 GLU N . 26908 1 430 . 2 2 16 16 LEU H H 1 8.287 0.02 . 1 . . . . 16 LEU HN . 26908 1 431 . 2 2 16 16 LEU CA C 13 55.63 0.1 . 1 . . . . 16 LEU CA . 26908 1 432 . 2 2 16 16 LEU CB C 13 38.09 0.1 . 1 . . . . 16 LEU CB . 26908 1 433 . 2 2 16 16 LEU N N 15 121.59 0.1 . 1 . . . . 16 LEU N . 26908 1 434 . 2 2 17 17 GLU H H 1 8.305 0.02 . 1 . . . . 17 GLU HN . 26908 1 435 . 2 2 17 17 GLU CA C 13 56.69 0.1 . 1 . . . . 17 GLU CA . 26908 1 436 . 2 2 17 17 GLU CB C 13 25.39 0.1 . 1 . . . . 17 GLU CB . 26908 1 437 . 2 2 17 17 GLU N N 15 119.68 0.1 . 1 . . . . 17 GLU N . 26908 1 438 . 2 2 18 18 ASN H H 1 8.131 0.02 . 1 . . . . 18 ASN HN . 26908 1 439 . 2 2 18 18 ASN CA C 13 53.34 0.1 . 1 . . . . 18 ASN CA . 26908 1 440 . 2 2 18 18 ASN CB C 13 35.12 0.1 . 1 . . . . 18 ASN CB . 26908 1 441 . 2 2 18 18 ASN N N 15 119.74 0.1 . 1 . . . . 18 ASN N . 26908 1 442 . 2 2 19 19 ILE H H 1 8.169 0.02 . 1 . . . . 19 ILE HN . 26908 1 443 . 2 2 19 19 ILE CA C 13 62.31 0.1 . 1 . . . . 19 ILE CA . 26908 1 444 . 2 2 19 19 ILE CB C 13 34.52 0.1 . 1 . . . . 19 ILE CB . 26908 1 445 . 2 2 19 19 ILE N N 15 122.24 0.1 . 1 . . . . 19 ILE N . 26908 1 446 . 2 2 20 20 PHE H H 1 8.719 0.02 . 1 . . . . 20 PHE HN . 26908 1 447 . 2 2 20 20 PHE CA C 13 59.76 0.1 . 1 . . . . 20 PHE CA . 26908 1 448 . 2 2 20 20 PHE CB C 13 35.34 0.1 . 1 . . . . 20 PHE CB . 26908 1 449 . 2 2 20 20 PHE N N 15 121.17 0.1 . 1 . . . . 20 PHE N . 26908 1 450 . 2 2 21 21 SER H H 1 8.357 0.02 . 1 . . . . 21 SER HN . 26908 1 451 . 2 2 21 21 SER CA C 13 58.19 0.1 . 1 . . . . 21 SER CA . 26908 1 452 . 2 2 21 21 SER CB C 13 60.66 0.1 . 1 . . . . 21 SER CB . 26908 1 453 . 2 2 21 21 SER N N 15 112.3 0.1 . 1 . . . . 21 SER N . 26908 1 454 . 2 2 22 22 ARG H H 1 7.369 0.02 . 1 . . . . 22 ARG HN . 26908 1 455 . 2 2 22 22 ARG CA C 13 55.34 0.1 . 1 . . . . 22 ARG CA . 26908 1 456 . 2 2 22 22 ARG CB C 13 27.6 0.1 . 1 . . . . 22 ARG CB . 26908 1 457 . 2 2 22 22 ARG N N 15 120.59 0.1 . 1 . . . . 22 ARG N . 26908 1 458 . 2 2 23 23 SER H H 1 8.38 0.02 . 1 . . . . 23 SER HN . 26908 1 459 . 2 2 23 23 SER CA C 13 52.86 0.1 . 1 . . . . 23 SER CA . 26908 1 460 . 2 2 23 23 SER CB C 13 60.22 0.1 . 1 . . . . 23 SER CB . 26908 1 461 . 2 2 23 23 SER N N 15 110.89 0.1 . 1 . . . . 23 SER N . 26908 1 462 . 2 2 24 24 PRO CA C 13 62.05 0.1 . 1 . . . . 24 PRO CA . 26908 1 463 . 2 2 24 24 PRO CB C 13 28.51 0.1 . 1 . . . . 24 PRO CB . 26908 1 464 . 2 2 25 25 SER H H 1 7.805 0.02 . 1 . . . . 25 SER HN . 26908 1 465 . 2 2 25 25 SER CA C 13 58.55 0.1 . 1 . . . . 25 SER CA . 26908 1 466 . 2 2 25 25 SER N N 15 111.14 0.1 . 1 . . . . 25 SER N . 26908 1 467 . 2 2 26 26 ASP H H 1 8.066 0.02 . 1 . . . . 26 ASP HN . 26908 1 468 . 2 2 26 26 ASP CA C 13 54.71 0.1 . 1 . . . . 26 ASP CA . 26908 1 469 . 2 2 26 26 ASP CB C 13 36.7 0.1 . 1 . . . . 26 ASP CB . 26908 1 470 . 2 2 26 26 ASP N N 15 124.61 0.1 . 1 . . . . 26 ASP N . 26908 1 471 . 2 2 27 27 ILE H H 1 7.071 0.02 . 1 . . . . 27 ILE HN . 26908 1 472 . 2 2 27 27 ILE CA C 13 62.11 0.1 . 1 . . . . 27 ILE CA . 26908 1 473 . 2 2 27 27 ILE CB C 13 33.01 0.1 . 1 . . . . 27 ILE CB . 26908 1 474 . 2 2 27 27 ILE N N 15 116.71 0.1 . 1 . . . . 27 ILE N . 26908 1 475 . 2 2 28 28 ALA H H 1 7.709 0.1 . 1 . . . . 28 ALA HN . 26908 1 476 . 2 2 28 28 ALA CA C 13 52.51 0.1 . 1 . . . . 28 ALA CA . 26908 1 477 . 2 2 28 28 ALA CB C 13 15.1 0.1 . 1 . . . . 28 ALA CB . 26908 1 478 . 2 2 28 28 ALA N N 15 122.28 0.02 . 1 . . . . 28 ALA N . 26908 1 479 . 2 2 29 29 GLU H H 1 8.034 0.02 . 1 . . . . 29 GLU HN . 26908 1 480 . 2 2 29 29 GLU CA C 13 56.43 0.1 . 1 . . . . 29 GLU CA . 26908 1 481 . 2 2 29 29 GLU CB C 13 26.1 0.1 . 1 . . . . 29 GLU CB . 26908 1 482 . 2 2 29 29 GLU N N 15 116.25 0.1 . 1 . . . . 29 GLU N . 26908 1 483 . 2 2 30 30 ILE H H 1 7.241 0.02 . 1 . . . . 30 ILE HN . 26908 1 484 . 2 2 30 30 ILE CA C 13 60.11 0.1 . 1 . . . . 30 ILE CA . 26908 1 485 . 2 2 30 30 ILE CB C 13 32.53 0.1 . 1 . . . . 30 ILE CB . 26908 1 486 . 2 2 30 30 ILE N N 15 119.99 0.1 . 1 . . . . 30 ILE N . 26908 1 487 . 2 2 31 31 VAL H H 1 8.041 0.02 . 1 . . . . 31 VAL HN . 26908 1 488 . 2 2 31 31 VAL CA C 13 64.69 0.1 . 1 . . . . 31 VAL CA . 26908 1 489 . 2 2 31 31 VAL CB C 13 27.42 0.1 . 1 . . . . 31 VAL CB . 26908 1 490 . 2 2 31 31 VAL N N 15 120.22 0.1 . 1 . . . . 31 VAL N . 26908 1 491 . 2 2 32 32 ARG H H 1 8.416 0.02 . 1 . . . . 32 ARG HN . 26908 1 492 . 2 2 32 32 ARG CA C 13 57.44 0.1 . 1 . . . . 32 ARG CA . 26908 1 493 . 2 2 32 32 ARG CB C 13 26.96 0.1 . 1 . . . . 32 ARG CB . 26908 1 494 . 2 2 32 32 ARG N N 15 118.54 0.1 . 1 . . . . 32 ARG N . 26908 1 495 . 2 2 33 33 LEU H H 1 7.579 0.02 . 1 . . . . 33 LEU HN . 26908 1 496 . 2 2 33 33 LEU CA C 13 55.47 0.1 . 1 . . . . 33 LEU CA . 26908 1 497 . 2 2 33 33 LEU CB C 13 38.32 0.1 . 1 . . . . 33 LEU CB . 26908 1 498 . 2 2 33 33 LEU N N 15 121.31 0.1 . 1 . . . . 33 LEU N . 26908 1 499 . 2 2 34 34 TRP H H 1 8.376 0.02 . 1 . . . . 34 TRP HN . 26908 1 500 . 2 2 34 34 TRP CA C 13 54.86 0.1 . 1 . . . . 34 TRP CA . 26908 1 501 . 2 2 34 34 TRP CB C 13 25.75 0.1 . 1 . . . . 34 TRP CB . 26908 1 502 . 2 2 34 34 TRP N N 15 120.46 0.1 . 1 . . . . 34 TRP N . 26908 1 503 . 2 2 35 35 PHE H H 1 8.863 0.02 . 1 . . . . 35 PHE HN . 26908 1 504 . 2 2 35 35 PHE CA C 13 59.42 0.1 . 1 . . . . 35 PHE CA . 26908 1 505 . 2 2 35 35 PHE CB C 13 36.24 0.1 . 1 . . . . 35 PHE CB . 26908 1 506 . 2 2 35 35 PHE N N 15 119.25 0.1 . 1 . . . . 35 PHE N . 26908 1 507 . 2 2 36 36 PHE H H 1 8.058 0.02 . 1 . . . . 36 PHE HN . 26908 1 508 . 2 2 36 36 PHE CA C 13 55.97 0.1 . 1 . . . . 36 PHE CA . 26908 1 509 . 2 2 36 36 PHE CB C 13 35.68 0.1 . 1 . . . . 36 PHE CB . 26908 1 510 . 2 2 36 36 PHE N N 15 116.95 0.1 . 1 . . . . 36 PHE N . 26908 1 511 . 2 2 37 37 GLU H H 1 8.067 0.02 . 1 . . . . 37 GLU HN . 26908 1 512 . 2 2 37 37 GLU CA C 13 55.38 0.1 . 1 . . . . 37 GLU CA . 26908 1 513 . 2 2 37 37 GLU N N 15 121.84 0.1 . 1 . . . . 37 GLU N . 26908 1 514 . 2 2 38 38 ARG CA C 13 53.72 0.1 . 1 . . . . 38 ARG CA . 26908 1 515 . 2 2 39 39 GLY H H 1 8.317 0.02 . 1 . . . . 39 GLY HN . 26908 1 516 . 2 2 39 39 GLY CA C 13 42.54 0.1 . 1 . . . . 39 GLY CA . 26908 1 517 . 2 2 39 39 GLY N N 15 109.49 0.1 . 1 . . . . 39 GLY N . 26908 1 518 . 2 2 40 40 LEU H H 1 7.984 0.02 . 1 . . . . 40 LEU HN . 26908 1 519 . 2 2 40 40 LEU CA C 13 52.55 0.1 . 1 . . . . 40 LEU CA . 26908 1 520 . 2 2 40 40 LEU CB C 13 38.8 0.1 . 1 . . . . 40 LEU CB . 26908 1 521 . 2 2 40 40 LEU N N 15 121.67 0.1 . 1 . . . . 40 LEU N . 26908 1 522 . 2 2 41 41 GLU H H 1 8.23 0.02 . 1 . . . . 41 GLU HN . 26908 1 523 . 2 2 41 41 GLU CA C 13 53.67 0.1 . 1 . . . . 41 GLU CA . 26908 1 524 . 2 2 41 41 GLU CB C 13 26.82 0.1 . 1 . . . . 41 GLU CB . 26908 1 525 . 2 2 41 41 GLU N N 15 120.66 0.1 . 1 . . . . 41 GLU N . 26908 1 526 . 2 2 42 42 ASP H H 1 8.148 0.02 . 1 . . . . 42 ASP HN . 26908 1 527 . 2 2 42 42 ASP CA C 13 51.44 0.1 . 1 . . . . 42 ASP CA . 26908 1 528 . 2 2 42 42 ASP CB C 13 38.26 0.1 . 1 . . . . 42 ASP CB . 26908 1 529 . 2 2 42 42 ASP N N 15 121.19 0.1 . 1 . . . . 42 ASP N . 26908 1 stop_ save_