data_36589 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36589 _Entry.Title ; Solution structures of the N-terminal divergent caplonin homology (NN-CH) domains of human intraflagellar transport protein 54 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-08-08 _Entry.Accession_date 2023-08-29 _Entry.Last_release_date 2023-08-29 _Entry.Original_release_date 2023-08-29 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 W. Dang W. . . . 36589 2 K. Kuwasako K. . . . 36589 3 F. He F. . . . 36589 4 M. Takahashi M. . . . 36589 5 K. Tsuda K. . . . 36589 6 T. Nagata T. . . . 36589 7 A. Tanaka A. . . . 36589 8 N. Kobayashi N. . . . 36589 9 T. Kigawa T. . . . 36589 10 P. Guentert P. . . . 36589 11 M. Shirouzu M. . . . 36589 12 S. Yokoyama S. . . . 36589 13 Y. Muto Y. . . . 36589 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 'PSI, Protein Structure Initiative' 'RIKEN Structural Genomics/Proteomics Initiative' RSGI 36589 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID IFT54 . 36589 'Intraflagellar transport (IFT) machinery' . 36589 'NN-CH domain' . 36589 PSI-2 . 36589 'Protein Structure Initiative' . 36589 'RIKEN Structural Genomics/Proteomics Initiative' . 36589 RSGI . 36589 'Structural Genomics' . 36589 'TRANSPORT PROTEIN' . 36589 ciliopathy . 36589 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36589 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 615 36589 '15N chemical shifts' 134 36589 '1H chemical shifts' 1002 36589 'distance constraints' 10909 36589 'torsion angle constraints' 686 36589 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 . . 2023-10-09 . original BMRB . 36589 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 8KCQ 'BMRB Entry Tracking System' 36589 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36589 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N resonance assignments and solution structures of the N-terminal divergent caplonin homology (NN-CH) domains of human intraflagellar transport protein 54 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'to be published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Kuwasako K. . . . 36589 1 2 W. Dang W. . . . 36589 1 3 F. He F. . . . 36589 1 4 M. Takahashi M. . . . 36589 1 5 K. Tsuda K. . . . 36589 1 6 T. Nagat T. . . . 36589 1 7 A. Tanaka A. . . . 36589 1 8 N. Kobayashi N. . . . 36589 1 9 T. KIgawa T. . . . 36589 1 10 P. Guentert P. . . . 36589 1 11 M. Shirouzu M. . . . 36589 1 12 S. Yokoyama S. . . . 36589 1 13 Y. Muto Y. . . . 36589 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36589 _Assembly.ID 1 _Assembly.Name 'TRAF3-interacting protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 15401.022 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 36589 1 stop_ loop_ _Chem_comp_assembly.Assembly_chem_comp_ID _Chem_comp_assembly.Entity_assembly_ID _Chem_comp_assembly.Entity_ID _Chem_comp_assembly.Comp_index_ID _Chem_comp_assembly.Comp_ID _Chem_comp_assembly.Seq_ID _Chem_comp_assembly.Auth_entity_assembly_ID _Chem_comp_assembly.Auth_asym_ID _Chem_comp_assembly.Auth_seq_ID _Chem_comp_assembly.Auth_comp_ID _Chem_comp_assembly.Auth_variant_ID _Chem_comp_assembly.Sequence_linking _Chem_comp_assembly.Cis_residue _Chem_comp_assembly.NEF_index _Chem_comp_assembly.Entry_ID _Chem_comp_assembly.Assembly_ID . 1 1 1 GLY 1 . A 1 GLY . start no . 36589 1 . 1 1 10 ALA 10 . A 10 ALA . middle . . 36589 1 . 1 1 100 ALA 100 . A 100 ALA . middle . . 36589 1 . 1 1 101 ARG 101 . A 101 ARG . middle . . 36589 1 . 1 1 102 ILE 102 . A 102 ILE . middle . . 36589 1 . 1 1 103 VAL 103 . A 103 VAL . middle . . 36589 1 . 1 1 104 ALA 104 . A 104 ALA . middle . . 36589 1 . 1 1 105 GLY 105 . A 105 GLY . middle no . 36589 1 . 1 1 106 HIS 106 . A 106 HIS . middle . . 36589 1 . 1 1 107 GLU 107 . A 107 GLU . middle . . 36589 1 . 1 1 108 PRO 108 . A 108 PRO . middle no . 36589 1 . 1 1 109 GLU 109 . A 109 GLU . middle . . 36589 1 . 1 1 11 ALA 11 . A 11 ALA . middle . . 36589 1 . 1 1 110 ARG 110 . A 110 ARG . middle . . 36589 1 . 1 1 111 THR 111 . A 111 THR . middle . . 36589 1 . 1 1 112 ASN 112 . A 112 ASN . middle . . 36589 1 . 1 1 113 GLU 113 . A 113 GLU . middle . . 36589 1 . 1 1 114 LEU 114 . A 114 LEU . middle . . 36589 1 . 1 1 115 LEU 115 . A 115 LEU . middle . . 36589 1 . 1 1 116 GLN 116 . A 116 GLN . middle . . 36589 1 . 1 1 117 ILE 117 . A 117 ILE . middle . . 36589 1 . 1 1 118 ILE 118 . A 118 ILE . middle . . 36589 1 . 1 1 119 GLY 119 . A 119 GLY . middle no . 36589 1 . 1 1 12 VAL 12 . A 12 VAL . middle . . 36589 1 . 1 1 120 LYS 120 . A 120 LYS . middle . . 36589 1 . 1 1 121 CYS 121 . A 121 CYS . middle . . 36589 1 . 1 1 122 CYS 122 . A 122 CYS . middle . . 36589 1 . 1 1 123 LEU 123 . A 123 LEU . middle . . 36589 1 . 1 1 124 ASN 124 . A 124 ASN . middle . . 36589 1 . 1 1 125 LYS 125 . A 125 LYS . middle . . 36589 1 . 1 1 126 LEU 126 . A 126 LEU . middle . . 36589 1 . 1 1 127 SER 127 . A 127 SER . middle . . 36589 1 . 1 1 128 SER 128 . A 128 SER . middle . . 36589 1 . 1 1 129 ASP 129 . A 129 ASP . middle . . 36589 1 . 1 1 13 VAL 13 . A 13 VAL . middle . . 36589 1 . 1 1 130 ASP 130 . A 130 ASP . middle . . 36589 1 . 1 1 131 ALA 131 . A 131 ALA . middle . . 36589 1 . 1 1 132 VAL 132 . A 132 VAL . middle . . 36589 1 . 1 1 133 ARG 133 . A 133 ARG . middle . . 36589 1 . 1 1 134 ARG 134 . A 134 ARG . middle . . 36589 1 . 1 1 135 VAL 135 . A 135 VAL . middle . . 36589 1 . 1 1 136 LEU 136 . A 136 LEU . middle . . 36589 1 . 1 1 137 ALA 137 . A 137 ALA . middle . . 36589 1 . 1 1 138 GLY 138 . A 138 GLY . middle no . 36589 1 . 1 1 139 GLU 139 . A 139 GLU . middle . . 36589 1 . 1 1 14 ARG 14 . A 14 ARG . middle . . 36589 1 . 1 1 140 LYS 140 . A 140 LYS . end . . 36589 1 . 1 1 15 ARG 15 . A 15 ARG . middle . . 36589 1 . 1 1 16 THR 16 . A 16 THR . middle . . 36589 1 . 1 1 17 GLN 17 . A 17 GLN . middle . . 36589 1 . 1 1 18 GLU 18 . A 18 GLU . middle . . 36589 1 . 1 1 19 ALA 19 . A 19 ALA . middle . . 36589 1 . 1 1 2 SER 2 . A 2 SER . middle . . 36589 1 . 1 1 20 LEU 20 . A 20 LEU . middle . . 36589 1 . 1 1 21 GLY 21 . A 21 GLY . middle no . 36589 1 . 1 1 22 LYS 22 . A 22 LYS . middle . . 36589 1 . 1 1 23 VAL 23 . A 23 VAL . middle . . 36589 1 . 1 1 24 ILE 24 . A 24 ILE . middle . . 36589 1 . 1 1 25 ARG 25 . A 25 ARG . middle . . 36589 1 . 1 1 26 ARG 26 . A 26 ARG . middle . . 36589 1 . 1 1 27 PRO 27 . A 27 PRO . middle no . 36589 1 . 1 1 28 PRO 28 . A 28 PRO . middle no . 36589 1 . 1 1 29 LEU 29 . A 29 LEU . middle . . 36589 1 . 1 1 3 SER 3 . A 3 SER . middle . . 36589 1 . 1 1 30 THR 30 . A 30 THR . middle . . 36589 1 . 1 1 31 GLU 31 . A 31 GLU . middle . . 36589 1 . 1 1 32 LYS 32 . A 32 LYS . middle . . 36589 1 . 1 1 33 LEU 33 . A 33 LEU . middle . . 36589 1 . 1 1 34 LEU 34 . A 34 LEU . middle . . 36589 1 . 1 1 35 SER 35 . A 35 SER . middle . . 36589 1 . 1 1 36 LYS 36 . A 36 LYS . middle . . 36589 1 . 1 1 37 PRO 37 . A 37 PRO . middle no . 36589 1 . 1 1 38 PRO 38 . A 38 PRO . middle no . 36589 1 . 1 1 39 PHE 39 . A 39 PHE . middle . . 36589 1 . 1 1 4 GLY 4 . A 4 GLY . middle no . 36589 1 . 1 1 40 ARG 40 . A 40 ARG . middle . . 36589 1 . 1 1 41 TYR 41 . A 41 TYR . middle . . 36589 1 . 1 1 42 LEU 42 . A 42 LEU . middle . . 36589 1 . 1 1 43 HIS 43 . A 43 HIS . middle . . 36589 1 . 1 1 44 ASP 44 . A 44 ASP . middle . . 36589 1 . 1 1 45 ILE 45 . A 45 ILE . middle . . 36589 1 . 1 1 46 ILE 46 . A 46 ILE . middle . . 36589 1 . 1 1 47 THR 47 . A 47 THR . middle . . 36589 1 . 1 1 48 GLU 48 . A 48 GLU . middle . . 36589 1 . 1 1 49 VAL 49 . A 49 VAL . middle . . 36589 1 . 1 1 5 SER 5 . A 5 SER . middle . . 36589 1 . 1 1 50 ILE 50 . A 50 ILE . middle . . 36589 1 . 1 1 51 ARG 51 . A 51 ARG . middle . . 36589 1 . 1 1 52 MET 52 . A 52 MET . middle . . 36589 1 . 1 1 53 THR 53 . A 53 THR . middle . . 36589 1 . 1 1 54 GLY 54 . A 54 GLY . middle no . 36589 1 . 1 1 55 PHE 55 . A 55 PHE . middle . . 36589 1 . 1 1 56 MET 56 . A 56 MET . middle . . 36589 1 . 1 1 57 LYS 57 . A 57 LYS . middle . . 36589 1 . 1 1 58 GLY 58 . A 58 GLY . middle no . 36589 1 . 1 1 59 LEU 59 . A 59 LEU . middle . . 36589 1 . 1 1 6 SER 6 . A 6 SER . middle . . 36589 1 . 1 1 60 TYR 60 . A 60 TYR . middle . . 36589 1 . 1 1 61 THR 61 . A 61 THR . middle . . 36589 1 . 1 1 62 ASP 62 . A 62 ASP . middle . . 36589 1 . 1 1 63 ALA 63 . A 63 ALA . middle . . 36589 1 . 1 1 64 GLU 64 . A 64 GLU . middle . . 36589 1 . 1 1 65 MET 65 . A 65 MET . middle . . 36589 1 . 1 1 66 LYS 66 . A 66 LYS . middle . . 36589 1 . 1 1 67 SER 67 . A 67 SER . middle . . 36589 1 . 1 1 68 ASP 68 . A 68 ASP . middle . . 36589 1 . 1 1 69 ASN 69 . A 69 ASN . middle . . 36589 1 . 1 1 7 GLY 7 . A 7 GLY . middle no . 36589 1 . 1 1 70 VAL 70 . A 70 VAL . middle . . 36589 1 . 1 1 71 LYS 71 . A 71 LYS . middle . . 36589 1 . 1 1 72 ASP 72 . A 72 ASP . middle . . 36589 1 . 1 1 73 LYS 73 . A 73 LYS . middle . . 36589 1 . 1 1 74 ASP 74 . A 74 ASP . middle . . 36589 1 . 1 1 75 ALA 75 . A 75 ALA . middle . . 36589 1 . 1 1 76 LYS 76 . A 76 LYS . middle . . 36589 1 . 1 1 77 ILE 77 . A 77 ILE . middle . . 36589 1 . 1 1 78 SER 78 . A 78 SER . middle . . 36589 1 . 1 1 79 PHE 79 . A 79 PHE . middle . . 36589 1 . 1 1 8 MET 8 . A 8 MET . middle . . 36589 1 . 1 1 80 LEU 80 . A 80 LEU . middle . . 36589 1 . 1 1 81 GLN 81 . A 81 GLN . middle . . 36589 1 . 1 1 82 LYS 82 . A 82 LYS . middle . . 36589 1 . 1 1 83 ALA 83 . A 83 ALA . middle . . 36589 1 . 1 1 84 ILE 84 . A 84 ILE . middle . . 36589 1 . 1 1 85 ASP 85 . A 85 ASP . middle . . 36589 1 . 1 1 86 VAL 86 . A 86 VAL . middle . . 36589 1 . 1 1 87 VAL 87 . A 87 VAL . middle . . 36589 1 . 1 1 88 VAL 88 . A 88 VAL . middle . . 36589 1 . 1 1 89 MET 89 . A 89 MET . middle . . 36589 1 . 1 1 9 ASN 9 . A 9 ASN . middle . . 36589 1 . 1 1 90 VAL 90 . A 90 VAL . middle . . 36589 1 . 1 1 91 SER 91 . A 91 SER . middle . . 36589 1 . 1 1 92 GLY 92 . A 92 GLY . middle no . 36589 1 . 1 1 93 GLU 93 . A 93 GLU . middle . . 36589 1 . 1 1 94 PRO 94 . A 94 PRO . middle no . 36589 1 . 1 1 95 LEU 95 . A 95 LEU . middle . . 36589 1 . 1 1 96 LEU 96 . A 96 LEU . middle . . 36589 1 . 1 1 97 ALA 97 . A 97 ALA . middle . . 36589 1 . 1 1 98 LYS 98 . A 98 LYS . middle . . 36589 1 . 1 1 99 PRO 99 . A 99 PRO . middle no . 36589 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36589 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'TRAF3-interacting protein 1' _Entity.Type polymer _Entity.Polymer_common_type protein _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 ; GSSGSSGMNAAVVRRTQEAL GKVIRRPPLTEKLLSKPPFR YLHDIITEVIRMTGFMKGLY TDAEMKSDNVKDKDAKISFL QKAIDVVVMVSGEPLLAKPA RIVAGHEPERTNELLQIIGK CCLNKLSSDDAVRRVLAGEK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 140 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15401.022 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 36589 1 2 2 SER . 36589 1 3 3 SER . 36589 1 4 4 GLY . 36589 1 5 5 SER . 36589 1 6 6 SER . 36589 1 7 7 GLY . 36589 1 8 8 MET . 36589 1 9 9 ASN . 36589 1 10 10 ALA . 36589 1 11 11 ALA . 36589 1 12 12 VAL . 36589 1 13 13 VAL . 36589 1 14 14 ARG . 36589 1 15 15 ARG . 36589 1 16 16 THR . 36589 1 17 17 GLN . 36589 1 18 18 GLU . 36589 1 19 19 ALA . 36589 1 20 20 LEU . 36589 1 21 21 GLY . 36589 1 22 22 LYS . 36589 1 23 23 VAL . 36589 1 24 24 ILE . 36589 1 25 25 ARG . 36589 1 26 26 ARG . 36589 1 27 27 PRO . 36589 1 28 28 PRO . 36589 1 29 29 LEU . 36589 1 30 30 THR . 36589 1 31 31 GLU . 36589 1 32 32 LYS . 36589 1 33 33 LEU . 36589 1 34 34 LEU . 36589 1 35 35 SER . 36589 1 36 36 LYS . 36589 1 37 37 PRO . 36589 1 38 38 PRO . 36589 1 39 39 PHE . 36589 1 40 40 ARG . 36589 1 41 41 TYR . 36589 1 42 42 LEU . 36589 1 43 43 HIS . 36589 1 44 44 ASP . 36589 1 45 45 ILE . 36589 1 46 46 ILE . 36589 1 47 47 THR . 36589 1 48 48 GLU . 36589 1 49 49 VAL . 36589 1 50 50 ILE . 36589 1 51 51 ARG . 36589 1 52 52 MET . 36589 1 53 53 THR . 36589 1 54 54 GLY . 36589 1 55 55 PHE . 36589 1 56 56 MET . 36589 1 57 57 LYS . 36589 1 58 58 GLY . 36589 1 59 59 LEU . 36589 1 60 60 TYR . 36589 1 61 61 THR . 36589 1 62 62 ASP . 36589 1 63 63 ALA . 36589 1 64 64 GLU . 36589 1 65 65 MET . 36589 1 66 66 LYS . 36589 1 67 67 SER . 36589 1 68 68 ASP . 36589 1 69 69 ASN . 36589 1 70 70 VAL . 36589 1 71 71 LYS . 36589 1 72 72 ASP . 36589 1 73 73 LYS . 36589 1 74 74 ASP . 36589 1 75 75 ALA . 36589 1 76 76 LYS . 36589 1 77 77 ILE . 36589 1 78 78 SER . 36589 1 79 79 PHE . 36589 1 80 80 LEU . 36589 1 81 81 GLN . 36589 1 82 82 LYS . 36589 1 83 83 ALA . 36589 1 84 84 ILE . 36589 1 85 85 ASP . 36589 1 86 86 VAL . 36589 1 87 87 VAL . 36589 1 88 88 VAL . 36589 1 89 89 MET . 36589 1 90 90 VAL . 36589 1 91 91 SER . 36589 1 92 92 GLY . 36589 1 93 93 GLU . 36589 1 94 94 PRO . 36589 1 95 95 LEU . 36589 1 96 96 LEU . 36589 1 97 97 ALA . 36589 1 98 98 LYS . 36589 1 99 99 PRO . 36589 1 100 100 ALA . 36589 1 101 101 ARG . 36589 1 102 102 ILE . 36589 1 103 103 VAL . 36589 1 104 104 ALA . 36589 1 105 105 GLY . 36589 1 106 106 HIS . 36589 1 107 107 GLU . 36589 1 108 108 PRO . 36589 1 109 109 GLU . 36589 1 110 110 ARG . 36589 1 111 111 THR . 36589 1 112 112 ASN . 36589 1 113 113 GLU . 36589 1 114 114 LEU . 36589 1 115 115 LEU . 36589 1 116 116 GLN . 36589 1 117 117 ILE . 36589 1 118 118 ILE . 36589 1 119 119 GLY . 36589 1 120 120 LYS . 36589 1 121 121 CYS . 36589 1 122 122 CYS . 36589 1 123 123 LEU . 36589 1 124 124 ASN . 36589 1 125 125 LYS . 36589 1 126 126 LEU . 36589 1 127 127 SER . 36589 1 128 128 SER . 36589 1 129 129 ASP . 36589 1 130 130 ASP . 36589 1 131 131 ALA . 36589 1 132 132 VAL . 36589 1 133 133 ARG . 36589 1 134 134 ARG . 36589 1 135 135 VAL . 36589 1 136 136 LEU . 36589 1 137 137 ALA . 36589 1 138 138 GLY . 36589 1 139 139 GLU . 36589 1 140 140 LYS . 36589 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 36589 1 . SER 2 2 36589 1 . SER 3 3 36589 1 . GLY 4 4 36589 1 . SER 5 5 36589 1 . SER 6 6 36589 1 . GLY 7 7 36589 1 . MET 8 8 36589 1 . ASN 9 9 36589 1 . ALA 10 10 36589 1 . ALA 11 11 36589 1 . VAL 12 12 36589 1 . VAL 13 13 36589 1 . ARG 14 14 36589 1 . ARG 15 15 36589 1 . THR 16 16 36589 1 . GLN 17 17 36589 1 . GLU 18 18 36589 1 . ALA 19 19 36589 1 . LEU 20 20 36589 1 . GLY 21 21 36589 1 . LYS 22 22 36589 1 . VAL 23 23 36589 1 . ILE 24 24 36589 1 . ARG 25 25 36589 1 . ARG 26 26 36589 1 . PRO 27 27 36589 1 . PRO 28 28 36589 1 . LEU 29 29 36589 1 . THR 30 30 36589 1 . GLU 31 31 36589 1 . LYS 32 32 36589 1 . LEU 33 33 36589 1 . LEU 34 34 36589 1 . SER 35 35 36589 1 . LYS 36 36 36589 1 . PRO 37 37 36589 1 . PRO 38 38 36589 1 . PHE 39 39 36589 1 . ARG 40 40 36589 1 . TYR 41 41 36589 1 . LEU 42 42 36589 1 . HIS 43 43 36589 1 . ASP 44 44 36589 1 . ILE 45 45 36589 1 . ILE 46 46 36589 1 . THR 47 47 36589 1 . GLU 48 48 36589 1 . VAL 49 49 36589 1 . ILE 50 50 36589 1 . ARG 51 51 36589 1 . MET 52 52 36589 1 . THR 53 53 36589 1 . GLY 54 54 36589 1 . PHE 55 55 36589 1 . MET 56 56 36589 1 . LYS 57 57 36589 1 . GLY 58 58 36589 1 . LEU 59 59 36589 1 . TYR 60 60 36589 1 . THR 61 61 36589 1 . ASP 62 62 36589 1 . ALA 63 63 36589 1 . GLU 64 64 36589 1 . MET 65 65 36589 1 . LYS 66 66 36589 1 . SER 67 67 36589 1 . ASP 68 68 36589 1 . ASN 69 69 36589 1 . VAL 70 70 36589 1 . LYS 71 71 36589 1 . ASP 72 72 36589 1 . LYS 73 73 36589 1 . ASP 74 74 36589 1 . ALA 75 75 36589 1 . LYS 76 76 36589 1 . ILE 77 77 36589 1 . SER 78 78 36589 1 . PHE 79 79 36589 1 . LEU 80 80 36589 1 . GLN 81 81 36589 1 . LYS 82 82 36589 1 . ALA 83 83 36589 1 . ILE 84 84 36589 1 . ASP 85 85 36589 1 . VAL 86 86 36589 1 . VAL 87 87 36589 1 . VAL 88 88 36589 1 . MET 89 89 36589 1 . VAL 90 90 36589 1 . SER 91 91 36589 1 . GLY 92 92 36589 1 . GLU 93 93 36589 1 . PRO 94 94 36589 1 . LEU 95 95 36589 1 . LEU 96 96 36589 1 . ALA 97 97 36589 1 . LYS 98 98 36589 1 . PRO 99 99 36589 1 . ALA 100 100 36589 1 . ARG 101 101 36589 1 . ILE 102 102 36589 1 . VAL 103 103 36589 1 . ALA 104 104 36589 1 . GLY 105 105 36589 1 . HIS 106 106 36589 1 . GLU 107 107 36589 1 . PRO 108 108 36589 1 . GLU 109 109 36589 1 . ARG 110 110 36589 1 . THR 111 111 36589 1 . ASN 112 112 36589 1 . GLU 113 113 36589 1 . LEU 114 114 36589 1 . LEU 115 115 36589 1 . GLN 116 116 36589 1 . ILE 117 117 36589 1 . ILE 118 118 36589 1 . GLY 119 119 36589 1 . LYS 120 120 36589 1 . CYS 121 121 36589 1 . CYS 122 122 36589 1 . LEU 123 123 36589 1 . ASN 124 124 36589 1 . LYS 125 125 36589 1 . LEU 126 126 36589 1 . SER 127 127 36589 1 . SER 128 128 36589 1 . ASP 129 129 36589 1 . ASP 130 130 36589 1 . ALA 131 131 36589 1 . VAL 132 132 36589 1 . ARG 133 133 36589 1 . ARG 134 134 36589 1 . VAL 135 135 36589 1 . LEU 136 136 36589 1 . ALA 137 137 36589 1 . GLY 138 138 36589 1 . GLU 139 139 36589 1 . LYS 140 140 36589 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 36589 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . TRAF3IP1 . 36589 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 36589 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Cell-free gateway cloning vector N-term 8xHis mcherry pCellFree_G05' . 'CELL-Free Protein Synthesis' 1508208 . 'Cell-free gateway cloning vector N-term 8xHis mcherry pCellFree_G05' . . . PLASMID . . . . . . 36589 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36589 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8 mM [U-99% 13C; U-99% 15N] NN-CH domain of human IFT54, 100 mM None NaCl, 1 mM [U-99% 2H] d-DTT, 20 mM [U-99% 2H] d-Tris HCl, 0.02 % None NaN3, 90% H2O/10% D2O ; _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 'NN-CH domain of human IFT54' '[U-99% 13C; U-99% 15N]' 1 $assembly 1 $entity_1 . protein 0.8 . . mM . . . . 36589 1 2 NaN3 None . . . . . cytocide 0.02 . . % . . . . 36589 1 3 d-DTT [U-2H] . . . . . 'reducing agent' 1 . . mM . . . . 36589 1 4 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 36589 1 5 'd-Tris HCl' [U-2H] . . . . . buffer 20 . . mM . . . . 36589 1 6 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36589 1 7 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36589 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 36589 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 100 . mM 36589 1 pH 7.0 . pH 36589 1 pressure 1 . atm 36589 1 temperature 298 . K 36589 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36589 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version 12 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36589 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36589 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36589 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 2.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36589 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36589 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36589 _Software.ID 3 _Software.Type . _Software.Name KUJIRA _Software.Version 0.863 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'N. Kobayashi, T. Kigawa, S. Yokoyama' . . 36589 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36589 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36589 _Software.ID 4 _Software.Type . _Software.Name MagRO-NMRView _Software.Version 1.2.38 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'N. Kobayashi' . . 36589 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 36589 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36589 _Software.ID 5 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 36589 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'geometry optimization' . 36589 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36589 _Software.ID 6 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 36589 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36589 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36589 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details 3D_13C,15N-SEPARATED_NOESY _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 36589 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'Assignments (CBCACONH et al.)' _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 36589 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Bruker AVANCE . 800 . . . 36589 1 2 NMR_spectrometer_2 Bruker AVANCE . 600 . . . 36589 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 36589 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D_13C,15N-SEPARATED_NOESY SPECTRA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36589 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36589 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36589 1 4 '3D HCCH-COSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36589 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36589 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36589 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.821ppm at 298K) and then those of 15N and 13C were calculated based on their gyro-magnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 0.000 internal indirect 0.251449530 . . . . . 36589 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36589 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36589 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36589 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D_13C,15N-SEPARATED_NOESY SPECTRA' 1 $sample_1 isotropic 36589 1 2 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36589 1 3 '3D HNCACB' 1 $sample_1 isotropic 36589 1 4 '3D HCCH-COSY' 1 $sample_1 isotropic 36589 1 5 '3D HCCH-TOCSY' 1 $sample_1 isotropic 36589 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 6 6 SER HA H 1 4.505 0.030 . 1 . . . . A 6 SER HA . 36589 1 2 . 1 . 1 6 6 SER HB2 H 1 3.890 0.030 . 1 . . . . A 6 SER HB2 . 36589 1 3 . 1 . 1 6 6 SER HB3 H 1 3.890 0.030 . 1 . . . . A 6 SER HB3 . 36589 1 4 . 1 . 1 6 6 SER C C 13 174.747 0.300 . 1 . . . . A 6 SER C . 36589 1 5 . 1 . 1 6 6 SER CA C 13 58.480 0.300 . 1 . . . . A 6 SER CA . 36589 1 6 . 1 . 1 6 6 SER CB C 13 63.761 0.300 . 1 . . . . A 6 SER CB . 36589 1 7 . 1 . 1 7 7 GLY H H 1 8.406 0.030 . 1 . . . . A 7 GLY H . 36589 1 8 . 1 . 1 7 7 GLY HA2 H 1 4.003 0.030 . 1 . . . . A 7 GLY HA2 . 36589 1 9 . 1 . 1 7 7 GLY HA3 H 1 4.003 0.030 . 1 . . . . A 7 GLY HA3 . 36589 1 10 . 1 . 1 7 7 GLY C C 13 173.031 0.300 . 1 . . . . A 7 GLY C . 36589 1 11 . 1 . 1 7 7 GLY CA C 13 45.064 0.300 . 1 . . . . A 7 GLY CA . 36589 1 12 . 1 . 1 7 7 GLY N N 15 110.579 0.300 . 1 . . . . A 7 GLY N . 36589 1 13 . 1 . 1 8 8 MET H H 1 8.319 0.030 . 1 . . . . A 8 MET H . 36589 1 14 . 1 . 1 8 8 MET HA H 1 4.633 0.030 . 1 . . . . A 8 MET HA . 36589 1 15 . 1 . 1 8 8 MET HB2 H 1 1.984 0.030 . 2 . . . . A 8 MET HB2 . 36589 1 16 . 1 . 1 8 8 MET HB3 H 1 2.175 0.030 . 2 . . . . A 8 MET HB3 . 36589 1 17 . 1 . 1 8 8 MET HG2 H 1 2.844 0.030 . 2 . . . . A 8 MET HG2 . 36589 1 18 . 1 . 1 8 8 MET HG3 H 1 2.511 0.030 . 2 . . . . A 8 MET HG3 . 36589 1 19 . 1 . 1 8 8 MET HE1 H 1 1.959 0.030 . 1 . . . . A 8 MET HE1 . 36589 1 20 . 1 . 1 8 8 MET HE2 H 1 1.959 0.030 . 1 . . . . A 8 MET HE2 . 36589 1 21 . 1 . 1 8 8 MET HE3 H 1 1.959 0.030 . 1 . . . . A 8 MET HE3 . 36589 1 22 . 1 . 1 8 8 MET C C 13 175.029 0.300 . 1 . . . . A 8 MET C . 36589 1 23 . 1 . 1 8 8 MET CA C 13 54.676 0.300 . 1 . . . . A 8 MET CA . 36589 1 24 . 1 . 1 8 8 MET CB C 13 32.818 0.300 . 1 . . . . A 8 MET CB . 36589 1 25 . 1 . 1 8 8 MET CG C 13 32.618 0.300 . 1 . . . . A 8 MET CG . 36589 1 26 . 1 . 1 8 8 MET CE C 13 18.196 0.300 . 1 . . . . A 8 MET CE . 36589 1 27 . 1 . 1 8 8 MET N N 15 119.866 0.300 . 1 . . . . A 8 MET N . 36589 1 28 . 1 . 1 9 9 ASN H H 1 7.790 0.030 . 1 . . . . A 9 ASN H . 36589 1 29 . 1 . 1 9 9 ASN HA H 1 4.716 0.030 . 1 . . . . A 9 ASN HA . 36589 1 30 . 1 . 1 9 9 ASN HB2 H 1 3.067 0.030 . 1 . . . . A 9 ASN HB2 . 36589 1 31 . 1 . 1 9 9 ASN HB3 H 1 3.067 0.030 . 1 . . . . A 9 ASN HB3 . 36589 1 32 . 1 . 1 9 9 ASN HD21 H 1 7.581 0.030 . 2 . . . . A 9 ASN HD21 . 36589 1 33 . 1 . 1 9 9 ASN HD22 H 1 6.799 0.030 . 2 . . . . A 9 ASN HD22 . 36589 1 34 . 1 . 1 9 9 ASN C C 13 175.560 0.300 . 1 . . . . A 9 ASN C . 36589 1 35 . 1 . 1 9 9 ASN CA C 13 53.125 0.300 . 1 . . . . A 9 ASN CA . 36589 1 36 . 1 . 1 9 9 ASN CB C 13 39.798 0.300 . 1 . . . . A 9 ASN CB . 36589 1 37 . 1 . 1 9 9 ASN N N 15 120.561 0.300 . 1 . . . . A 9 ASN N . 36589 1 38 . 1 . 1 9 9 ASN ND2 N 15 113.405 0.300 . 1 . . . . A 9 ASN ND2 . 36589 1 39 . 1 . 1 10 10 ALA H H 1 8.691 0.030 . 1 . . . . A 10 ALA H . 36589 1 40 . 1 . 1 10 10 ALA HA H 1 4.029 0.030 . 1 . . . . A 10 ALA HA . 36589 1 41 . 1 . 1 10 10 ALA HB1 H 1 1.504 0.030 . 1 . . . . A 10 ALA HB1 . 36589 1 42 . 1 . 1 10 10 ALA HB2 H 1 1.504 0.030 . 1 . . . . A 10 ALA HB2 . 36589 1 43 . 1 . 1 10 10 ALA HB3 H 1 1.504 0.030 . 1 . . . . A 10 ALA HB3 . 36589 1 44 . 1 . 1 10 10 ALA C C 13 179.228 0.300 . 1 . . . . A 10 ALA C . 36589 1 45 . 1 . 1 10 10 ALA CA C 13 55.198 0.300 . 1 . . . . A 10 ALA CA . 36589 1 46 . 1 . 1 10 10 ALA CB C 13 18.767 0.300 . 1 . . . . A 10 ALA CB . 36589 1 47 . 1 . 1 10 10 ALA N N 15 123.325 0.300 . 1 . . . . A 10 ALA N . 36589 1 48 . 1 . 1 11 11 ALA H H 1 8.350 0.030 . 1 . . . . A 11 ALA H . 36589 1 49 . 1 . 1 11 11 ALA HA H 1 4.113 0.030 . 1 . . . . A 11 ALA HA . 36589 1 50 . 1 . 1 11 11 ALA HB1 H 1 1.486 0.030 . 1 . . . . A 11 ALA HB1 . 36589 1 51 . 1 . 1 11 11 ALA HB2 H 1 1.486 0.030 . 1 . . . . A 11 ALA HB2 . 36589 1 52 . 1 . 1 11 11 ALA HB3 H 1 1.486 0.030 . 1 . . . . A 11 ALA HB3 . 36589 1 53 . 1 . 1 11 11 ALA C C 13 180.275 0.300 . 1 . . . . A 11 ALA C . 36589 1 54 . 1 . 1 11 11 ALA CA C 13 55.020 0.300 . 1 . . . . A 11 ALA CA . 36589 1 55 . 1 . 1 11 11 ALA CB C 13 18.011 0.300 . 1 . . . . A 11 ALA CB . 36589 1 56 . 1 . 1 11 11 ALA N N 15 120.938 0.300 . 1 . . . . A 11 ALA N . 36589 1 57 . 1 . 1 12 12 VAL H H 1 7.706 0.030 . 1 . . . . A 12 VAL H . 36589 1 58 . 1 . 1 12 12 VAL HA H 1 3.610 0.030 . 1 . . . . A 12 VAL HA . 36589 1 59 . 1 . 1 12 12 VAL HB H 1 2.336 0.030 . 1 . . . . A 12 VAL HB . 36589 1 60 . 1 . 1 12 12 VAL HG11 H 1 1.209 0.030 . 2 . . . . A 12 VAL HG11 . 36589 1 61 . 1 . 1 12 12 VAL HG12 H 1 1.209 0.030 . 2 . . . . A 12 VAL HG12 . 36589 1 62 . 1 . 1 12 12 VAL HG13 H 1 1.209 0.030 . 2 . . . . A 12 VAL HG13 . 36589 1 63 . 1 . 1 12 12 VAL HG21 H 1 0.972 0.030 . 2 . . . . A 12 VAL HG21 . 36589 1 64 . 1 . 1 12 12 VAL HG22 H 1 0.972 0.030 . 2 . . . . A 12 VAL HG22 . 36589 1 65 . 1 . 1 12 12 VAL HG23 H 1 0.972 0.030 . 2 . . . . A 12 VAL HG23 . 36589 1 66 . 1 . 1 12 12 VAL C C 13 177.530 0.300 . 1 . . . . A 12 VAL C . 36589 1 67 . 1 . 1 12 12 VAL CA C 13 66.478 0.300 . 1 . . . . A 12 VAL CA . 36589 1 68 . 1 . 1 12 12 VAL CB C 13 32.059 0.300 . 1 . . . . A 12 VAL CB . 36589 1 69 . 1 . 1 12 12 VAL CG1 C 13 22.159 0.300 . 2 . . . . A 12 VAL CG1 . 36589 1 70 . 1 . 1 12 12 VAL CG2 C 13 22.051 0.300 . 2 . . . . A 12 VAL CG2 . 36589 1 71 . 1 . 1 12 12 VAL N N 15 118.964 0.300 . 1 . . . . A 12 VAL N . 36589 1 72 . 1 . 1 13 13 VAL H H 1 6.945 0.030 . 1 . . . . A 13 VAL H . 36589 1 73 . 1 . 1 13 13 VAL HA H 1 3.434 0.030 . 1 . . . . A 13 VAL HA . 36589 1 74 . 1 . 1 13 13 VAL HB H 1 2.184 0.030 . 1 . . . . A 13 VAL HB . 36589 1 75 . 1 . 1 13 13 VAL HG11 H 1 0.921 0.030 . 2 . . . . A 13 VAL HG11 . 36589 1 76 . 1 . 1 13 13 VAL HG12 H 1 0.921 0.030 . 2 . . . . A 13 VAL HG12 . 36589 1 77 . 1 . 1 13 13 VAL HG13 H 1 0.921 0.030 . 2 . . . . A 13 VAL HG13 . 36589 1 78 . 1 . 1 13 13 VAL HG21 H 1 0.796 0.030 . 2 . . . . A 13 VAL HG21 . 36589 1 79 . 1 . 1 13 13 VAL HG22 H 1 0.796 0.030 . 2 . . . . A 13 VAL HG22 . 36589 1 80 . 1 . 1 13 13 VAL HG23 H 1 0.796 0.030 . 2 . . . . A 13 VAL HG23 . 36589 1 81 . 1 . 1 13 13 VAL C C 13 177.916 0.300 . 1 . . . . A 13 VAL C . 36589 1 82 . 1 . 1 13 13 VAL CA C 13 66.333 0.300 . 1 . . . . A 13 VAL CA . 36589 1 83 . 1 . 1 13 13 VAL CB C 13 31.608 0.300 . 1 . . . . A 13 VAL CB . 36589 1 84 . 1 . 1 13 13 VAL CG1 C 13 22.979 0.300 . 2 . . . . A 13 VAL CG1 . 36589 1 85 . 1 . 1 13 13 VAL CG2 C 13 21.189 0.300 . 2 . . . . A 13 VAL CG2 . 36589 1 86 . 1 . 1 13 13 VAL N N 15 116.570 0.300 . 1 . . . . A 13 VAL N . 36589 1 87 . 1 . 1 14 14 ARG H H 1 7.939 0.030 . 1 . . . . A 14 ARG H . 36589 1 88 . 1 . 1 14 14 ARG HA H 1 4.362 0.030 . 1 . . . . A 14 ARG HA . 36589 1 89 . 1 . 1 14 14 ARG HB2 H 1 1.926 0.030 . 1 . . . . A 14 ARG HB2 . 36589 1 90 . 1 . 1 14 14 ARG HB3 H 1 1.926 0.030 . 1 . . . . A 14 ARG HB3 . 36589 1 91 . 1 . 1 14 14 ARG HG2 H 1 1.677 0.030 . 2 . . . . A 14 ARG HG2 . 36589 1 92 . 1 . 1 14 14 ARG HG3 H 1 1.769 0.030 . 2 . . . . A 14 ARG HG3 . 36589 1 93 . 1 . 1 14 14 ARG HD2 H 1 3.276 0.030 . 1 . . . . A 14 ARG HD2 . 36589 1 94 . 1 . 1 14 14 ARG HD3 H 1 3.276 0.030 . 1 . . . . A 14 ARG HD3 . 36589 1 95 . 1 . 1 14 14 ARG C C 13 178.795 0.300 . 1 . . . . A 14 ARG C . 36589 1 96 . 1 . 1 14 14 ARG CA C 13 58.826 0.300 . 1 . . . . A 14 ARG CA . 36589 1 97 . 1 . 1 14 14 ARG CB C 13 29.727 0.300 . 1 . . . . A 14 ARG CB . 36589 1 98 . 1 . 1 14 14 ARG CG C 13 27.592 0.300 . 1 . . . . A 14 ARG CG . 36589 1 99 . 1 . 1 14 14 ARG CD C 13 43.296 0.300 . 1 . . . . A 14 ARG CD . 36589 1 100 . 1 . 1 14 14 ARG N N 15 118.820 0.300 . 1 . . . . A 14 ARG N . 36589 1 101 . 1 . 1 15 15 ARG H H 1 7.902 0.030 . 1 . . . . A 15 ARG H . 36589 1 102 . 1 . 1 15 15 ARG HA H 1 4.151 0.030 . 1 . . . . A 15 ARG HA . 36589 1 103 . 1 . 1 15 15 ARG HB2 H 1 1.817 0.030 . 2 . . . . A 15 ARG HB2 . 36589 1 104 . 1 . 1 15 15 ARG HB3 H 1 2.100 0.030 . 2 . . . . A 15 ARG HB3 . 36589 1 105 . 1 . 1 15 15 ARG HG2 H 1 1.593 0.030 . 2 . . . . A 15 ARG HG2 . 36589 1 106 . 1 . 1 15 15 ARG HG3 H 1 1.880 0.030 . 2 . . . . A 15 ARG HG3 . 36589 1 107 . 1 . 1 15 15 ARG HD2 H 1 3.168 0.030 . 2 . . . . A 15 ARG HD2 . 36589 1 108 . 1 . 1 15 15 ARG HD3 H 1 3.261 0.030 . 2 . . . . A 15 ARG HD3 . 36589 1 109 . 1 . 1 15 15 ARG C C 13 180.206 0.300 . 1 . . . . A 15 ARG C . 36589 1 110 . 1 . 1 15 15 ARG CA C 13 59.811 0.300 . 1 . . . . A 15 ARG CA . 36589 1 111 . 1 . 1 15 15 ARG CB C 13 30.163 0.300 . 1 . . . . A 15 ARG CB . 36589 1 112 . 1 . 1 15 15 ARG CG C 13 28.422 0.300 . 1 . . . . A 15 ARG CG . 36589 1 113 . 1 . 1 15 15 ARG CD C 13 43.826 0.300 . 1 . . . . A 15 ARG CD . 36589 1 114 . 1 . 1 15 15 ARG N N 15 118.538 0.300 . 1 . . . . A 15 ARG N . 36589 1 115 . 1 . 1 16 16 THR H H 1 8.266 0.030 . 1 . . . . A 16 THR H . 36589 1 116 . 1 . 1 16 16 THR HA H 1 4.555 0.030 . 1 . . . . A 16 THR HA . 36589 1 117 . 1 . 1 16 16 THR HB H 1 3.914 0.030 . 1 . . . . A 16 THR HB . 36589 1 118 . 1 . 1 16 16 THR HG21 H 1 1.258 0.030 . 1 . . . . A 16 THR HG21 . 36589 1 119 . 1 . 1 16 16 THR HG22 H 1 1.258 0.030 . 1 . . . . A 16 THR HG22 . 36589 1 120 . 1 . 1 16 16 THR HG23 H 1 1.258 0.030 . 1 . . . . A 16 THR HG23 . 36589 1 121 . 1 . 1 16 16 THR C C 13 175.992 0.300 . 1 . . . . A 16 THR C . 36589 1 122 . 1 . 1 16 16 THR CA C 13 67.414 0.300 . 1 . . . . A 16 THR CA . 36589 1 123 . 1 . 1 16 16 THR CB C 13 67.468 0.300 . 1 . . . . A 16 THR CB . 36589 1 124 . 1 . 1 16 16 THR CG2 C 13 25.811 0.300 . 1 . . . . A 16 THR CG2 . 36589 1 125 . 1 . 1 16 16 THR N N 15 119.673 0.300 . 1 . . . . A 16 THR N . 36589 1 126 . 1 . 1 17 17 GLN H H 1 8.617 0.030 . 1 . . . . A 17 GLN H . 36589 1 127 . 1 . 1 17 17 GLN HA H 1 3.822 0.030 . 1 . . . . A 17 GLN HA . 36589 1 128 . 1 . 1 17 17 GLN HB2 H 1 2.008 0.030 . 2 . . . . A 17 GLN HB2 . 36589 1 129 . 1 . 1 17 17 GLN HB3 H 1 2.558 0.030 . 2 . . . . A 17 GLN HB3 . 36589 1 130 . 1 . 1 17 17 GLN HG2 H 1 2.436 0.030 . 2 . . . . A 17 GLN HG2 . 36589 1 131 . 1 . 1 17 17 GLN HG3 H 1 2.324 0.030 . 2 . . . . A 17 GLN HG3 . 36589 1 132 . 1 . 1 17 17 GLN HE21 H 1 7.402 0.030 . 2 . . . . A 17 GLN HE21 . 36589 1 133 . 1 . 1 17 17 GLN HE22 H 1 6.713 0.030 . 2 . . . . A 17 GLN HE22 . 36589 1 134 . 1 . 1 17 17 GLN C C 13 179.841 0.300 . 1 . . . . A 17 GLN C . 36589 1 135 . 1 . 1 17 17 GLN CA C 13 59.829 0.300 . 1 . . . . A 17 GLN CA . 36589 1 136 . 1 . 1 17 17 GLN CB C 13 28.167 0.300 . 1 . . . . A 17 GLN CB . 36589 1 137 . 1 . 1 17 17 GLN CG C 13 34.205 0.300 . 1 . . . . A 17 GLN CG . 36589 1 138 . 1 . 1 17 17 GLN N N 15 121.143 0.300 . 1 . . . . A 17 GLN N . 36589 1 139 . 1 . 1 17 17 GLN NE2 N 15 109.258 0.300 . 1 . . . . A 17 GLN NE2 . 36589 1 140 . 1 . 1 18 18 GLU H H 1 8.654 0.030 . 1 . . . . A 18 GLU H . 36589 1 141 . 1 . 1 18 18 GLU HA H 1 4.031 0.030 . 1 . . . . A 18 GLU HA . 36589 1 142 . 1 . 1 18 18 GLU HB2 H 1 2.137 0.030 . 2 . . . . A 18 GLU HB2 . 36589 1 143 . 1 . 1 18 18 GLU HB3 H 1 2.068 0.030 . 2 . . . . A 18 GLU HB3 . 36589 1 144 . 1 . 1 18 18 GLU HG2 H 1 2.286 0.030 . 2 . . . . A 18 GLU HG2 . 36589 1 145 . 1 . 1 18 18 GLU HG3 H 1 2.475 0.030 . 2 . . . . A 18 GLU HG3 . 36589 1 146 . 1 . 1 18 18 GLU C C 13 177.909 0.300 . 1 . . . . A 18 GLU C . 36589 1 147 . 1 . 1 18 18 GLU CA C 13 58.933 0.300 . 1 . . . . A 18 GLU CA . 36589 1 148 . 1 . 1 18 18 GLU CB C 13 30.011 0.300 . 1 . . . . A 18 GLU CB . 36589 1 149 . 1 . 1 18 18 GLU CG C 13 36.679 0.300 . 1 . . . . A 18 GLU CG . 36589 1 150 . 1 . 1 18 18 GLU N N 15 118.910 0.300 . 1 . . . . A 18 GLU N . 36589 1 151 . 1 . 1 19 19 ALA H H 1 7.823 0.030 . 1 . . . . A 19 ALA H . 36589 1 152 . 1 . 1 19 19 ALA HA H 1 4.318 0.030 . 1 . . . . A 19 ALA HA . 36589 1 153 . 1 . 1 19 19 ALA HB1 H 1 1.608 0.030 . 1 . . . . A 19 ALA HB1 . 36589 1 154 . 1 . 1 19 19 ALA HB2 H 1 1.608 0.030 . 1 . . . . A 19 ALA HB2 . 36589 1 155 . 1 . 1 19 19 ALA HB3 H 1 1.608 0.030 . 1 . . . . A 19 ALA HB3 . 36589 1 156 . 1 . 1 19 19 ALA C C 13 178.768 0.300 . 1 . . . . A 19 ALA C . 36589 1 157 . 1 . 1 19 19 ALA CA C 13 54.294 0.300 . 1 . . . . A 19 ALA CA . 36589 1 158 . 1 . 1 19 19 ALA CB C 13 20.066 0.300 . 1 . . . . A 19 ALA CB . 36589 1 159 . 1 . 1 19 19 ALA N N 15 119.803 0.300 . 1 . . . . A 19 ALA N . 36589 1 160 . 1 . 1 20 20 LEU H H 1 8.077 0.030 . 1 . . . . A 20 LEU H . 36589 1 161 . 1 . 1 20 20 LEU HA H 1 4.472 0.030 . 1 . . . . A 20 LEU HA . 36589 1 162 . 1 . 1 20 20 LEU HB2 H 1 1.504 0.030 . 2 . . . . A 20 LEU HB2 . 36589 1 163 . 1 . 1 20 20 LEU HB3 H 1 1.673 0.030 . 2 . . . . A 20 LEU HB3 . 36589 1 164 . 1 . 1 20 20 LEU HG H 1 1.615 0.030 . 1 . . . . A 20 LEU HG . 36589 1 165 . 1 . 1 20 20 LEU HD11 H 1 0.845 0.030 . 2 . . . . A 20 LEU HD11 . 36589 1 166 . 1 . 1 20 20 LEU HD12 H 1 0.845 0.030 . 2 . . . . A 20 LEU HD12 . 36589 1 167 . 1 . 1 20 20 LEU HD13 H 1 0.845 0.030 . 2 . . . . A 20 LEU HD13 . 36589 1 168 . 1 . 1 20 20 LEU HD21 H 1 0.795 0.030 . 2 . . . . A 20 LEU HD21 . 36589 1 169 . 1 . 1 20 20 LEU HD22 H 1 0.795 0.030 . 2 . . . . A 20 LEU HD22 . 36589 1 170 . 1 . 1 20 20 LEU HD23 H 1 0.795 0.030 . 2 . . . . A 20 LEU HD23 . 36589 1 171 . 1 . 1 20 20 LEU C C 13 179.075 0.300 . 1 . . . . A 20 LEU C . 36589 1 172 . 1 . 1 20 20 LEU CA C 13 55.326 0.300 . 1 . . . . A 20 LEU CA . 36589 1 173 . 1 . 1 20 20 LEU CB C 13 43.712 0.300 . 1 . . . . A 20 LEU CB . 36589 1 174 . 1 . 1 20 20 LEU CG C 13 27.144 0.300 . 1 . . . . A 20 LEU CG . 36589 1 175 . 1 . 1 20 20 LEU CD1 C 13 25.976 0.300 . 2 . . . . A 20 LEU CD1 . 36589 1 176 . 1 . 1 20 20 LEU CD2 C 13 23.234 0.300 . 2 . . . . A 20 LEU CD2 . 36589 1 177 . 1 . 1 20 20 LEU N N 15 113.151 0.300 . 1 . . . . A 20 LEU N . 36589 1 178 . 1 . 1 21 21 GLY H H 1 8.070 0.030 . 1 . . . . A 21 GLY H . 36589 1 179 . 1 . 1 21 21 GLY HA2 H 1 4.052 0.030 . 2 . . . . A 21 GLY HA2 . 36589 1 180 . 1 . 1 21 21 GLY HA3 H 1 4.106 0.030 . 2 . . . . A 21 GLY HA3 . 36589 1 181 . 1 . 1 21 21 GLY C C 13 174.760 0.300 . 1 . . . . A 21 GLY C . 36589 1 182 . 1 . 1 21 21 GLY CA C 13 47.086 0.300 . 1 . . . . A 21 GLY CA . 36589 1 183 . 1 . 1 21 21 GLY N N 15 108.173 0.300 . 1 . . . . A 21 GLY N . 36589 1 184 . 1 . 1 22 22 LYS H H 1 7.646 0.030 . 1 . . . . A 22 LYS H . 36589 1 185 . 1 . 1 22 22 LYS HA H 1 4.406 0.030 . 1 . . . . A 22 LYS HA . 36589 1 186 . 1 . 1 22 22 LYS HB2 H 1 1.831 0.030 . 2 . . . . A 22 LYS HB2 . 36589 1 187 . 1 . 1 22 22 LYS HB3 H 1 2.005 0.030 . 2 . . . . A 22 LYS HB3 . 36589 1 188 . 1 . 1 22 22 LYS HG2 H 1 1.471 0.030 . 2 . . . . A 22 LYS HG2 . 36589 1 189 . 1 . 1 22 22 LYS HG3 H 1 1.641 0.030 . 2 . . . . A 22 LYS HG3 . 36589 1 190 . 1 . 1 22 22 LYS HD2 H 1 1.728 0.030 . 1 . . . . A 22 LYS HD2 . 36589 1 191 . 1 . 1 22 22 LYS HD3 H 1 1.728 0.030 . 1 . . . . A 22 LYS HD3 . 36589 1 192 . 1 . 1 22 22 LYS HE2 H 1 3.043 0.030 . 1 . . . . A 22 LYS HE2 . 36589 1 193 . 1 . 1 22 22 LYS HE3 H 1 3.043 0.030 . 1 . . . . A 22 LYS HE3 . 36589 1 194 . 1 . 1 22 22 LYS C C 13 176.731 0.300 . 1 . . . . A 22 LYS C . 36589 1 195 . 1 . 1 22 22 LYS CA C 13 56.519 0.300 . 1 . . . . A 22 LYS CA . 36589 1 196 . 1 . 1 22 22 LYS CB C 13 33.123 0.300 . 1 . . . . A 22 LYS CB . 36589 1 197 . 1 . 1 22 22 LYS CG C 13 25.450 0.300 . 1 . . . . A 22 LYS CG . 36589 1 198 . 1 . 1 22 22 LYS CD C 13 29.155 0.300 . 1 . . . . A 22 LYS CD . 36589 1 199 . 1 . 1 22 22 LYS CE C 13 42.224 0.300 . 1 . . . . A 22 LYS CE . 36589 1 200 . 1 . 1 22 22 LYS N N 15 115.453 0.300 . 1 . . . . A 22 LYS N . 36589 1 201 . 1 . 1 23 23 VAL H H 1 7.792 0.030 . 1 . . . . A 23 VAL H . 36589 1 202 . 1 . 1 23 23 VAL HA H 1 4.160 0.030 . 1 . . . . A 23 VAL HA . 36589 1 203 . 1 . 1 23 23 VAL HB H 1 2.211 0.030 . 1 . . . . A 23 VAL HB . 36589 1 204 . 1 . 1 23 23 VAL HG11 H 1 1.031 0.030 . 2 . . . . A 23 VAL HG11 . 36589 1 205 . 1 . 1 23 23 VAL HG12 H 1 1.031 0.030 . 2 . . . . A 23 VAL HG12 . 36589 1 206 . 1 . 1 23 23 VAL HG13 H 1 1.031 0.030 . 2 . . . . A 23 VAL HG13 . 36589 1 207 . 1 . 1 23 23 VAL HG21 H 1 1.057 0.030 . 2 . . . . A 23 VAL HG21 . 36589 1 208 . 1 . 1 23 23 VAL HG22 H 1 1.057 0.030 . 2 . . . . A 23 VAL HG22 . 36589 1 209 . 1 . 1 23 23 VAL HG23 H 1 1.057 0.030 . 2 . . . . A 23 VAL HG23 . 36589 1 210 . 1 . 1 23 23 VAL C C 13 175.314 0.300 . 1 . . . . A 23 VAL C . 36589 1 211 . 1 . 1 23 23 VAL CA C 13 63.403 0.300 . 1 . . . . A 23 VAL CA . 36589 1 212 . 1 . 1 23 23 VAL CB C 13 34.105 0.300 . 1 . . . . A 23 VAL CB . 36589 1 213 . 1 . 1 23 23 VAL CG1 C 13 22.288 0.300 . 2 . . . . A 23 VAL CG1 . 36589 1 214 . 1 . 1 23 23 VAL CG2 C 13 21.065 0.300 . 2 . . . . A 23 VAL CG2 . 36589 1 215 . 1 . 1 23 23 VAL N N 15 116.872 0.300 . 1 . . . . A 23 VAL N . 36589 1 216 . 1 . 1 24 24 ILE H H 1 7.766 0.030 . 1 . . . . A 24 ILE H . 36589 1 217 . 1 . 1 24 24 ILE HA H 1 4.877 0.030 . 1 . . . . A 24 ILE HA . 36589 1 218 . 1 . 1 24 24 ILE HB H 1 2.358 0.030 . 1 . . . . A 24 ILE HB . 36589 1 219 . 1 . 1 24 24 ILE HG12 H 1 1.123 0.030 . 2 . . . . A 24 ILE HG12 . 36589 1 220 . 1 . 1 24 24 ILE HG13 H 1 1.348 0.030 . 2 . . . . A 24 ILE HG13 . 36589 1 221 . 1 . 1 24 24 ILE HG21 H 1 0.942 0.030 . 1 . . . . A 24 ILE HG21 . 36589 1 222 . 1 . 1 24 24 ILE HG22 H 1 0.942 0.030 . 1 . . . . A 24 ILE HG22 . 36589 1 223 . 1 . 1 24 24 ILE HG23 H 1 0.942 0.030 . 1 . . . . A 24 ILE HG23 . 36589 1 224 . 1 . 1 24 24 ILE HD11 H 1 0.938 0.030 . 1 . . . . A 24 ILE HD11 . 36589 1 225 . 1 . 1 24 24 ILE HD12 H 1 0.938 0.030 . 1 . . . . A 24 ILE HD12 . 36589 1 226 . 1 . 1 24 24 ILE HD13 H 1 0.938 0.030 . 1 . . . . A 24 ILE HD13 . 36589 1 227 . 1 . 1 24 24 ILE C C 13 174.946 0.300 . 1 . . . . A 24 ILE C . 36589 1 228 . 1 . 1 24 24 ILE CA C 13 59.585 0.300 . 1 . . . . A 24 ILE CA . 36589 1 229 . 1 . 1 24 24 ILE CB C 13 41.681 0.300 . 1 . . . . A 24 ILE CB . 36589 1 230 . 1 . 1 24 24 ILE CG1 C 13 24.908 0.300 . 1 . . . . A 24 ILE CG1 . 36589 1 231 . 1 . 1 24 24 ILE CG2 C 13 19.515 0.300 . 1 . . . . A 24 ILE CG2 . 36589 1 232 . 1 . 1 24 24 ILE CD1 C 13 14.220 0.300 . 1 . . . . A 24 ILE CD1 . 36589 1 233 . 1 . 1 24 24 ILE N N 15 110.675 0.300 . 1 . . . . A 24 ILE N . 36589 1 234 . 1 . 1 25 25 ARG H H 1 9.342 0.030 . 1 . . . . A 25 ARG H . 36589 1 235 . 1 . 1 25 25 ARG HA H 1 4.493 0.030 . 1 . . . . A 25 ARG HA . 36589 1 236 . 1 . 1 25 25 ARG HB2 H 1 2.014 0.030 . 2 . . . . A 25 ARG HB2 . 36589 1 237 . 1 . 1 25 25 ARG HB3 H 1 1.729 0.030 . 2 . . . . A 25 ARG HB3 . 36589 1 238 . 1 . 1 25 25 ARG HG2 H 1 1.664 0.030 . 1 . . . . A 25 ARG HG2 . 36589 1 239 . 1 . 1 25 25 ARG HG3 H 1 1.664 0.030 . 1 . . . . A 25 ARG HG3 . 36589 1 240 . 1 . 1 25 25 ARG HD2 H 1 3.222 0.030 . 1 . . . . A 25 ARG HD2 . 36589 1 241 . 1 . 1 25 25 ARG HD3 H 1 3.222 0.030 . 1 . . . . A 25 ARG HD3 . 36589 1 242 . 1 . 1 25 25 ARG C C 13 175.457 0.300 . 1 . . . . A 25 ARG C . 36589 1 243 . 1 . 1 25 25 ARG CA C 13 55.158 0.300 . 1 . . . . A 25 ARG CA . 36589 1 244 . 1 . 1 25 25 ARG CB C 13 31.325 0.300 . 1 . . . . A 25 ARG CB . 36589 1 245 . 1 . 1 25 25 ARG CG C 13 27.084 0.300 . 1 . . . . A 25 ARG CG . 36589 1 246 . 1 . 1 25 25 ARG CD C 13 43.067 0.300 . 1 . . . . A 25 ARG CD . 36589 1 247 . 1 . 1 25 25 ARG N N 15 118.749 0.300 . 1 . . . . A 25 ARG N . 36589 1 248 . 1 . 1 26 26 ARG H H 1 7.801 0.030 . 1 . . . . A 26 ARG H . 36589 1 249 . 1 . 1 26 26 ARG HA H 1 4.197 0.030 . 1 . . . . A 26 ARG HA . 36589 1 250 . 1 . 1 26 26 ARG HB2 H 1 1.685 0.030 . 2 . . . . A 26 ARG HB2 . 36589 1 251 . 1 . 1 26 26 ARG HB3 H 1 1.815 0.030 . 2 . . . . A 26 ARG HB3 . 36589 1 252 . 1 . 1 26 26 ARG HG2 H 1 1.494 0.030 . 2 . . . . A 26 ARG HG2 . 36589 1 253 . 1 . 1 26 26 ARG HG3 H 1 1.352 0.030 . 2 . . . . A 26 ARG HG3 . 36589 1 254 . 1 . 1 26 26 ARG HD2 H 1 3.107 0.030 . 1 . . . . A 26 ARG HD2 . 36589 1 255 . 1 . 1 26 26 ARG HD3 H 1 3.107 0.030 . 1 . . . . A 26 ARG HD3 . 36589 1 256 . 1 . 1 26 26 ARG C C 13 171.805 0.300 . 1 . . . . A 26 ARG C . 36589 1 257 . 1 . 1 26 26 ARG CA C 13 53.520 0.300 . 1 . . . . A 26 ARG CA . 36589 1 258 . 1 . 1 26 26 ARG CB C 13 30.292 0.300 . 1 . . . . A 26 ARG CB . 36589 1 259 . 1 . 1 26 26 ARG CG C 13 24.898 0.300 . 1 . . . . A 26 ARG CG . 36589 1 260 . 1 . 1 26 26 ARG CD C 13 43.279 0.300 . 1 . . . . A 26 ARG CD . 36589 1 261 . 1 . 1 26 26 ARG N N 15 118.447 0.300 . 1 . . . . A 26 ARG N . 36589 1 262 . 1 . 1 27 27 PRO HA H 1 4.754 0.030 . 1 . . . . A 27 PRO HA . 36589 1 263 . 1 . 1 27 27 PRO HB2 H 1 2.587 0.030 . 2 . . . . A 27 PRO HB2 . 36589 1 264 . 1 . 1 27 27 PRO HB3 H 1 2.401 0.030 . 2 . . . . A 27 PRO HB3 . 36589 1 265 . 1 . 1 27 27 PRO HG2 H 1 1.703 0.030 . 2 . . . . A 27 PRO HG2 . 36589 1 266 . 1 . 1 27 27 PRO HG3 H 1 1.409 0.030 . 2 . . . . A 27 PRO HG3 . 36589 1 267 . 1 . 1 27 27 PRO HD2 H 1 3.457 0.030 . 2 . . . . A 27 PRO HD2 . 36589 1 268 . 1 . 1 27 27 PRO HD3 H 1 3.041 0.030 . 2 . . . . A 27 PRO HD3 . 36589 1 269 . 1 . 1 27 27 PRO CA C 13 61.459 0.300 . 1 . . . . A 27 PRO CA . 36589 1 270 . 1 . 1 27 27 PRO CB C 13 33.320 0.300 . 1 . . . . A 27 PRO CB . 36589 1 271 . 1 . 1 27 27 PRO CG C 13 25.457 0.300 . 1 . . . . A 27 PRO CG . 36589 1 272 . 1 . 1 27 27 PRO CD C 13 49.581 0.300 . 1 . . . . A 27 PRO CD . 36589 1 273 . 1 . 1 28 28 PRO HA H 1 4.363 0.030 . 1 . . . . A 28 PRO HA . 36589 1 274 . 1 . 1 28 28 PRO HB2 H 1 1.887 0.030 . 2 . . . . A 28 PRO HB2 . 36589 1 275 . 1 . 1 28 28 PRO HB3 H 1 2.323 0.030 . 2 . . . . A 28 PRO HB3 . 36589 1 276 . 1 . 1 28 28 PRO HG2 H 1 2.170 0.030 . 2 . . . . A 28 PRO HG2 . 36589 1 277 . 1 . 1 28 28 PRO HG3 H 1 2.031 0.030 . 2 . . . . A 28 PRO HG3 . 36589 1 278 . 1 . 1 28 28 PRO HD2 H 1 3.766 0.030 . 2 . . . . A 28 PRO HD2 . 36589 1 279 . 1 . 1 28 28 PRO HD3 H 1 3.888 0.030 . 2 . . . . A 28 PRO HD3 . 36589 1 280 . 1 . 1 28 28 PRO C C 13 177.322 0.300 . 1 . . . . A 28 PRO C . 36589 1 281 . 1 . 1 28 28 PRO CA C 13 63.376 0.300 . 1 . . . . A 28 PRO CA . 36589 1 282 . 1 . 1 28 28 PRO CB C 13 32.211 0.300 . 1 . . . . A 28 PRO CB . 36589 1 283 . 1 . 1 28 28 PRO CG C 13 28.133 0.300 . 1 . . . . A 28 PRO CG . 36589 1 284 . 1 . 1 28 28 PRO CD C 13 50.667 0.300 . 1 . . . . A 28 PRO CD . 36589 1 285 . 1 . 1 29 29 LEU H H 1 8.897 0.030 . 1 . . . . A 29 LEU H . 36589 1 286 . 1 . 1 29 29 LEU HA H 1 4.617 0.030 . 1 . . . . A 29 LEU HA . 36589 1 287 . 1 . 1 29 29 LEU HB2 H 1 2.090 0.030 . 2 . . . . A 29 LEU HB2 . 36589 1 288 . 1 . 1 29 29 LEU HB3 H 1 1.157 0.030 . 2 . . . . A 29 LEU HB3 . 36589 1 289 . 1 . 1 29 29 LEU HG H 1 1.905 0.030 . 1 . . . . A 29 LEU HG . 36589 1 290 . 1 . 1 29 29 LEU HD11 H 1 0.870 0.030 . 2 . . . . A 29 LEU HD11 . 36589 1 291 . 1 . 1 29 29 LEU HD12 H 1 0.870 0.030 . 2 . . . . A 29 LEU HD12 . 36589 1 292 . 1 . 1 29 29 LEU HD13 H 1 0.870 0.030 . 2 . . . . A 29 LEU HD13 . 36589 1 293 . 1 . 1 29 29 LEU HD21 H 1 0.742 0.030 . 2 . . . . A 29 LEU HD21 . 36589 1 294 . 1 . 1 29 29 LEU HD22 H 1 0.742 0.030 . 2 . . . . A 29 LEU HD22 . 36589 1 295 . 1 . 1 29 29 LEU HD23 H 1 0.742 0.030 . 2 . . . . A 29 LEU HD23 . 36589 1 296 . 1 . 1 29 29 LEU C C 13 175.620 0.300 . 1 . . . . A 29 LEU C . 36589 1 297 . 1 . 1 29 29 LEU CA C 13 53.027 0.300 . 1 . . . . A 29 LEU CA . 36589 1 298 . 1 . 1 29 29 LEU CB C 13 41.095 0.300 . 1 . . . . A 29 LEU CB . 36589 1 299 . 1 . 1 29 29 LEU CG C 13 25.932 0.300 . 1 . . . . A 29 LEU CG . 36589 1 300 . 1 . 1 29 29 LEU CD1 C 13 27.749 0.300 . 2 . . . . A 29 LEU CD1 . 36589 1 301 . 1 . 1 29 29 LEU CD2 C 13 23.173 0.300 . 2 . . . . A 29 LEU CD2 . 36589 1 302 . 1 . 1 29 29 LEU N N 15 127.628 0.300 . 1 . . . . A 29 LEU N . 36589 1 303 . 1 . 1 30 30 THR H H 1 6.830 0.030 . 1 . . . . A 30 THR H . 36589 1 304 . 1 . 1 30 30 THR HA H 1 4.669 0.030 . 1 . . . . A 30 THR HA . 36589 1 305 . 1 . 1 30 30 THR HB H 1 4.555 0.030 . 1 . . . . A 30 THR HB . 36589 1 306 . 1 . 1 30 30 THR HG21 H 1 1.186 0.030 . 1 . . . . A 30 THR HG21 . 36589 1 307 . 1 . 1 30 30 THR HG22 H 1 1.186 0.030 . 1 . . . . A 30 THR HG22 . 36589 1 308 . 1 . 1 30 30 THR HG23 H 1 1.186 0.030 . 1 . . . . A 30 THR HG23 . 36589 1 309 . 1 . 1 30 30 THR C C 13 174.047 0.300 . 1 . . . . A 30 THR C . 36589 1 310 . 1 . 1 30 30 THR CA C 13 58.770 0.300 . 1 . . . . A 30 THR CA . 36589 1 311 . 1 . 1 30 30 THR CB C 13 71.096 0.300 . 1 . . . . A 30 THR CB . 36589 1 312 . 1 . 1 30 30 THR CG2 C 13 22.063 0.300 . 1 . . . . A 30 THR CG2 . 36589 1 313 . 1 . 1 30 30 THR N N 15 110.815 0.300 . 1 . . . . A 30 THR N . 36589 1 314 . 1 . 1 31 31 GLU H H 1 9.138 0.030 . 1 . . . . A 31 GLU H . 36589 1 315 . 1 . 1 31 31 GLU HA H 1 3.836 0.030 . 1 . . . . A 31 GLU HA . 36589 1 316 . 1 . 1 31 31 GLU HB2 H 1 2.112 0.030 . 2 . . . . A 31 GLU HB2 . 36589 1 317 . 1 . 1 31 31 GLU HB3 H 1 2.088 0.030 . 2 . . . . A 31 GLU HB3 . 36589 1 318 . 1 . 1 31 31 GLU HG2 H 1 2.215 0.030 . 1 . . . . A 31 GLU HG2 . 36589 1 319 . 1 . 1 31 31 GLU HG3 H 1 2.215 0.030 . 1 . . . . A 31 GLU HG3 . 36589 1 320 . 1 . 1 31 31 GLU C C 13 178.586 0.300 . 1 . . . . A 31 GLU C . 36589 1 321 . 1 . 1 31 31 GLU CA C 13 60.225 0.300 . 1 . . . . A 31 GLU CA . 36589 1 322 . 1 . 1 31 31 GLU CB C 13 29.273 0.300 . 1 . . . . A 31 GLU CB . 36589 1 323 . 1 . 1 31 31 GLU CG C 13 36.296 0.300 . 1 . . . . A 31 GLU CG . 36589 1 324 . 1 . 1 31 31 GLU N N 15 122.334 0.300 . 1 . . . . A 31 GLU N . 36589 1 325 . 1 . 1 32 32 LYS H H 1 8.501 0.030 . 1 . . . . A 32 LYS H . 36589 1 326 . 1 . 1 32 32 LYS HA H 1 3.957 0.030 . 1 . . . . A 32 LYS HA . 36589 1 327 . 1 . 1 32 32 LYS HB2 H 1 1.668 0.030 . 2 . . . . A 32 LYS HB2 . 36589 1 328 . 1 . 1 32 32 LYS HB3 H 1 1.865 0.030 . 2 . . . . A 32 LYS HB3 . 36589 1 329 . 1 . 1 32 32 LYS HG2 H 1 1.315 0.030 . 2 . . . . A 32 LYS HG2 . 36589 1 330 . 1 . 1 32 32 LYS HG3 H 1 1.443 0.030 . 2 . . . . A 32 LYS HG3 . 36589 1 331 . 1 . 1 32 32 LYS HD2 H 1 1.785 0.030 . 1 . . . . A 32 LYS HD2 . 36589 1 332 . 1 . 1 32 32 LYS HD3 H 1 1.785 0.030 . 1 . . . . A 32 LYS HD3 . 36589 1 333 . 1 . 1 32 32 LYS HE2 H 1 2.992 0.030 . 1 . . . . A 32 LYS HE2 . 36589 1 334 . 1 . 1 32 32 LYS HE3 H 1 2.992 0.030 . 1 . . . . A 32 LYS HE3 . 36589 1 335 . 1 . 1 32 32 LYS C C 13 179.052 0.300 . 1 . . . . A 32 LYS C . 36589 1 336 . 1 . 1 32 32 LYS CA C 13 59.516 0.300 . 1 . . . . A 32 LYS CA . 36589 1 337 . 1 . 1 32 32 LYS CB C 13 32.631 0.300 . 1 . . . . A 32 LYS CB . 36589 1 338 . 1 . 1 32 32 LYS CG C 13 25.106 0.300 . 1 . . . . A 32 LYS CG . 36589 1 339 . 1 . 1 32 32 LYS CD C 13 29.609 0.300 . 1 . . . . A 32 LYS CD . 36589 1 340 . 1 . 1 32 32 LYS CE C 13 42.206 0.300 . 1 . . . . A 32 LYS CE . 36589 1 341 . 1 . 1 32 32 LYS N N 15 119.361 0.300 . 1 . . . . A 32 LYS N . 36589 1 342 . 1 . 1 33 33 LEU H H 1 7.061 0.030 . 1 . . . . A 33 LEU H . 36589 1 343 . 1 . 1 33 33 LEU HA H 1 3.957 0.030 . 1 . . . . A 33 LEU HA . 36589 1 344 . 1 . 1 33 33 LEU HB2 H 1 0.400 0.030 . 2 . . . . A 33 LEU HB2 . 36589 1 345 . 1 . 1 33 33 LEU HB3 H 1 1.437 0.030 . 2 . . . . A 33 LEU HB3 . 36589 1 346 . 1 . 1 33 33 LEU HG H 1 1.207 0.030 . 1 . . . . A 33 LEU HG . 36589 1 347 . 1 . 1 33 33 LEU HD11 H 1 0.593 0.030 . 2 . . . . A 33 LEU HD11 . 36589 1 348 . 1 . 1 33 33 LEU HD12 H 1 0.593 0.030 . 2 . . . . A 33 LEU HD12 . 36589 1 349 . 1 . 1 33 33 LEU HD13 H 1 0.593 0.030 . 2 . . . . A 33 LEU HD13 . 36589 1 350 . 1 . 1 33 33 LEU HD21 H 1 0.440 0.030 . 2 . . . . A 33 LEU HD21 . 36589 1 351 . 1 . 1 33 33 LEU HD22 H 1 0.440 0.030 . 2 . . . . A 33 LEU HD22 . 36589 1 352 . 1 . 1 33 33 LEU HD23 H 1 0.440 0.030 . 2 . . . . A 33 LEU HD23 . 36589 1 353 . 1 . 1 33 33 LEU C C 13 178.685 0.300 . 1 . . . . A 33 LEU C . 36589 1 354 . 1 . 1 33 33 LEU CA C 13 57.034 0.300 . 1 . . . . A 33 LEU CA . 36589 1 355 . 1 . 1 33 33 LEU CB C 13 40.923 0.300 . 1 . . . . A 33 LEU CB . 36589 1 356 . 1 . 1 33 33 LEU CG C 13 27.073 0.300 . 1 . . . . A 33 LEU CG . 36589 1 357 . 1 . 1 33 33 LEU CD1 C 13 25.243 0.300 . 2 . . . . A 33 LEU CD1 . 36589 1 358 . 1 . 1 33 33 LEU CD2 C 13 22.496 0.300 . 2 . . . . A 33 LEU CD2 . 36589 1 359 . 1 . 1 33 33 LEU N N 15 118.530 0.300 . 1 . . . . A 33 LEU N . 36589 1 360 . 1 . 1 34 34 LEU H H 1 8.347 0.030 . 1 . . . . A 34 LEU H . 36589 1 361 . 1 . 1 34 34 LEU HA H 1 4.086 0.030 . 1 . . . . A 34 LEU HA . 36589 1 362 . 1 . 1 34 34 LEU HB2 H 1 1.844 0.030 . 2 . . . . A 34 LEU HB2 . 36589 1 363 . 1 . 1 34 34 LEU HB3 H 1 1.746 0.030 . 2 . . . . A 34 LEU HB3 . 36589 1 364 . 1 . 1 34 34 LEU HG H 1 2.158 0.030 . 1 . . . . A 34 LEU HG . 36589 1 365 . 1 . 1 34 34 LEU HD11 H 1 0.833 0.030 . 2 . . . . A 34 LEU HD11 . 36589 1 366 . 1 . 1 34 34 LEU HD12 H 1 0.833 0.030 . 2 . . . . A 34 LEU HD12 . 36589 1 367 . 1 . 1 34 34 LEU HD13 H 1 0.833 0.030 . 2 . . . . A 34 LEU HD13 . 36589 1 368 . 1 . 1 34 34 LEU HD21 H 1 0.990 0.030 . 2 . . . . A 34 LEU HD21 . 36589 1 369 . 1 . 1 34 34 LEU HD22 H 1 0.990 0.030 . 2 . . . . A 34 LEU HD22 . 36589 1 370 . 1 . 1 34 34 LEU HD23 H 1 0.990 0.030 . 2 . . . . A 34 LEU HD23 . 36589 1 371 . 1 . 1 34 34 LEU C C 13 178.042 0.300 . 1 . . . . A 34 LEU C . 36589 1 372 . 1 . 1 34 34 LEU CA C 13 57.141 0.300 . 1 . . . . A 34 LEU CA . 36589 1 373 . 1 . 1 34 34 LEU CB C 13 41.493 0.300 . 1 . . . . A 34 LEU CB . 36589 1 374 . 1 . 1 34 34 LEU CG C 13 27.214 0.300 . 1 . . . . A 34 LEU CG . 36589 1 375 . 1 . 1 34 34 LEU CD1 C 13 26.736 0.300 . 2 . . . . A 34 LEU CD1 . 36589 1 376 . 1 . 1 34 34 LEU CD2 C 13 22.768 0.300 . 2 . . . . A 34 LEU CD2 . 36589 1 377 . 1 . 1 34 34 LEU N N 15 115.824 0.300 . 1 . . . . A 34 LEU N . 36589 1 378 . 1 . 1 35 35 SER H H 1 7.607 0.030 . 1 . . . . A 35 SER H . 36589 1 379 . 1 . 1 35 35 SER HA H 1 4.258 0.030 . 1 . . . . A 35 SER HA . 36589 1 380 . 1 . 1 35 35 SER HB2 H 1 3.901 0.030 . 1 . . . . A 35 SER HB2 . 36589 1 381 . 1 . 1 35 35 SER HB3 H 1 3.901 0.030 . 1 . . . . A 35 SER HB3 . 36589 1 382 . 1 . 1 35 35 SER C C 13 173.739 0.300 . 1 . . . . A 35 SER C . 36589 1 383 . 1 . 1 35 35 SER CA C 13 61.049 0.300 . 1 . . . . A 35 SER CA . 36589 1 384 . 1 . 1 35 35 SER CB C 13 63.529 0.300 . 1 . . . . A 35 SER CB . 36589 1 385 . 1 . 1 35 35 SER N N 15 110.834 0.300 . 1 . . . . A 35 SER N . 36589 1 386 . 1 . 1 36 36 LYS H H 1 6.763 0.030 . 1 . . . . A 36 LYS H . 36589 1 387 . 1 . 1 36 36 LYS HA H 1 4.252 0.030 . 1 . . . . A 36 LYS HA . 36589 1 388 . 1 . 1 36 36 LYS HB2 H 1 1.766 0.030 . 2 . . . . A 36 LYS HB2 . 36589 1 389 . 1 . 1 36 36 LYS HB3 H 1 1.874 0.030 . 2 . . . . A 36 LYS HB3 . 36589 1 390 . 1 . 1 36 36 LYS HG2 H 1 1.315 0.030 . 2 . . . . A 36 LYS HG2 . 36589 1 391 . 1 . 1 36 36 LYS HG3 H 1 1.448 0.030 . 2 . . . . A 36 LYS HG3 . 36589 1 392 . 1 . 1 36 36 LYS HD2 H 1 1.784 0.030 . 1 . . . . A 36 LYS HD2 . 36589 1 393 . 1 . 1 36 36 LYS HD3 H 1 1.784 0.030 . 1 . . . . A 36 LYS HD3 . 36589 1 394 . 1 . 1 36 36 LYS HE2 H 1 3.097 0.030 . 1 . . . . A 36 LYS HE2 . 36589 1 395 . 1 . 1 36 36 LYS HE3 H 1 3.097 0.030 . 1 . . . . A 36 LYS HE3 . 36589 1 396 . 1 . 1 36 36 LYS C C 13 172.483 0.300 . 1 . . . . A 36 LYS C . 36589 1 397 . 1 . 1 36 36 LYS CA C 13 55.720 0.300 . 1 . . . . A 36 LYS CA . 36589 1 398 . 1 . 1 36 36 LYS CB C 13 32.226 0.300 . 1 . . . . A 36 LYS CB . 36589 1 399 . 1 . 1 36 36 LYS CG C 13 25.168 0.300 . 1 . . . . A 36 LYS CG . 36589 1 400 . 1 . 1 36 36 LYS CD C 13 29.617 0.300 . 1 . . . . A 36 LYS CD . 36589 1 401 . 1 . 1 36 36 LYS CE C 13 42.297 0.300 . 1 . . . . A 36 LYS CE . 36589 1 402 . 1 . 1 36 36 LYS N N 15 116.242 0.300 . 1 . . . . A 36 LYS N . 36589 1 403 . 1 . 1 37 37 PRO HA H 1 5.145 0.030 . 1 . . . . A 37 PRO HA . 36589 1 404 . 1 . 1 37 37 PRO HB2 H 1 2.049 0.030 . 2 . . . . A 37 PRO HB2 . 36589 1 405 . 1 . 1 37 37 PRO HB3 H 1 2.243 0.030 . 2 . . . . A 37 PRO HB3 . 36589 1 406 . 1 . 1 37 37 PRO HG2 H 1 2.209 0.030 . 2 . . . . A 37 PRO HG2 . 36589 1 407 . 1 . 1 37 37 PRO HG3 H 1 2.119 0.030 . 2 . . . . A 37 PRO HG3 . 36589 1 408 . 1 . 1 37 37 PRO HD2 H 1 3.594 0.030 . 2 . . . . A 37 PRO HD2 . 36589 1 409 . 1 . 1 37 37 PRO HD3 H 1 3.700 0.030 . 2 . . . . A 37 PRO HD3 . 36589 1 410 . 1 . 1 37 37 PRO CA C 13 61.895 0.300 . 1 . . . . A 37 PRO CA . 36589 1 411 . 1 . 1 37 37 PRO CB C 13 32.527 0.300 . 1 . . . . A 37 PRO CB . 36589 1 412 . 1 . 1 37 37 PRO CG C 13 27.761 0.300 . 1 . . . . A 37 PRO CG . 36589 1 413 . 1 . 1 37 37 PRO CD C 13 49.157 0.300 . 1 . . . . A 37 PRO CD . 36589 1 414 . 1 . 1 38 38 PRO HA H 1 4.864 0.030 . 1 . . . . A 38 PRO HA . 36589 1 415 . 1 . 1 38 38 PRO HB2 H 1 2.646 0.030 . 2 . . . . A 38 PRO HB2 . 36589 1 416 . 1 . 1 38 38 PRO HB3 H 1 2.082 0.030 . 2 . . . . A 38 PRO HB3 . 36589 1 417 . 1 . 1 38 38 PRO HG2 H 1 2.153 0.030 . 2 . . . . A 38 PRO HG2 . 36589 1 418 . 1 . 1 38 38 PRO HG3 H 1 2.078 0.030 . 2 . . . . A 38 PRO HG3 . 36589 1 419 . 1 . 1 38 38 PRO HD2 H 1 4.454 0.030 . 2 . . . . A 38 PRO HD2 . 36589 1 420 . 1 . 1 38 38 PRO HD3 H 1 3.479 0.030 . 2 . . . . A 38 PRO HD3 . 36589 1 421 . 1 . 1 38 38 PRO CA C 13 61.894 0.300 . 1 . . . . A 38 PRO CA . 36589 1 422 . 1 . 1 38 38 PRO CB C 13 32.884 0.300 . 1 . . . . A 38 PRO CB . 36589 1 423 . 1 . 1 38 38 PRO CG C 13 27.493 0.300 . 1 . . . . A 38 PRO CG . 36589 1 424 . 1 . 1 38 38 PRO CD C 13 51.238 0.300 . 1 . . . . A 38 PRO CD . 36589 1 425 . 1 . 1 39 39 PHE HA H 1 3.913 0.030 . 1 . . . . A 39 PHE HA . 36589 1 426 . 1 . 1 39 39 PHE HB2 H 1 3.133 0.030 . 2 . . . . A 39 PHE HB2 . 36589 1 427 . 1 . 1 39 39 PHE HB3 H 1 3.351 0.030 . 2 . . . . A 39 PHE HB3 . 36589 1 428 . 1 . 1 39 39 PHE HD1 H 1 7.112 0.030 . 1 . . . . A 39 PHE HD1 . 36589 1 429 . 1 . 1 39 39 PHE HD2 H 1 7.112 0.030 . 1 . . . . A 39 PHE HD2 . 36589 1 430 . 1 . 1 39 39 PHE HE1 H 1 7.224 0.030 . 1 . . . . A 39 PHE HE1 . 36589 1 431 . 1 . 1 39 39 PHE HE2 H 1 7.224 0.030 . 1 . . . . A 39 PHE HE2 . 36589 1 432 . 1 . 1 39 39 PHE HZ H 1 6.702 0.030 . 1 . . . . A 39 PHE HZ . 36589 1 433 . 1 . 1 39 39 PHE C C 13 176.682 0.300 . 1 . . . . A 39 PHE C . 36589 1 434 . 1 . 1 39 39 PHE CA C 13 64.012 0.300 . 1 . . . . A 39 PHE CA . 36589 1 435 . 1 . 1 39 39 PHE CB C 13 39.050 0.300 . 1 . . . . A 39 PHE CB . 36589 1 436 . 1 . 1 39 39 PHE CD1 C 13 131.568 0.300 . 1 . . . . A 39 PHE CD1 . 36589 1 437 . 1 . 1 39 39 PHE CD2 C 13 131.568 0.300 . 1 . . . . A 39 PHE CD2 . 36589 1 438 . 1 . 1 39 39 PHE CE1 C 13 131.486 0.300 . 1 . . . . A 39 PHE CE1 . 36589 1 439 . 1 . 1 39 39 PHE CE2 C 13 131.486 0.300 . 1 . . . . A 39 PHE CE2 . 36589 1 440 . 1 . 1 39 39 PHE CZ C 13 129.365 0.300 . 1 . . . . A 39 PHE CZ . 36589 1 441 . 1 . 1 39 39 PHE N N 15 120.000 0.300 . 1 . . . . A 39 PHE N . 36589 1 442 . 1 . 1 40 40 ARG H H 1 9.228 0.030 . 1 . . . . A 40 ARG H . 36589 1 443 . 1 . 1 40 40 ARG HA H 1 3.608 0.030 . 1 . . . . A 40 ARG HA . 36589 1 444 . 1 . 1 40 40 ARG HB2 H 1 1.980 0.030 . 2 . . . . A 40 ARG HB2 . 36589 1 445 . 1 . 1 40 40 ARG HB3 H 1 1.841 0.030 . 2 . . . . A 40 ARG HB3 . 36589 1 446 . 1 . 1 40 40 ARG HG2 H 1 1.743 0.030 . 2 . . . . A 40 ARG HG2 . 36589 1 447 . 1 . 1 40 40 ARG HG3 H 1 1.703 0.030 . 2 . . . . A 40 ARG HG3 . 36589 1 448 . 1 . 1 40 40 ARG HD2 H 1 3.227 0.030 . 1 . . . . A 40 ARG HD2 . 36589 1 449 . 1 . 1 40 40 ARG HD3 H 1 3.227 0.030 . 1 . . . . A 40 ARG HD3 . 36589 1 450 . 1 . 1 40 40 ARG C C 13 176.544 0.300 . 1 . . . . A 40 ARG C . 36589 1 451 . 1 . 1 40 40 ARG CA C 13 59.809 0.300 . 1 . . . . A 40 ARG CA . 36589 1 452 . 1 . 1 40 40 ARG CB C 13 29.593 0.300 . 1 . . . . A 40 ARG CB . 36589 1 453 . 1 . 1 40 40 ARG CG C 13 27.662 0.300 . 1 . . . . A 40 ARG CG . 36589 1 454 . 1 . 1 40 40 ARG CD C 13 43.189 0.300 . 1 . . . . A 40 ARG CD . 36589 1 455 . 1 . 1 40 40 ARG N N 15 117.424 0.300 . 1 . . . . A 40 ARG N . 36589 1 456 . 1 . 1 41 41 TYR H H 1 6.596 0.030 . 1 . . . . A 41 TYR H . 36589 1 457 . 1 . 1 41 41 TYR HA H 1 4.551 0.030 . 1 . . . . A 41 TYR HA . 36589 1 458 . 1 . 1 41 41 TYR HB2 H 1 3.228 0.030 . 2 . . . . A 41 TYR HB2 . 36589 1 459 . 1 . 1 41 41 TYR HB3 H 1 3.123 0.030 . 2 . . . . A 41 TYR HB3 . 36589 1 460 . 1 . 1 41 41 TYR HD1 H 1 7.035 0.030 . 1 . . . . A 41 TYR HD1 . 36589 1 461 . 1 . 1 41 41 TYR HD2 H 1 7.035 0.030 . 1 . . . . A 41 TYR HD2 . 36589 1 462 . 1 . 1 41 41 TYR HE1 H 1 6.623 0.030 . 1 . . . . A 41 TYR HE1 . 36589 1 463 . 1 . 1 41 41 TYR HE2 H 1 6.623 0.030 . 1 . . . . A 41 TYR HE2 . 36589 1 464 . 1 . 1 41 41 TYR C C 13 176.399 0.300 . 1 . . . . A 41 TYR C . 36589 1 465 . 1 . 1 41 41 TYR CA C 13 59.782 0.300 . 1 . . . . A 41 TYR CA . 36589 1 466 . 1 . 1 41 41 TYR CB C 13 39.690 0.300 . 1 . . . . A 41 TYR CB . 36589 1 467 . 1 . 1 41 41 TYR CD1 C 13 132.060 0.300 . 1 . . . . A 41 TYR CD1 . 36589 1 468 . 1 . 1 41 41 TYR CD2 C 13 132.060 0.300 . 1 . . . . A 41 TYR CD2 . 36589 1 469 . 1 . 1 41 41 TYR CE1 C 13 118.565 0.300 . 1 . . . . A 41 TYR CE1 . 36589 1 470 . 1 . 1 41 41 TYR CE2 C 13 118.565 0.300 . 1 . . . . A 41 TYR CE2 . 36589 1 471 . 1 . 1 41 41 TYR N N 15 117.951 0.300 . 1 . . . . A 41 TYR N . 36589 1 472 . 1 . 1 42 42 LEU H H 1 7.382 0.030 . 1 . . . . A 42 LEU H . 36589 1 473 . 1 . 1 42 42 LEU HA H 1 3.673 0.030 . 1 . . . . A 42 LEU HA . 36589 1 474 . 1 . 1 42 42 LEU HB2 H 1 1.005 0.030 . 2 . . . . A 42 LEU HB2 . 36589 1 475 . 1 . 1 42 42 LEU HB3 H 1 1.839 0.030 . 2 . . . . A 42 LEU HB3 . 36589 1 476 . 1 . 1 42 42 LEU HG H 1 1.786 0.030 . 1 . . . . A 42 LEU HG . 36589 1 477 . 1 . 1 42 42 LEU HD11 H 1 0.825 0.030 . 2 . . . . A 42 LEU HD11 . 36589 1 478 . 1 . 1 42 42 LEU HD12 H 1 0.825 0.030 . 2 . . . . A 42 LEU HD12 . 36589 1 479 . 1 . 1 42 42 LEU HD13 H 1 0.825 0.030 . 2 . . . . A 42 LEU HD13 . 36589 1 480 . 1 . 1 42 42 LEU HD21 H 1 0.711 0.030 . 2 . . . . A 42 LEU HD21 . 36589 1 481 . 1 . 1 42 42 LEU HD22 H 1 0.711 0.030 . 2 . . . . A 42 LEU HD22 . 36589 1 482 . 1 . 1 42 42 LEU HD23 H 1 0.711 0.030 . 2 . . . . A 42 LEU HD23 . 36589 1 483 . 1 . 1 42 42 LEU C C 13 177.924 0.300 . 1 . . . . A 42 LEU C . 36589 1 484 . 1 . 1 42 42 LEU CA C 13 57.491 0.300 . 1 . . . . A 42 LEU CA . 36589 1 485 . 1 . 1 42 42 LEU CB C 13 41.671 0.300 . 1 . . . . A 42 LEU CB . 36589 1 486 . 1 . 1 42 42 LEU CG C 13 26.216 0.300 . 1 . . . . A 42 LEU CG . 36589 1 487 . 1 . 1 42 42 LEU CD1 C 13 26.916 0.300 . 2 . . . . A 42 LEU CD1 . 36589 1 488 . 1 . 1 42 42 LEU CD2 C 13 23.289 0.300 . 2 . . . . A 42 LEU CD2 . 36589 1 489 . 1 . 1 42 42 LEU N N 15 117.099 0.300 . 1 . . . . A 42 LEU N . 36589 1 490 . 1 . 1 43 43 HIS H H 1 8.457 0.030 . 1 . . . . A 43 HIS H . 36589 1 491 . 1 . 1 43 43 HIS HA H 1 3.434 0.030 . 1 . . . . A 43 HIS HA . 36589 1 492 . 1 . 1 43 43 HIS HB2 H 1 1.880 0.030 . 2 . . . . A 43 HIS HB2 . 36589 1 493 . 1 . 1 43 43 HIS HB3 H 1 2.829 0.030 . 2 . . . . A 43 HIS HB3 . 36589 1 494 . 1 . 1 43 43 HIS HD2 H 1 5.093 0.030 . 1 . . . . A 43 HIS HD2 . 36589 1 495 . 1 . 1 43 43 HIS HE1 H 1 7.359 0.030 . 1 . . . . A 43 HIS HE1 . 36589 1 496 . 1 . 1 43 43 HIS C C 13 177.346 0.300 . 1 . . . . A 43 HIS C . 36589 1 497 . 1 . 1 43 43 HIS CA C 13 61.560 0.300 . 1 . . . . A 43 HIS CA . 36589 1 498 . 1 . 1 43 43 HIS CB C 13 30.758 0.300 . 1 . . . . A 43 HIS CB . 36589 1 499 . 1 . 1 43 43 HIS CD2 C 13 116.160 0.300 . 1 . . . . A 43 HIS CD2 . 36589 1 500 . 1 . 1 43 43 HIS CE1 C 13 138.665 0.300 . 1 . . . . A 43 HIS CE1 . 36589 1 501 . 1 . 1 43 43 HIS N N 15 119.553 0.300 . 1 . . . . A 43 HIS N . 36589 1 502 . 1 . 1 44 44 ASP H H 1 8.267 0.030 . 1 . . . . A 44 ASP H . 36589 1 503 . 1 . 1 44 44 ASP HA H 1 4.481 0.030 . 1 . . . . A 44 ASP HA . 36589 1 504 . 1 . 1 44 44 ASP HB2 H 1 2.566 0.030 . 2 . . . . A 44 ASP HB2 . 36589 1 505 . 1 . 1 44 44 ASP HB3 H 1 3.099 0.030 . 2 . . . . A 44 ASP HB3 . 36589 1 506 . 1 . 1 44 44 ASP C C 13 178.043 0.300 . 1 . . . . A 44 ASP C . 36589 1 507 . 1 . 1 44 44 ASP CA C 13 57.322 0.300 . 1 . . . . A 44 ASP CA . 36589 1 508 . 1 . 1 44 44 ASP CB C 13 40.363 0.300 . 1 . . . . A 44 ASP CB . 36589 1 509 . 1 . 1 44 44 ASP N N 15 119.813 0.300 . 1 . . . . A 44 ASP N . 36589 1 510 . 1 . 1 45 45 ILE H H 1 7.977 0.030 . 1 . . . . A 45 ILE H . 36589 1 511 . 1 . 1 45 45 ILE HA H 1 3.375 0.030 . 1 . . . . A 45 ILE HA . 36589 1 512 . 1 . 1 45 45 ILE HB H 1 1.640 0.030 . 1 . . . . A 45 ILE HB . 36589 1 513 . 1 . 1 45 45 ILE HG12 H 1 1.325 0.030 . 2 . . . . A 45 ILE HG12 . 36589 1 514 . 1 . 1 45 45 ILE HG13 H 1 0.320 0.030 . 2 . . . . A 45 ILE HG13 . 36589 1 515 . 1 . 1 45 45 ILE HG21 H 1 0.671 0.030 . 1 . . . . A 45 ILE HG21 . 36589 1 516 . 1 . 1 45 45 ILE HG22 H 1 0.671 0.030 . 1 . . . . A 45 ILE HG22 . 36589 1 517 . 1 . 1 45 45 ILE HG23 H 1 0.671 0.030 . 1 . . . . A 45 ILE HG23 . 36589 1 518 . 1 . 1 45 45 ILE HD11 H 1 0.127 0.030 . 1 . . . . A 45 ILE HD11 . 36589 1 519 . 1 . 1 45 45 ILE HD12 H 1 0.127 0.030 . 1 . . . . A 45 ILE HD12 . 36589 1 520 . 1 . 1 45 45 ILE HD13 H 1 0.127 0.030 . 1 . . . . A 45 ILE HD13 . 36589 1 521 . 1 . 1 45 45 ILE C C 13 176.869 0.300 . 1 . . . . A 45 ILE C . 36589 1 522 . 1 . 1 45 45 ILE CA C 13 66.330 0.300 . 1 . . . . A 45 ILE CA . 36589 1 523 . 1 . 1 45 45 ILE CB C 13 38.525 0.300 . 1 . . . . A 45 ILE CB . 36589 1 524 . 1 . 1 45 45 ILE CG1 C 13 29.873 0.300 . 1 . . . . A 45 ILE CG1 . 36589 1 525 . 1 . 1 45 45 ILE CG2 C 13 17.297 0.300 . 1 . . . . A 45 ILE CG2 . 36589 1 526 . 1 . 1 45 45 ILE CD1 C 13 13.623 0.300 . 1 . . . . A 45 ILE CD1 . 36589 1 527 . 1 . 1 45 45 ILE N N 15 118.954 0.300 . 1 . . . . A 45 ILE N . 36589 1 528 . 1 . 1 46 46 ILE H H 1 8.429 0.030 . 1 . . . . A 46 ILE H . 36589 1 529 . 1 . 1 46 46 ILE HA H 1 3.382 0.030 . 1 . . . . A 46 ILE HA . 36589 1 530 . 1 . 1 46 46 ILE HB H 1 1.870 0.030 . 1 . . . . A 46 ILE HB . 36589 1 531 . 1 . 1 46 46 ILE HG12 H 1 1.756 0.030 . 2 . . . . A 46 ILE HG12 . 36589 1 532 . 1 . 1 46 46 ILE HG13 H 1 0.867 0.030 . 2 . . . . A 46 ILE HG13 . 36589 1 533 . 1 . 1 46 46 ILE HG21 H 1 0.947 0.030 . 1 . . . . A 46 ILE HG21 . 36589 1 534 . 1 . 1 46 46 ILE HG22 H 1 0.947 0.030 . 1 . . . . A 46 ILE HG22 . 36589 1 535 . 1 . 1 46 46 ILE HG23 H 1 0.947 0.030 . 1 . . . . A 46 ILE HG23 . 36589 1 536 . 1 . 1 46 46 ILE HD11 H 1 0.725 0.030 . 1 . . . . A 46 ILE HD11 . 36589 1 537 . 1 . 1 46 46 ILE HD12 H 1 0.725 0.030 . 1 . . . . A 46 ILE HD12 . 36589 1 538 . 1 . 1 46 46 ILE HD13 H 1 0.725 0.030 . 1 . . . . A 46 ILE HD13 . 36589 1 539 . 1 . 1 46 46 ILE C C 13 177.695 0.300 . 1 . . . . A 46 ILE C . 36589 1 540 . 1 . 1 46 46 ILE CA C 13 66.651 0.300 . 1 . . . . A 46 ILE CA . 36589 1 541 . 1 . 1 46 46 ILE CB C 13 37.916 0.300 . 1 . . . . A 46 ILE CB . 36589 1 542 . 1 . 1 46 46 ILE CG1 C 13 31.218 0.300 . 1 . . . . A 46 ILE CG1 . 36589 1 543 . 1 . 1 46 46 ILE CG2 C 13 17.149 0.300 . 1 . . . . A 46 ILE CG2 . 36589 1 544 . 1 . 1 46 46 ILE CD1 C 13 12.377 0.300 . 1 . . . . A 46 ILE CD1 . 36589 1 545 . 1 . 1 46 46 ILE N N 15 118.254 0.300 . 1 . . . . A 46 ILE N . 36589 1 546 . 1 . 1 47 47 THR H H 1 8.738 0.030 . 1 . . . . A 47 THR H . 36589 1 547 . 1 . 1 47 47 THR HA H 1 3.954 0.030 . 1 . . . . A 47 THR HA . 36589 1 548 . 1 . 1 47 47 THR HB H 1 4.295 0.030 . 1 . . . . A 47 THR HB . 36589 1 549 . 1 . 1 47 47 THR HG21 H 1 1.171 0.030 . 1 . . . . A 47 THR HG21 . 36589 1 550 . 1 . 1 47 47 THR HG22 H 1 1.171 0.030 . 1 . . . . A 47 THR HG22 . 36589 1 551 . 1 . 1 47 47 THR HG23 H 1 1.171 0.030 . 1 . . . . A 47 THR HG23 . 36589 1 552 . 1 . 1 47 47 THR C C 13 177.060 0.300 . 1 . . . . A 47 THR C . 36589 1 553 . 1 . 1 47 47 THR CA C 13 66.453 0.300 . 1 . . . . A 47 THR CA . 36589 1 554 . 1 . 1 47 47 THR CB C 13 68.756 0.300 . 1 . . . . A 47 THR CB . 36589 1 555 . 1 . 1 47 47 THR CG2 C 13 22.354 0.300 . 1 . . . . A 47 THR CG2 . 36589 1 556 . 1 . 1 47 47 THR N N 15 109.225 0.300 . 1 . . . . A 47 THR N . 36589 1 557 . 1 . 1 48 48 GLU H H 1 8.144 0.030 . 1 . . . . A 48 GLU H . 36589 1 558 . 1 . 1 48 48 GLU HA H 1 4.235 0.030 . 1 . . . . A 48 GLU HA . 36589 1 559 . 1 . 1 48 48 GLU HB2 H 1 2.191 0.030 . 2 . . . . A 48 GLU HB2 . 36589 1 560 . 1 . 1 48 48 GLU HB3 H 1 2.308 0.030 . 2 . . . . A 48 GLU HB3 . 36589 1 561 . 1 . 1 48 48 GLU HG2 H 1 3.112 0.030 . 2 . . . . A 48 GLU HG2 . 36589 1 562 . 1 . 1 48 48 GLU HG3 H 1 2.366 0.030 . 2 . . . . A 48 GLU HG3 . 36589 1 563 . 1 . 1 48 48 GLU C C 13 179.216 0.300 . 1 . . . . A 48 GLU C . 36589 1 564 . 1 . 1 48 48 GLU CA C 13 59.721 0.300 . 1 . . . . A 48 GLU CA . 36589 1 565 . 1 . 1 48 48 GLU CB C 13 28.753 0.300 . 1 . . . . A 48 GLU CB . 36589 1 566 . 1 . 1 48 48 GLU CG C 13 34.629 0.300 . 1 . . . . A 48 GLU CG . 36589 1 567 . 1 . 1 48 48 GLU N N 15 125.689 0.300 . 1 . . . . A 48 GLU N . 36589 1 568 . 1 . 1 49 49 VAL H H 1 8.716 0.030 . 1 . . . . A 49 VAL H . 36589 1 569 . 1 . 1 49 49 VAL HA H 1 3.390 0.030 . 1 . . . . A 49 VAL HA . 36589 1 570 . 1 . 1 49 49 VAL HB H 1 2.582 0.030 . 1 . . . . A 49 VAL HB . 36589 1 571 . 1 . 1 49 49 VAL HG11 H 1 1.044 0.030 . 2 . . . . A 49 VAL HG11 . 36589 1 572 . 1 . 1 49 49 VAL HG12 H 1 1.044 0.030 . 2 . . . . A 49 VAL HG12 . 36589 1 573 . 1 . 1 49 49 VAL HG13 H 1 1.044 0.030 . 2 . . . . A 49 VAL HG13 . 36589 1 574 . 1 . 1 49 49 VAL HG21 H 1 1.039 0.030 . 2 . . . . A 49 VAL HG21 . 36589 1 575 . 1 . 1 49 49 VAL HG22 H 1 1.039 0.030 . 2 . . . . A 49 VAL HG22 . 36589 1 576 . 1 . 1 49 49 VAL HG23 H 1 1.039 0.030 . 2 . . . . A 49 VAL HG23 . 36589 1 577 . 1 . 1 49 49 VAL C C 13 180.289 0.300 . 1 . . . . A 49 VAL C . 36589 1 578 . 1 . 1 49 49 VAL CA C 13 67.967 0.300 . 1 . . . . A 49 VAL CA . 36589 1 579 . 1 . 1 49 49 VAL CB C 13 31.607 0.300 . 1 . . . . A 49 VAL CB . 36589 1 580 . 1 . 1 49 49 VAL CG1 C 13 23.940 0.300 . 2 . . . . A 49 VAL CG1 . 36589 1 581 . 1 . 1 49 49 VAL CG2 C 13 22.358 0.300 . 2 . . . . A 49 VAL CG2 . 36589 1 582 . 1 . 1 49 49 VAL N N 15 120.565 0.300 . 1 . . . . A 49 VAL N . 36589 1 583 . 1 . 1 50 50 ILE H H 1 8.320 0.030 . 1 . . . . A 50 ILE H . 36589 1 584 . 1 . 1 50 50 ILE HA H 1 3.950 0.030 . 1 . . . . A 50 ILE HA . 36589 1 585 . 1 . 1 50 50 ILE HB H 1 1.961 0.030 . 1 . . . . A 50 ILE HB . 36589 1 586 . 1 . 1 50 50 ILE HG12 H 1 2.065 0.030 . 2 . . . . A 50 ILE HG12 . 36589 1 587 . 1 . 1 50 50 ILE HG13 H 1 1.380 0.030 . 2 . . . . A 50 ILE HG13 . 36589 1 588 . 1 . 1 50 50 ILE HG21 H 1 0.809 0.030 . 1 . . . . A 50 ILE HG21 . 36589 1 589 . 1 . 1 50 50 ILE HG22 H 1 0.809 0.030 . 1 . . . . A 50 ILE HG22 . 36589 1 590 . 1 . 1 50 50 ILE HG23 H 1 0.809 0.030 . 1 . . . . A 50 ILE HG23 . 36589 1 591 . 1 . 1 50 50 ILE HD11 H 1 1.002 0.030 . 1 . . . . A 50 ILE HD11 . 36589 1 592 . 1 . 1 50 50 ILE HD12 H 1 1.002 0.030 . 1 . . . . A 50 ILE HD12 . 36589 1 593 . 1 . 1 50 50 ILE HD13 H 1 1.002 0.030 . 1 . . . . A 50 ILE HD13 . 36589 1 594 . 1 . 1 50 50 ILE C C 13 180.165 0.300 . 1 . . . . A 50 ILE C . 36589 1 595 . 1 . 1 50 50 ILE CA C 13 65.921 0.300 . 1 . . . . A 50 ILE CA . 36589 1 596 . 1 . 1 50 50 ILE CB C 13 38.728 0.300 . 1 . . . . A 50 ILE CB . 36589 1 597 . 1 . 1 50 50 ILE CG1 C 13 28.768 0.300 . 1 . . . . A 50 ILE CG1 . 36589 1 598 . 1 . 1 50 50 ILE CG2 C 13 16.723 0.300 . 1 . . . . A 50 ILE CG2 . 36589 1 599 . 1 . 1 50 50 ILE CD1 C 13 15.179 0.300 . 1 . . . . A 50 ILE CD1 . 36589 1 600 . 1 . 1 50 50 ILE N N 15 124.194 0.300 . 1 . . . . A 50 ILE N . 36589 1 601 . 1 . 1 51 51 ARG H H 1 8.456 0.030 . 1 . . . . A 51 ARG H . 36589 1 602 . 1 . 1 51 51 ARG HA H 1 4.014 0.030 . 1 . . . . A 51 ARG HA . 36589 1 603 . 1 . 1 51 51 ARG HB2 H 1 1.873 0.030 . 2 . . . . A 51 ARG HB2 . 36589 1 604 . 1 . 1 51 51 ARG HB3 H 1 2.042 0.030 . 2 . . . . A 51 ARG HB3 . 36589 1 605 . 1 . 1 51 51 ARG HG2 H 1 1.873 0.030 . 2 . . . . A 51 ARG HG2 . 36589 1 606 . 1 . 1 51 51 ARG HG3 H 1 1.651 0.030 . 2 . . . . A 51 ARG HG3 . 36589 1 607 . 1 . 1 51 51 ARG HD2 H 1 3.217 0.030 . 2 . . . . A 51 ARG HD2 . 36589 1 608 . 1 . 1 51 51 ARG HD3 H 1 3.342 0.030 . 2 . . . . A 51 ARG HD3 . 36589 1 609 . 1 . 1 51 51 ARG C C 13 179.135 0.300 . 1 . . . . A 51 ARG C . 36589 1 610 . 1 . 1 51 51 ARG CA C 13 60.115 0.300 . 1 . . . . A 51 ARG CA . 36589 1 611 . 1 . 1 51 51 ARG CB C 13 31.489 0.300 . 1 . . . . A 51 ARG CB . 36589 1 612 . 1 . 1 51 51 ARG CG C 13 28.856 0.300 . 1 . . . . A 51 ARG CG . 36589 1 613 . 1 . 1 51 51 ARG CD C 13 43.467 0.300 . 1 . . . . A 51 ARG CD . 36589 1 614 . 1 . 1 51 51 ARG N N 15 120.132 0.300 . 1 . . . . A 51 ARG N . 36589 1 615 . 1 . 1 52 52 MET H H 1 8.849 0.030 . 1 . . . . A 52 MET H . 36589 1 616 . 1 . 1 52 52 MET HA H 1 4.740 0.030 . 1 . . . . A 52 MET HA . 36589 1 617 . 1 . 1 52 52 MET HB2 H 1 2.351 0.030 . 2 . . . . A 52 MET HB2 . 36589 1 618 . 1 . 1 52 52 MET HB3 H 1 2.242 0.030 . 2 . . . . A 52 MET HB3 . 36589 1 619 . 1 . 1 52 52 MET HG2 H 1 2.884 0.030 . 2 . . . . A 52 MET HG2 . 36589 1 620 . 1 . 1 52 52 MET HG3 H 1 3.067 0.030 . 2 . . . . A 52 MET HG3 . 36589 1 621 . 1 . 1 52 52 MET HE1 H 1 2.192 0.030 . 1 . . . . A 52 MET HE1 . 36589 1 622 . 1 . 1 52 52 MET HE2 H 1 2.192 0.030 . 1 . . . . A 52 MET HE2 . 36589 1 623 . 1 . 1 52 52 MET HE3 H 1 2.192 0.030 . 1 . . . . A 52 MET HE3 . 36589 1 624 . 1 . 1 52 52 MET C C 13 178.821 0.300 . 1 . . . . A 52 MET C . 36589 1 625 . 1 . 1 52 52 MET CA C 13 56.067 0.300 . 1 . . . . A 52 MET CA . 36589 1 626 . 1 . 1 52 52 MET CB C 13 33.174 0.300 . 1 . . . . A 52 MET CB . 36589 1 627 . 1 . 1 52 52 MET CG C 13 33.417 0.300 . 1 . . . . A 52 MET CG . 36589 1 628 . 1 . 1 52 52 MET CE C 13 17.205 0.300 . 1 . . . . A 52 MET CE . 36589 1 629 . 1 . 1 52 52 MET N N 15 113.860 0.300 . 1 . . . . A 52 MET N . 36589 1 630 . 1 . 1 53 53 THR H H 1 8.186 0.030 . 1 . . . . A 53 THR H . 36589 1 631 . 1 . 1 53 53 THR HA H 1 4.905 0.030 . 1 . . . . A 53 THR HA . 36589 1 632 . 1 . 1 53 53 THR HB H 1 4.549 0.030 . 1 . . . . A 53 THR HB . 36589 1 633 . 1 . 1 53 53 THR HG21 H 1 1.331 0.030 . 1 . . . . A 53 THR HG21 . 36589 1 634 . 1 . 1 53 53 THR HG22 H 1 1.331 0.030 . 1 . . . . A 53 THR HG22 . 36589 1 635 . 1 . 1 53 53 THR HG23 H 1 1.331 0.030 . 1 . . . . A 53 THR HG23 . 36589 1 636 . 1 . 1 53 53 THR C C 13 176.331 0.300 . 1 . . . . A 53 THR C . 36589 1 637 . 1 . 1 53 53 THR CA C 13 62.399 0.300 . 1 . . . . A 53 THR CA . 36589 1 638 . 1 . 1 53 53 THR CB C 13 73.048 0.300 . 1 . . . . A 53 THR CB . 36589 1 639 . 1 . 1 53 53 THR CG2 C 13 21.659 0.300 . 1 . . . . A 53 THR CG2 . 36589 1 640 . 1 . 1 53 53 THR N N 15 106.128 0.300 . 1 . . . . A 53 THR N . 36589 1 641 . 1 . 1 54 54 GLY H H 1 8.230 0.030 . 1 . . . . A 54 GLY H . 36589 1 642 . 1 . 1 54 54 GLY HA2 H 1 3.839 0.030 . 2 . . . . A 54 GLY HA2 . 36589 1 643 . 1 . 1 54 54 GLY HA3 H 1 4.475 0.030 . 2 . . . . A 54 GLY HA3 . 36589 1 644 . 1 . 1 54 54 GLY C C 13 173.610 0.300 . 1 . . . . A 54 GLY C . 36589 1 645 . 1 . 1 54 54 GLY CA C 13 45.835 0.300 . 1 . . . . A 54 GLY CA . 36589 1 646 . 1 . 1 54 54 GLY N N 15 112.206 0.300 . 1 . . . . A 54 GLY N . 36589 1 647 . 1 . 1 55 55 PHE H H 1 8.905 0.030 . 1 . . . . A 55 PHE H . 36589 1 648 . 1 . 1 55 55 PHE HA H 1 4.380 0.030 . 1 . . . . A 55 PHE HA . 36589 1 649 . 1 . 1 55 55 PHE HB2 H 1 3.188 0.030 . 2 . . . . A 55 PHE HB2 . 36589 1 650 . 1 . 1 55 55 PHE HB3 H 1 2.672 0.030 . 2 . . . . A 55 PHE HB3 . 36589 1 651 . 1 . 1 55 55 PHE HD1 H 1 7.273 0.030 . 1 . . . . A 55 PHE HD1 . 36589 1 652 . 1 . 1 55 55 PHE HD2 H 1 7.273 0.030 . 1 . . . . A 55 PHE HD2 . 36589 1 653 . 1 . 1 55 55 PHE HE1 H 1 7.164 0.030 . 1 . . . . A 55 PHE HE1 . 36589 1 654 . 1 . 1 55 55 PHE HE2 H 1 7.164 0.030 . 1 . . . . A 55 PHE HE2 . 36589 1 655 . 1 . 1 55 55 PHE HZ H 1 7.141 0.030 . 1 . . . . A 55 PHE HZ . 36589 1 656 . 1 . 1 55 55 PHE C C 13 174.273 0.300 . 1 . . . . A 55 PHE C . 36589 1 657 . 1 . 1 55 55 PHE CA C 13 60.448 0.300 . 1 . . . . A 55 PHE CA . 36589 1 658 . 1 . 1 55 55 PHE CB C 13 40.064 0.300 . 1 . . . . A 55 PHE CB . 36589 1 659 . 1 . 1 55 55 PHE CD1 C 13 132.870 0.300 . 1 . . . . A 55 PHE CD1 . 36589 1 660 . 1 . 1 55 55 PHE CD2 C 13 132.870 0.300 . 1 . . . . A 55 PHE CD2 . 36589 1 661 . 1 . 1 55 55 PHE CE1 C 13 130.533 0.300 . 1 . . . . A 55 PHE CE1 . 36589 1 662 . 1 . 1 55 55 PHE CE2 C 13 130.533 0.300 . 1 . . . . A 55 PHE CE2 . 36589 1 663 . 1 . 1 55 55 PHE CZ C 13 127.689 0.300 . 1 . . . . A 55 PHE CZ . 36589 1 664 . 1 . 1 55 55 PHE N N 15 128.601 0.300 . 1 . . . . A 55 PHE N . 36589 1 665 . 1 . 1 56 56 MET H H 1 8.438 0.030 . 1 . . . . A 56 MET H . 36589 1 666 . 1 . 1 56 56 MET HA H 1 2.700 0.030 . 1 . . . . A 56 MET HA . 36589 1 667 . 1 . 1 56 56 MET HB2 H 1 1.936 0.030 . 2 . . . . A 56 MET HB2 . 36589 1 668 . 1 . 1 56 56 MET HB3 H 1 2.721 0.030 . 2 . . . . A 56 MET HB3 . 36589 1 669 . 1 . 1 56 56 MET HG2 H 1 1.719 0.030 . 2 . . . . A 56 MET HG2 . 36589 1 670 . 1 . 1 56 56 MET HG3 H 1 1.482 0.030 . 2 . . . . A 56 MET HG3 . 36589 1 671 . 1 . 1 56 56 MET HE1 H 1 2.011 0.030 . 1 . . . . A 56 MET HE1 . 36589 1 672 . 1 . 1 56 56 MET HE2 H 1 2.011 0.030 . 1 . . . . A 56 MET HE2 . 36589 1 673 . 1 . 1 56 56 MET HE3 H 1 2.011 0.030 . 1 . . . . A 56 MET HE3 . 36589 1 674 . 1 . 1 56 56 MET C C 13 174.182 0.300 . 1 . . . . A 56 MET C . 36589 1 675 . 1 . 1 56 56 MET CA C 13 59.106 0.300 . 1 . . . . A 56 MET CA . 36589 1 676 . 1 . 1 56 56 MET CB C 13 29.217 0.300 . 1 . . . . A 56 MET CB . 36589 1 677 . 1 . 1 56 56 MET CG C 13 32.889 0.300 . 1 . . . . A 56 MET CG . 36589 1 678 . 1 . 1 56 56 MET CE C 13 16.671 0.300 . 1 . . . . A 56 MET CE . 36589 1 679 . 1 . 1 56 56 MET N N 15 112.366 0.300 . 1 . . . . A 56 MET N . 36589 1 680 . 1 . 1 57 57 LYS H H 1 7.633 0.030 . 1 . . . . A 57 LYS H . 36589 1 681 . 1 . 1 57 57 LYS HA H 1 3.837 0.030 . 1 . . . . A 57 LYS HA . 36589 1 682 . 1 . 1 57 57 LYS HB2 H 1 1.844 0.030 . 2 . . . . A 57 LYS HB2 . 36589 1 683 . 1 . 1 57 57 LYS HB3 H 1 1.806 0.030 . 2 . . . . A 57 LYS HB3 . 36589 1 684 . 1 . 1 57 57 LYS HG2 H 1 1.434 0.030 . 2 . . . . A 57 LYS HG2 . 36589 1 685 . 1 . 1 57 57 LYS HG3 H 1 1.375 0.030 . 2 . . . . A 57 LYS HG3 . 36589 1 686 . 1 . 1 57 57 LYS HD2 H 1 1.764 0.030 . 1 . . . . A 57 LYS HD2 . 36589 1 687 . 1 . 1 57 57 LYS HD3 H 1 1.764 0.030 . 1 . . . . A 57 LYS HD3 . 36589 1 688 . 1 . 1 57 57 LYS HE2 H 1 3.059 0.030 . 1 . . . . A 57 LYS HE2 . 36589 1 689 . 1 . 1 57 57 LYS HE3 H 1 3.059 0.030 . 1 . . . . A 57 LYS HE3 . 36589 1 690 . 1 . 1 57 57 LYS C C 13 177.507 0.300 . 1 . . . . A 57 LYS C . 36589 1 691 . 1 . 1 57 57 LYS CA C 13 58.974 0.300 . 1 . . . . A 57 LYS CA . 36589 1 692 . 1 . 1 57 57 LYS CB C 13 32.748 0.300 . 1 . . . . A 57 LYS CB . 36589 1 693 . 1 . 1 57 57 LYS CG C 13 24.539 0.300 . 1 . . . . A 57 LYS CG . 36589 1 694 . 1 . 1 57 57 LYS CD C 13 29.710 0.300 . 1 . . . . A 57 LYS CD . 36589 1 695 . 1 . 1 57 57 LYS CE C 13 42.309 0.300 . 1 . . . . A 57 LYS CE . 36589 1 696 . 1 . 1 57 57 LYS N N 15 119.944 0.300 . 1 . . . . A 57 LYS N . 36589 1 697 . 1 . 1 58 58 GLY H H 1 8.788 0.030 . 1 . . . . A 58 GLY H . 36589 1 698 . 1 . 1 58 58 GLY HA2 H 1 3.636 0.030 . 2 . . . . A 58 GLY HA2 . 36589 1 699 . 1 . 1 58 58 GLY HA3 H 1 4.152 0.030 . 2 . . . . A 58 GLY HA3 . 36589 1 700 . 1 . 1 58 58 GLY C C 13 173.722 0.300 . 1 . . . . A 58 GLY C . 36589 1 701 . 1 . 1 58 58 GLY CA C 13 44.890 0.300 . 1 . . . . A 58 GLY CA . 36589 1 702 . 1 . 1 58 58 GLY N N 15 114.709 0.300 . 1 . . . . A 58 GLY N . 36589 1 703 . 1 . 1 59 59 LEU H H 1 7.697 0.030 . 1 . . . . A 59 LEU H . 36589 1 704 . 1 . 1 59 59 LEU HA H 1 3.748 0.030 . 1 . . . . A 59 LEU HA . 36589 1 705 . 1 . 1 59 59 LEU HB2 H 1 0.915 0.030 . 2 . . . . A 59 LEU HB2 . 36589 1 706 . 1 . 1 59 59 LEU HB3 H 1 1.244 0.030 . 2 . . . . A 59 LEU HB3 . 36589 1 707 . 1 . 1 59 59 LEU HD11 H 1 0.386 0.030 . 2 . . . . A 59 LEU HD11 . 36589 1 708 . 1 . 1 59 59 LEU HD12 H 1 0.386 0.030 . 2 . . . . A 59 LEU HD12 . 36589 1 709 . 1 . 1 59 59 LEU HD13 H 1 0.386 0.030 . 2 . . . . A 59 LEU HD13 . 36589 1 710 . 1 . 1 59 59 LEU HD21 H 1 0.647 0.030 . 2 . . . . A 59 LEU HD21 . 36589 1 711 . 1 . 1 59 59 LEU HD22 H 1 0.647 0.030 . 2 . . . . A 59 LEU HD22 . 36589 1 712 . 1 . 1 59 59 LEU HD23 H 1 0.647 0.030 . 2 . . . . A 59 LEU HD23 . 36589 1 713 . 1 . 1 59 59 LEU C C 13 173.869 0.300 . 1 . . . . A 59 LEU C . 36589 1 714 . 1 . 1 59 59 LEU CA C 13 56.318 0.300 . 1 . . . . A 59 LEU CA . 36589 1 715 . 1 . 1 59 59 LEU CB C 13 44.413 0.300 . 1 . . . . A 59 LEU CB . 36589 1 716 . 1 . 1 59 59 LEU CG C 13 25.832 0.300 . 1 . . . . A 59 LEU CG . 36589 1 717 . 1 . 1 59 59 LEU CD1 C 13 26.066 0.300 . 2 . . . . A 59 LEU CD1 . 36589 1 718 . 1 . 1 59 59 LEU CD2 C 13 22.507 0.300 . 2 . . . . A 59 LEU CD2 . 36589 1 719 . 1 . 1 59 59 LEU N N 15 122.364 0.300 . 1 . . . . A 59 LEU N . 36589 1 720 . 1 . 1 60 60 TYR H H 1 7.616 0.030 . 1 . . . . A 60 TYR H . 36589 1 721 . 1 . 1 60 60 TYR HA H 1 5.025 0.030 . 1 . . . . A 60 TYR HA . 36589 1 722 . 1 . 1 60 60 TYR HB2 H 1 2.551 0.030 . 2 . . . . A 60 TYR HB2 . 36589 1 723 . 1 . 1 60 60 TYR HB3 H 1 3.260 0.030 . 2 . . . . A 60 TYR HB3 . 36589 1 724 . 1 . 1 60 60 TYR HD1 H 1 6.913 0.030 . 1 . . . . A 60 TYR HD1 . 36589 1 725 . 1 . 1 60 60 TYR HD2 H 1 6.913 0.030 . 1 . . . . A 60 TYR HD2 . 36589 1 726 . 1 . 1 60 60 TYR HE1 H 1 6.154 0.030 . 1 . . . . A 60 TYR HE1 . 36589 1 727 . 1 . 1 60 60 TYR HE2 H 1 6.154 0.030 . 1 . . . . A 60 TYR HE2 . 36589 1 728 . 1 . 1 60 60 TYR C C 13 177.099 0.300 . 1 . . . . A 60 TYR C . 36589 1 729 . 1 . 1 60 60 TYR CA C 13 55.265 0.300 . 1 . . . . A 60 TYR CA . 36589 1 730 . 1 . 1 60 60 TYR CB C 13 40.796 0.300 . 1 . . . . A 60 TYR CB . 36589 1 731 . 1 . 1 60 60 TYR CD1 C 13 132.074 0.300 . 1 . . . . A 60 TYR CD1 . 36589 1 732 . 1 . 1 60 60 TYR CD2 C 13 132.074 0.300 . 1 . . . . A 60 TYR CD2 . 36589 1 733 . 1 . 1 60 60 TYR CE1 C 13 117.917 0.300 . 1 . . . . A 60 TYR CE1 . 36589 1 734 . 1 . 1 60 60 TYR CE2 C 13 117.917 0.300 . 1 . . . . A 60 TYR CE2 . 36589 1 735 . 1 . 1 60 60 TYR N N 15 112.459 0.300 . 1 . . . . A 60 TYR N . 36589 1 736 . 1 . 1 61 61 THR H H 1 9.371 0.030 . 1 . . . . A 61 THR H . 36589 1 737 . 1 . 1 61 61 THR HA H 1 4.371 0.030 . 1 . . . . A 61 THR HA . 36589 1 738 . 1 . 1 61 61 THR HB H 1 4.736 0.030 . 1 . . . . A 61 THR HB . 36589 1 739 . 1 . 1 61 61 THR HG21 H 1 1.397 0.030 . 1 . . . . A 61 THR HG21 . 36589 1 740 . 1 . 1 61 61 THR HG22 H 1 1.397 0.030 . 1 . . . . A 61 THR HG22 . 36589 1 741 . 1 . 1 61 61 THR HG23 H 1 1.397 0.030 . 1 . . . . A 61 THR HG23 . 36589 1 742 . 1 . 1 61 61 THR C C 13 174.912 0.300 . 1 . . . . A 61 THR C . 36589 1 743 . 1 . 1 61 61 THR CA C 13 60.941 0.300 . 1 . . . . A 61 THR CA . 36589 1 744 . 1 . 1 61 61 THR CB C 13 71.281 0.300 . 1 . . . . A 61 THR CB . 36589 1 745 . 1 . 1 61 61 THR CG2 C 13 21.950 0.300 . 1 . . . . A 61 THR CG2 . 36589 1 746 . 1 . 1 61 61 THR N N 15 114.914 0.300 . 1 . . . . A 61 THR N . 36589 1 747 . 1 . 1 62 62 ASP H H 1 8.775 0.030 . 1 . . . . A 62 ASP H . 36589 1 748 . 1 . 1 62 62 ASP HA H 1 4.291 0.030 . 1 . . . . A 62 ASP HA . 36589 1 749 . 1 . 1 62 62 ASP HB2 H 1 2.671 0.030 . 1 . . . . A 62 ASP HB2 . 36589 1 750 . 1 . 1 62 62 ASP HB3 H 1 2.671 0.030 . 1 . . . . A 62 ASP HB3 . 36589 1 751 . 1 . 1 62 62 ASP C C 13 179.256 0.300 . 1 . . . . A 62 ASP C . 36589 1 752 . 1 . 1 62 62 ASP CA C 13 58.035 0.300 . 1 . . . . A 62 ASP CA . 36589 1 753 . 1 . 1 62 62 ASP CB C 13 40.274 0.300 . 1 . . . . A 62 ASP CB . 36589 1 754 . 1 . 1 62 62 ASP N N 15 119.329 0.300 . 1 . . . . A 62 ASP N . 36589 1 755 . 1 . 1 63 63 ALA H H 1 8.205 0.030 . 1 . . . . A 63 ALA H . 36589 1 756 . 1 . 1 63 63 ALA HA H 1 4.097 0.030 . 1 . . . . A 63 ALA HA . 36589 1 757 . 1 . 1 63 63 ALA HB1 H 1 1.443 0.030 . 1 . . . . A 63 ALA HB1 . 36589 1 758 . 1 . 1 63 63 ALA HB2 H 1 1.443 0.030 . 1 . . . . A 63 ALA HB2 . 36589 1 759 . 1 . 1 63 63 ALA HB3 H 1 1.443 0.030 . 1 . . . . A 63 ALA HB3 . 36589 1 760 . 1 . 1 63 63 ALA C C 13 180.466 0.300 . 1 . . . . A 63 ALA C . 36589 1 761 . 1 . 1 63 63 ALA CA C 13 55.262 0.300 . 1 . . . . A 63 ALA CA . 36589 1 762 . 1 . 1 63 63 ALA CB C 13 18.369 0.300 . 1 . . . . A 63 ALA CB . 36589 1 763 . 1 . 1 63 63 ALA N N 15 120.316 0.300 . 1 . . . . A 63 ALA N . 36589 1 764 . 1 . 1 64 64 GLU H H 1 7.580 0.030 . 1 . . . . A 64 GLU H . 36589 1 765 . 1 . 1 64 64 GLU HA H 1 3.967 0.030 . 1 . . . . A 64 GLU HA . 36589 1 766 . 1 . 1 64 64 GLU HB2 H 1 2.238 0.030 . 2 . . . . A 64 GLU HB2 . 36589 1 767 . 1 . 1 64 64 GLU HB3 H 1 2.680 0.030 . 2 . . . . A 64 GLU HB3 . 36589 1 768 . 1 . 1 64 64 GLU HG2 H 1 2.448 0.030 . 2 . . . . A 64 GLU HG2 . 36589 1 769 . 1 . 1 64 64 GLU HG3 H 1 2.552 0.030 . 2 . . . . A 64 GLU HG3 . 36589 1 770 . 1 . 1 64 64 GLU C C 13 176.536 0.300 . 1 . . . . A 64 GLU C . 36589 1 771 . 1 . 1 64 64 GLU CA C 13 58.222 0.300 . 1 . . . . A 64 GLU CA . 36589 1 772 . 1 . 1 64 64 GLU CB C 13 31.333 0.300 . 1 . . . . A 64 GLU CB . 36589 1 773 . 1 . 1 64 64 GLU CG C 13 38.221 0.300 . 1 . . . . A 64 GLU CG . 36589 1 774 . 1 . 1 64 64 GLU N N 15 117.137 0.300 . 1 . . . . A 64 GLU N . 36589 1 775 . 1 . 1 65 65 MET H H 1 7.588 0.030 . 1 . . . . A 65 MET H . 36589 1 776 . 1 . 1 65 65 MET HA H 1 4.285 0.030 . 1 . . . . A 65 MET HA . 36589 1 777 . 1 . 1 65 65 MET HB2 H 1 2.353 0.030 . 2 . . . . A 65 MET HB2 . 36589 1 778 . 1 . 1 65 65 MET HB3 H 1 2.308 0.030 . 2 . . . . A 65 MET HB3 . 36589 1 779 . 1 . 1 65 65 MET HG2 H 1 2.578 0.030 . 2 . . . . A 65 MET HG2 . 36589 1 780 . 1 . 1 65 65 MET HG3 H 1 2.898 0.030 . 2 . . . . A 65 MET HG3 . 36589 1 781 . 1 . 1 65 65 MET HE1 H 1 2.166 0.030 . 1 . . . . A 65 MET HE1 . 36589 1 782 . 1 . 1 65 65 MET HE2 H 1 2.166 0.030 . 1 . . . . A 65 MET HE2 . 36589 1 783 . 1 . 1 65 65 MET HE3 H 1 2.166 0.030 . 1 . . . . A 65 MET HE3 . 36589 1 784 . 1 . 1 65 65 MET C C 13 175.195 0.300 . 1 . . . . A 65 MET C . 36589 1 785 . 1 . 1 65 65 MET CA C 13 55.869 0.300 . 1 . . . . A 65 MET CA . 36589 1 786 . 1 . 1 65 65 MET CB C 13 31.586 0.300 . 1 . . . . A 65 MET CB . 36589 1 787 . 1 . 1 65 65 MET CG C 13 32.801 0.300 . 1 . . . . A 65 MET CG . 36589 1 788 . 1 . 1 65 65 MET CE C 13 16.421 0.300 . 1 . . . . A 65 MET CE . 36589 1 789 . 1 . 1 65 65 MET N N 15 114.261 0.300 . 1 . . . . A 65 MET N . 36589 1 790 . 1 . 1 66 66 LYS H H 1 7.482 0.030 . 1 . . . . A 66 LYS H . 36589 1 791 . 1 . 1 66 66 LYS HA H 1 4.709 0.030 . 1 . . . . A 66 LYS HA . 36589 1 792 . 1 . 1 66 66 LYS HB2 H 1 1.928 0.030 . 2 . . . . A 66 LYS HB2 . 36589 1 793 . 1 . 1 66 66 LYS HB3 H 1 1.861 0.030 . 2 . . . . A 66 LYS HB3 . 36589 1 794 . 1 . 1 66 66 LYS HG2 H 1 1.411 0.030 . 2 . . . . A 66 LYS HG2 . 36589 1 795 . 1 . 1 66 66 LYS HG3 H 1 1.565 0.030 . 2 . . . . A 66 LYS HG3 . 36589 1 796 . 1 . 1 66 66 LYS HD2 H 1 1.702 0.030 . 1 . . . . A 66 LYS HD2 . 36589 1 797 . 1 . 1 66 66 LYS HD3 H 1 1.702 0.030 . 1 . . . . A 66 LYS HD3 . 36589 1 798 . 1 . 1 66 66 LYS HE2 H 1 3.007 0.030 . 1 . . . . A 66 LYS HE2 . 36589 1 799 . 1 . 1 66 66 LYS HE3 H 1 3.007 0.030 . 1 . . . . A 66 LYS HE3 . 36589 1 800 . 1 . 1 66 66 LYS C C 13 176.592 0.300 . 1 . . . . A 66 LYS C . 36589 1 801 . 1 . 1 66 66 LYS CA C 13 55.018 0.300 . 1 . . . . A 66 LYS CA . 36589 1 802 . 1 . 1 66 66 LYS CB C 13 32.898 0.300 . 1 . . . . A 66 LYS CB . 36589 1 803 . 1 . 1 66 66 LYS CG C 13 24.630 0.300 . 1 . . . . A 66 LYS CG . 36589 1 804 . 1 . 1 66 66 LYS CD C 13 29.256 0.300 . 1 . . . . A 66 LYS CD . 36589 1 805 . 1 . 1 66 66 LYS CE C 13 42.387 0.300 . 1 . . . . A 66 LYS CE . 36589 1 806 . 1 . 1 66 66 LYS N N 15 121.595 0.300 . 1 . . . . A 66 LYS N . 36589 1 807 . 1 . 1 67 67 SER H H 1 9.045 0.030 . 1 . . . . A 67 SER H . 36589 1 808 . 1 . 1 67 67 SER HA H 1 3.460 0.030 . 1 . . . . A 67 SER HA . 36589 1 809 . 1 . 1 67 67 SER HB2 H 1 2.799 0.030 . 2 . . . . A 67 SER HB2 . 36589 1 810 . 1 . 1 67 67 SER HB3 H 1 3.508 0.030 . 2 . . . . A 67 SER HB3 . 36589 1 811 . 1 . 1 67 67 SER C C 13 176.548 0.300 . 1 . . . . A 67 SER C . 36589 1 812 . 1 . 1 67 67 SER CA C 13 61.584 0.300 . 1 . . . . A 67 SER CA . 36589 1 813 . 1 . 1 67 67 SER CB C 13 61.545 0.300 . 1 . . . . A 67 SER CB . 36589 1 814 . 1 . 1 67 67 SER N N 15 122.564 0.300 . 1 . . . . A 67 SER N . 36589 1 815 . 1 . 1 68 68 ASP H H 1 8.408 0.030 . 1 . . . . A 68 ASP H . 36589 1 816 . 1 . 1 68 68 ASP HA H 1 4.287 0.030 . 1 . . . . A 68 ASP HA . 36589 1 817 . 1 . 1 68 68 ASP HB2 H 1 2.404 0.030 . 2 . . . . A 68 ASP HB2 . 36589 1 818 . 1 . 1 68 68 ASP HB3 H 1 2.663 0.030 . 2 . . . . A 68 ASP HB3 . 36589 1 819 . 1 . 1 68 68 ASP C C 13 176.195 0.300 . 1 . . . . A 68 ASP C . 36589 1 820 . 1 . 1 68 68 ASP CA C 13 55.854 0.300 . 1 . . . . A 68 ASP CA . 36589 1 821 . 1 . 1 68 68 ASP CB C 13 40.624 0.300 . 1 . . . . A 68 ASP CB . 36589 1 822 . 1 . 1 68 68 ASP N N 15 119.520 0.300 . 1 . . . . A 68 ASP N . 36589 1 823 . 1 . 1 69 69 ASN H H 1 7.732 0.030 . 1 . . . . A 69 ASN H . 36589 1 824 . 1 . 1 69 69 ASN HA H 1 4.700 0.030 . 1 . . . . A 69 ASN HA . 36589 1 825 . 1 . 1 69 69 ASN HB2 H 1 2.898 0.030 . 2 . . . . A 69 ASN HB2 . 36589 1 826 . 1 . 1 69 69 ASN HB3 H 1 3.083 0.030 . 2 . . . . A 69 ASN HB3 . 36589 1 827 . 1 . 1 69 69 ASN HD21 H 1 7.282 0.030 . 2 . . . . A 69 ASN HD21 . 36589 1 828 . 1 . 1 69 69 ASN HD22 H 1 8.339 0.030 . 2 . . . . A 69 ASN HD22 . 36589 1 829 . 1 . 1 69 69 ASN C C 13 175.474 0.300 . 1 . . . . A 69 ASN C . 36589 1 830 . 1 . 1 69 69 ASN CA C 13 53.265 0.300 . 1 . . . . A 69 ASN CA . 36589 1 831 . 1 . 1 69 69 ASN CB C 13 39.083 0.300 . 1 . . . . A 69 ASN CB . 36589 1 832 . 1 . 1 69 69 ASN N N 15 113.740 0.300 . 1 . . . . A 69 ASN N . 36589 1 833 . 1 . 1 69 69 ASN ND2 N 15 114.335 0.300 . 1 . . . . A 69 ASN ND2 . 36589 1 834 . 1 . 1 70 70 VAL H H 1 7.581 0.030 . 1 . . . . A 70 VAL H . 36589 1 835 . 1 . 1 70 70 VAL HA H 1 4.010 0.030 . 1 . . . . A 70 VAL HA . 36589 1 836 . 1 . 1 70 70 VAL HB H 1 1.990 0.030 . 1 . . . . A 70 VAL HB . 36589 1 837 . 1 . 1 70 70 VAL HG11 H 1 0.731 0.030 . 2 . . . . A 70 VAL HG11 . 36589 1 838 . 1 . 1 70 70 VAL HG12 H 1 0.731 0.030 . 2 . . . . A 70 VAL HG12 . 36589 1 839 . 1 . 1 70 70 VAL HG13 H 1 0.731 0.030 . 2 . . . . A 70 VAL HG13 . 36589 1 840 . 1 . 1 70 70 VAL HG21 H 1 0.866 0.030 . 2 . . . . A 70 VAL HG21 . 36589 1 841 . 1 . 1 70 70 VAL HG22 H 1 0.866 0.030 . 2 . . . . A 70 VAL HG22 . 36589 1 842 . 1 . 1 70 70 VAL HG23 H 1 0.866 0.030 . 2 . . . . A 70 VAL HG23 . 36589 1 843 . 1 . 1 70 70 VAL C C 13 174.146 0.300 . 1 . . . . A 70 VAL C . 36589 1 844 . 1 . 1 70 70 VAL CA C 13 61.347 0.300 . 1 . . . . A 70 VAL CA . 36589 1 845 . 1 . 1 70 70 VAL CB C 13 30.361 0.300 . 1 . . . . A 70 VAL CB . 36589 1 846 . 1 . 1 70 70 VAL CG1 C 13 23.322 0.300 . 2 . . . . A 70 VAL CG1 . 36589 1 847 . 1 . 1 70 70 VAL CG2 C 13 20.551 0.300 . 2 . . . . A 70 VAL CG2 . 36589 1 848 . 1 . 1 70 70 VAL N N 15 123.620 0.300 . 1 . . . . A 70 VAL N . 36589 1 849 . 1 . 1 71 71 LYS H H 1 7.859 0.030 . 1 . . . . A 71 LYS H . 36589 1 850 . 1 . 1 71 71 LYS HA H 1 4.229 0.030 . 1 . . . . A 71 LYS HA . 36589 1 851 . 1 . 1 71 71 LYS HB2 H 1 1.718 0.030 . 1 . . . . A 71 LYS HB2 . 36589 1 852 . 1 . 1 71 71 LYS HB3 H 1 1.718 0.030 . 1 . . . . A 71 LYS HB3 . 36589 1 853 . 1 . 1 71 71 LYS HG2 H 1 1.315 0.030 . 1 . . . . A 71 LYS HG2 . 36589 1 854 . 1 . 1 71 71 LYS HG3 H 1 1.315 0.030 . 1 . . . . A 71 LYS HG3 . 36589 1 855 . 1 . 1 71 71 LYS HD2 H 1 1.678 0.030 . 1 . . . . A 71 LYS HD2 . 36589 1 856 . 1 . 1 71 71 LYS HD3 H 1 1.678 0.030 . 1 . . . . A 71 LYS HD3 . 36589 1 857 . 1 . 1 71 71 LYS HE2 H 1 3.030 0.030 . 1 . . . . A 71 LYS HE2 . 36589 1 858 . 1 . 1 71 71 LYS HE3 H 1 3.030 0.030 . 1 . . . . A 71 LYS HE3 . 36589 1 859 . 1 . 1 71 71 LYS C C 13 176.548 0.300 . 1 . . . . A 71 LYS C . 36589 1 860 . 1 . 1 71 71 LYS CA C 13 57.569 0.300 . 1 . . . . A 71 LYS CA . 36589 1 861 . 1 . 1 71 71 LYS CB C 13 34.740 0.300 . 1 . . . . A 71 LYS CB . 36589 1 862 . 1 . 1 71 71 LYS CG C 13 24.769 0.300 . 1 . . . . A 71 LYS CG . 36589 1 863 . 1 . 1 71 71 LYS CD C 13 29.291 0.300 . 1 . . . . A 71 LYS CD . 36589 1 864 . 1 . 1 71 71 LYS CE C 13 42.131 0.300 . 1 . . . . A 71 LYS CE . 36589 1 865 . 1 . 1 71 71 LYS N N 15 120.749 0.300 . 1 . . . . A 71 LYS N . 36589 1 866 . 1 . 1 72 72 ASP H H 1 7.869 0.030 . 1 . . . . A 72 ASP H . 36589 1 867 . 1 . 1 72 72 ASP HA H 1 4.805 0.030 . 1 . . . . A 72 ASP HA . 36589 1 868 . 1 . 1 72 72 ASP HB2 H 1 2.839 0.030 . 2 . . . . A 72 ASP HB2 . 36589 1 869 . 1 . 1 72 72 ASP HB3 H 1 2.754 0.030 . 2 . . . . A 72 ASP HB3 . 36589 1 870 . 1 . 1 72 72 ASP C C 13 175.897 0.300 . 1 . . . . A 72 ASP C . 36589 1 871 . 1 . 1 72 72 ASP CA C 13 53.267 0.300 . 1 . . . . A 72 ASP CA . 36589 1 872 . 1 . 1 72 72 ASP CB C 13 42.590 0.300 . 1 . . . . A 72 ASP CB . 36589 1 873 . 1 . 1 72 72 ASP N N 15 119.375 0.300 . 1 . . . . A 72 ASP N . 36589 1 874 . 1 . 1 73 73 LYS HA H 1 3.672 0.030 . 1 . . . . A 73 LYS HA . 36589 1 875 . 1 . 1 73 73 LYS HB2 H 1 1.801 0.030 . 2 . . . . A 73 LYS HB2 . 36589 1 876 . 1 . 1 73 73 LYS HB3 H 1 1.940 0.030 . 2 . . . . A 73 LYS HB3 . 36589 1 877 . 1 . 1 73 73 LYS HG2 H 1 1.388 0.030 . 2 . . . . A 73 LYS HG2 . 36589 1 878 . 1 . 1 73 73 LYS HG3 H 1 1.457 0.030 . 2 . . . . A 73 LYS HG3 . 36589 1 879 . 1 . 1 73 73 LYS HD2 H 1 1.801 0.030 . 1 . . . . A 73 LYS HD2 . 36589 1 880 . 1 . 1 73 73 LYS HD3 H 1 1.801 0.030 . 1 . . . . A 73 LYS HD3 . 36589 1 881 . 1 . 1 73 73 LYS HE2 H 1 2.978 0.030 . 1 . . . . A 73 LYS HE2 . 36589 1 882 . 1 . 1 73 73 LYS HE3 H 1 2.978 0.030 . 1 . . . . A 73 LYS HE3 . 36589 1 883 . 1 . 1 73 73 LYS C C 13 177.664 0.300 . 1 . . . . A 73 LYS C . 36589 1 884 . 1 . 1 73 73 LYS CA C 13 61.109 0.300 . 1 . . . . A 73 LYS CA . 36589 1 885 . 1 . 1 73 73 LYS CB C 13 32.275 0.300 . 1 . . . . A 73 LYS CB . 36589 1 886 . 1 . 1 73 73 LYS CG C 13 24.561 0.300 . 1 . . . . A 73 LYS CG . 36589 1 887 . 1 . 1 73 73 LYS CD C 13 29.087 0.300 . 1 . . . . A 73 LYS CD . 36589 1 888 . 1 . 1 73 73 LYS CE C 13 41.989 0.300 . 1 . . . . A 73 LYS CE . 36589 1 889 . 1 . 1 73 73 LYS N N 15 122.894 0.300 . 1 . . . . A 73 LYS N . 36589 1 890 . 1 . 1 74 74 ASP H H 1 8.389 0.030 . 1 . . . . A 74 ASP H . 36589 1 891 . 1 . 1 74 74 ASP HA H 1 4.393 0.030 . 1 . . . . A 74 ASP HA . 36589 1 892 . 1 . 1 74 74 ASP HB2 H 1 2.676 0.030 . 1 . . . . A 74 ASP HB2 . 36589 1 893 . 1 . 1 74 74 ASP HB3 H 1 2.676 0.030 . 1 . . . . A 74 ASP HB3 . 36589 1 894 . 1 . 1 74 74 ASP C C 13 178.705 0.300 . 1 . . . . A 74 ASP C . 36589 1 895 . 1 . 1 74 74 ASP CA C 13 57.723 0.300 . 1 . . . . A 74 ASP CA . 36589 1 896 . 1 . 1 74 74 ASP CB C 13 40.104 0.300 . 1 . . . . A 74 ASP CB . 36589 1 897 . 1 . 1 74 74 ASP N N 15 116.669 0.300 . 1 . . . . A 74 ASP N . 36589 1 898 . 1 . 1 75 75 ALA H H 1 7.764 0.030 . 1 . . . . A 75 ALA H . 36589 1 899 . 1 . 1 75 75 ALA HA H 1 4.322 0.030 . 1 . . . . A 75 ALA HA . 36589 1 900 . 1 . 1 75 75 ALA HB1 H 1 1.607 0.030 . 1 . . . . A 75 ALA HB1 . 36589 1 901 . 1 . 1 75 75 ALA HB2 H 1 1.607 0.030 . 1 . . . . A 75 ALA HB2 . 36589 1 902 . 1 . 1 75 75 ALA HB3 H 1 1.607 0.030 . 1 . . . . A 75 ALA HB3 . 36589 1 903 . 1 . 1 75 75 ALA C C 13 180.612 0.300 . 1 . . . . A 75 ALA C . 36589 1 904 . 1 . 1 75 75 ALA CA C 13 54.732 0.300 . 1 . . . . A 75 ALA CA . 36589 1 905 . 1 . 1 75 75 ALA CB C 13 18.919 0.300 . 1 . . . . A 75 ALA CB . 36589 1 906 . 1 . 1 75 75 ALA N N 15 124.249 0.300 . 1 . . . . A 75 ALA N . 36589 1 907 . 1 . 1 76 76 LYS H H 1 7.995 0.030 . 1 . . . . A 76 LYS H . 36589 1 908 . 1 . 1 76 76 LYS HA H 1 3.474 0.030 . 1 . . . . A 76 LYS HA . 36589 1 909 . 1 . 1 76 76 LYS HB2 H 1 0.961 0.030 . 2 . . . . A 76 LYS HB2 . 36589 1 910 . 1 . 1 76 76 LYS HB3 H 1 1.696 0.030 . 2 . . . . A 76 LYS HB3 . 36589 1 911 . 1 . 1 76 76 LYS HG2 H 1 0.912 0.030 . 2 . . . . A 76 LYS HG2 . 36589 1 912 . 1 . 1 76 76 LYS HG3 H 1 -0.572 0.030 . 2 . . . . A 76 LYS HG3 . 36589 1 913 . 1 . 1 76 76 LYS HD2 H 1 1.059 0.030 . 2 . . . . A 76 LYS HD2 . 36589 1 914 . 1 . 1 76 76 LYS HD3 H 1 0.926 0.030 . 2 . . . . A 76 LYS HD3 . 36589 1 915 . 1 . 1 76 76 LYS HE2 H 1 2.475 0.030 . 2 . . . . A 76 LYS HE2 . 36589 1 916 . 1 . 1 76 76 LYS HE3 H 1 2.557 0.030 . 2 . . . . A 76 LYS HE3 . 36589 1 917 . 1 . 1 76 76 LYS C C 13 178.345 0.300 . 1 . . . . A 76 LYS C . 36589 1 918 . 1 . 1 76 76 LYS CA C 13 59.914 0.300 . 1 . . . . A 76 LYS CA . 36589 1 919 . 1 . 1 76 76 LYS CB C 13 34.162 0.300 . 1 . . . . A 76 LYS CB . 36589 1 920 . 1 . 1 76 76 LYS CG C 13 25.111 0.300 . 1 . . . . A 76 LYS CG . 36589 1 921 . 1 . 1 76 76 LYS CD C 13 30.595 0.300 . 1 . . . . A 76 LYS CD . 36589 1 922 . 1 . 1 76 76 LYS CE C 13 41.900 0.300 . 1 . . . . A 76 LYS CE . 36589 1 923 . 1 . 1 76 76 LYS N N 15 120.518 0.300 . 1 . . . . A 76 LYS N . 36589 1 924 . 1 . 1 77 77 ILE H H 1 8.168 0.030 . 1 . . . . A 77 ILE H . 36589 1 925 . 1 . 1 77 77 ILE HA H 1 3.561 0.030 . 1 . . . . A 77 ILE HA . 36589 1 926 . 1 . 1 77 77 ILE HB H 1 2.050 0.030 . 1 . . . . A 77 ILE HB . 36589 1 927 . 1 . 1 77 77 ILE HG12 H 1 1.924 0.030 . 2 . . . . A 77 ILE HG12 . 36589 1 928 . 1 . 1 77 77 ILE HG13 H 1 0.817 0.030 . 2 . . . . A 77 ILE HG13 . 36589 1 929 . 1 . 1 77 77 ILE HG21 H 1 1.017 0.030 . 1 . . . . A 77 ILE HG21 . 36589 1 930 . 1 . 1 77 77 ILE HG22 H 1 1.017 0.030 . 1 . . . . A 77 ILE HG22 . 36589 1 931 . 1 . 1 77 77 ILE HG23 H 1 1.017 0.030 . 1 . . . . A 77 ILE HG23 . 36589 1 932 . 1 . 1 77 77 ILE HD11 H 1 0.926 0.030 . 1 . . . . A 77 ILE HD11 . 36589 1 933 . 1 . 1 77 77 ILE HD12 H 1 0.926 0.030 . 1 . . . . A 77 ILE HD12 . 36589 1 934 . 1 . 1 77 77 ILE HD13 H 1 0.926 0.030 . 1 . . . . A 77 ILE HD13 . 36589 1 935 . 1 . 1 77 77 ILE C C 13 177.684 0.300 . 1 . . . . A 77 ILE C . 36589 1 936 . 1 . 1 77 77 ILE CA C 13 65.902 0.300 . 1 . . . . A 77 ILE CA . 36589 1 937 . 1 . 1 77 77 ILE CB C 13 37.769 0.300 . 1 . . . . A 77 ILE CB . 36589 1 938 . 1 . 1 77 77 ILE CG1 C 13 30.747 0.300 . 1 . . . . A 77 ILE CG1 . 36589 1 939 . 1 . 1 77 77 ILE CG2 C 13 16.902 0.300 . 1 . . . . A 77 ILE CG2 . 36589 1 940 . 1 . 1 77 77 ILE CD1 C 13 13.367 0.300 . 1 . . . . A 77 ILE CD1 . 36589 1 941 . 1 . 1 77 77 ILE N N 15 118.654 0.300 . 1 . . . . A 77 ILE N . 36589 1 942 . 1 . 1 78 78 SER H H 1 8.193 0.030 . 1 . . . . A 78 SER H . 36589 1 943 . 1 . 1 78 78 SER HA H 1 4.341 0.030 . 1 . . . . A 78 SER HA . 36589 1 944 . 1 . 1 78 78 SER HB2 H 1 4.112 0.030 . 2 . . . . A 78 SER HB2 . 36589 1 945 . 1 . 1 78 78 SER HB3 H 1 4.069 0.030 . 2 . . . . A 78 SER HB3 . 36589 1 946 . 1 . 1 78 78 SER C C 13 176.396 0.300 . 1 . . . . A 78 SER C . 36589 1 947 . 1 . 1 78 78 SER CA C 13 61.625 0.300 . 1 . . . . A 78 SER CA . 36589 1 948 . 1 . 1 78 78 SER CB C 13 63.072 0.300 . 1 . . . . A 78 SER CB . 36589 1 949 . 1 . 1 78 78 SER N N 15 114.385 0.300 . 1 . . . . A 78 SER N . 36589 1 950 . 1 . 1 79 79 PHE H H 1 8.299 0.030 . 1 . . . . A 79 PHE H . 36589 1 951 . 1 . 1 79 79 PHE HA H 1 4.440 0.030 . 1 . . . . A 79 PHE HA . 36589 1 952 . 1 . 1 79 79 PHE HB2 H 1 3.511 0.030 . 2 . . . . A 79 PHE HB2 . 36589 1 953 . 1 . 1 79 79 PHE HB3 H 1 3.625 0.030 . 2 . . . . A 79 PHE HB3 . 36589 1 954 . 1 . 1 79 79 PHE HD1 H 1 6.993 0.030 . 1 . . . . A 79 PHE HD1 . 36589 1 955 . 1 . 1 79 79 PHE HD2 H 1 6.993 0.030 . 1 . . . . A 79 PHE HD2 . 36589 1 956 . 1 . 1 79 79 PHE HE1 H 1 6.063 0.030 . 1 . . . . A 79 PHE HE1 . 36589 1 957 . 1 . 1 79 79 PHE HE2 H 1 6.063 0.030 . 1 . . . . A 79 PHE HE2 . 36589 1 958 . 1 . 1 79 79 PHE HZ H 1 6.396 0.030 . 1 . . . . A 79 PHE HZ . 36589 1 959 . 1 . 1 79 79 PHE C C 13 179.072 0.300 . 1 . . . . A 79 PHE C . 36589 1 960 . 1 . 1 79 79 PHE CA C 13 61.909 0.300 . 1 . . . . A 79 PHE CA . 36589 1 961 . 1 . 1 79 79 PHE CB C 13 40.098 0.300 . 1 . . . . A 79 PHE CB . 36589 1 962 . 1 . 1 79 79 PHE CD1 C 13 131.591 0.300 . 1 . . . . A 79 PHE CD1 . 36589 1 963 . 1 . 1 79 79 PHE CD2 C 13 131.591 0.300 . 1 . . . . A 79 PHE CD2 . 36589 1 964 . 1 . 1 79 79 PHE CE1 C 13 130.259 0.300 . 1 . . . . A 79 PHE CE1 . 36589 1 965 . 1 . 1 79 79 PHE CE2 C 13 130.259 0.300 . 1 . . . . A 79 PHE CE2 . 36589 1 966 . 1 . 1 79 79 PHE CZ C 13 130.321 0.300 . 1 . . . . A 79 PHE CZ . 36589 1 967 . 1 . 1 79 79 PHE N N 15 120.984 0.300 . 1 . . . . A 79 PHE N . 36589 1 968 . 1 . 1 80 80 LEU H H 1 8.153 0.030 . 1 . . . . A 80 LEU H . 36589 1 969 . 1 . 1 80 80 LEU HA H 1 4.206 0.030 . 1 . . . . A 80 LEU HA . 36589 1 970 . 1 . 1 80 80 LEU HB2 H 1 1.329 0.030 . 2 . . . . A 80 LEU HB2 . 36589 1 971 . 1 . 1 80 80 LEU HB3 H 1 2.212 0.030 . 2 . . . . A 80 LEU HB3 . 36589 1 972 . 1 . 1 80 80 LEU HG H 1 2.424 0.030 . 1 . . . . A 80 LEU HG . 36589 1 973 . 1 . 1 80 80 LEU HD11 H 1 1.158 0.030 . 2 . . . . A 80 LEU HD11 . 36589 1 974 . 1 . 1 80 80 LEU HD12 H 1 1.158 0.030 . 2 . . . . A 80 LEU HD12 . 36589 1 975 . 1 . 1 80 80 LEU HD13 H 1 1.158 0.030 . 2 . . . . A 80 LEU HD13 . 36589 1 976 . 1 . 1 80 80 LEU HD21 H 1 0.982 0.030 . 2 . . . . A 80 LEU HD21 . 36589 1 977 . 1 . 1 80 80 LEU HD22 H 1 0.982 0.030 . 2 . . . . A 80 LEU HD22 . 36589 1 978 . 1 . 1 80 80 LEU HD23 H 1 0.982 0.030 . 2 . . . . A 80 LEU HD23 . 36589 1 979 . 1 . 1 80 80 LEU C C 13 177.517 0.300 . 1 . . . . A 80 LEU C . 36589 1 980 . 1 . 1 80 80 LEU CA C 13 57.225 0.300 . 1 . . . . A 80 LEU CA . 36589 1 981 . 1 . 1 80 80 LEU CB C 13 42.941 0.300 . 1 . . . . A 80 LEU CB . 36589 1 982 . 1 . 1 80 80 LEU CG C 13 27.879 0.300 . 1 . . . . A 80 LEU CG . 36589 1 983 . 1 . 1 80 80 LEU CD1 C 13 27.308 0.300 . 2 . . . . A 80 LEU CD1 . 36589 1 984 . 1 . 1 80 80 LEU CD2 C 13 21.590 0.300 . 2 . . . . A 80 LEU CD2 . 36589 1 985 . 1 . 1 80 80 LEU N N 15 118.880 0.300 . 1 . . . . A 80 LEU N . 36589 1 986 . 1 . 1 81 81 GLN H H 1 9.281 0.030 . 1 . . . . A 81 GLN H . 36589 1 987 . 1 . 1 81 81 GLN HA H 1 3.851 0.030 . 1 . . . . A 81 GLN HA . 36589 1 988 . 1 . 1 81 81 GLN HB2 H 1 2.339 0.030 . 1 . . . . A 81 GLN HB2 . 36589 1 989 . 1 . 1 81 81 GLN HB3 H 1 2.339 0.030 . 1 . . . . A 81 GLN HB3 . 36589 1 990 . 1 . 1 81 81 GLN HG2 H 1 2.479 0.030 . 2 . . . . A 81 GLN HG2 . 36589 1 991 . 1 . 1 81 81 GLN HG3 H 1 2.355 0.030 . 2 . . . . A 81 GLN HG3 . 36589 1 992 . 1 . 1 81 81 GLN HE21 H 1 6.963 0.030 . 2 . . . . A 81 GLN HE21 . 36589 1 993 . 1 . 1 81 81 GLN HE22 H 1 8.183 0.030 . 2 . . . . A 81 GLN HE22 . 36589 1 994 . 1 . 1 81 81 GLN C C 13 177.270 0.300 . 1 . . . . A 81 GLN C . 36589 1 995 . 1 . 1 81 81 GLN CA C 13 58.661 0.300 . 1 . . . . A 81 GLN CA . 36589 1 996 . 1 . 1 81 81 GLN CB C 13 28.952 0.300 . 1 . . . . A 81 GLN CB . 36589 1 997 . 1 . 1 81 81 GLN CG C 13 33.657 0.300 . 1 . . . . A 81 GLN CG . 36589 1 998 . 1 . 1 81 81 GLN N N 15 120.482 0.300 . 1 . . . . A 81 GLN N . 36589 1 999 . 1 . 1 81 81 GLN NE2 N 15 117.168 0.300 . 1 . . . . A 81 GLN NE2 . 36589 1 1000 . 1 . 1 82 82 LYS H H 1 7.899 0.030 . 1 . . . . A 82 LYS H . 36589 1 1001 . 1 . 1 82 82 LYS HA H 1 3.970 0.030 . 1 . . . . A 82 LYS HA . 36589 1 1002 . 1 . 1 82 82 LYS HB2 H 1 1.791 0.030 . 2 . . . . A 82 LYS HB2 . 36589 1 1003 . 1 . 1 82 82 LYS HB3 H 1 1.476 0.030 . 2 . . . . A 82 LYS HB3 . 36589 1 1004 . 1 . 1 82 82 LYS HG2 H 1 1.270 0.030 . 2 . . . . A 82 LYS HG2 . 36589 1 1005 . 1 . 1 82 82 LYS HG3 H 1 1.908 0.030 . 2 . . . . A 82 LYS HG3 . 36589 1 1006 . 1 . 1 82 82 LYS HD2 H 1 1.546 0.030 . 2 . . . . A 82 LYS HD2 . 36589 1 1007 . 1 . 1 82 82 LYS HD3 H 1 1.655 0.030 . 2 . . . . A 82 LYS HD3 . 36589 1 1008 . 1 . 1 82 82 LYS HE2 H 1 2.849 0.030 . 1 . . . . A 82 LYS HE2 . 36589 1 1009 . 1 . 1 82 82 LYS HE3 H 1 2.849 0.030 . 1 . . . . A 82 LYS HE3 . 36589 1 1010 . 1 . 1 82 82 LYS C C 13 177.017 0.300 . 1 . . . . A 82 LYS C . 36589 1 1011 . 1 . 1 82 82 LYS CA C 13 60.803 0.300 . 1 . . . . A 82 LYS CA . 36589 1 1012 . 1 . 1 82 82 LYS CB C 13 32.956 0.300 . 1 . . . . A 82 LYS CB . 36589 1 1013 . 1 . 1 82 82 LYS CG C 13 27.312 0.300 . 1 . . . . A 82 LYS CG . 36589 1 1014 . 1 . 1 82 82 LYS CD C 13 30.168 0.300 . 1 . . . . A 82 LYS CD . 36589 1 1015 . 1 . 1 82 82 LYS CE C 13 42.208 0.300 . 1 . . . . A 82 LYS CE . 36589 1 1016 . 1 . 1 82 82 LYS N N 15 116.467 0.300 . 1 . . . . A 82 LYS N . 36589 1 1017 . 1 . 1 83 83 ALA H H 1 6.593 0.030 . 1 . . . . A 83 ALA H . 36589 1 1018 . 1 . 1 83 83 ALA HA H 1 3.900 0.030 . 1 . . . . A 83 ALA HA . 36589 1 1019 . 1 . 1 83 83 ALA HB1 H 1 1.457 0.030 . 1 . . . . A 83 ALA HB1 . 36589 1 1020 . 1 . 1 83 83 ALA HB2 H 1 1.457 0.030 . 1 . . . . A 83 ALA HB2 . 36589 1 1021 . 1 . 1 83 83 ALA HB3 H 1 1.457 0.030 . 1 . . . . A 83 ALA HB3 . 36589 1 1022 . 1 . 1 83 83 ALA C C 13 179.082 0.300 . 1 . . . . A 83 ALA C . 36589 1 1023 . 1 . 1 83 83 ALA CA C 13 55.317 0.300 . 1 . . . . A 83 ALA CA . 36589 1 1024 . 1 . 1 83 83 ALA CB C 13 16.872 0.300 . 1 . . . . A 83 ALA CB . 36589 1 1025 . 1 . 1 83 83 ALA N N 15 118.570 0.300 . 1 . . . . A 83 ALA N . 36589 1 1026 . 1 . 1 84 84 ILE H H 1 8.280 0.030 . 1 . . . . A 84 ILE H . 36589 1 1027 . 1 . 1 84 84 ILE HA H 1 3.343 0.030 . 1 . . . . A 84 ILE HA . 36589 1 1028 . 1 . 1 84 84 ILE HB H 1 1.891 0.030 . 1 . . . . A 84 ILE HB . 36589 1 1029 . 1 . 1 84 84 ILE HG12 H 1 0.867 0.030 . 2 . . . . A 84 ILE HG12 . 36589 1 1030 . 1 . 1 84 84 ILE HG13 H 1 1.870 0.030 . 2 . . . . A 84 ILE HG13 . 36589 1 1031 . 1 . 1 84 84 ILE HG21 H 1 0.998 0.030 . 1 . . . . A 84 ILE HG21 . 36589 1 1032 . 1 . 1 84 84 ILE HG22 H 1 0.998 0.030 . 1 . . . . A 84 ILE HG22 . 36589 1 1033 . 1 . 1 84 84 ILE HG23 H 1 0.998 0.030 . 1 . . . . A 84 ILE HG23 . 36589 1 1034 . 1 . 1 84 84 ILE HD11 H 1 0.760 0.030 . 1 . . . . A 84 ILE HD11 . 36589 1 1035 . 1 . 1 84 84 ILE HD12 H 1 0.760 0.030 . 1 . . . . A 84 ILE HD12 . 36589 1 1036 . 1 . 1 84 84 ILE HD13 H 1 0.760 0.030 . 1 . . . . A 84 ILE HD13 . 36589 1 1037 . 1 . 1 84 84 ILE C C 13 176.717 0.300 . 1 . . . . A 84 ILE C . 36589 1 1038 . 1 . 1 84 84 ILE CA C 13 66.309 0.300 . 1 . . . . A 84 ILE CA . 36589 1 1039 . 1 . 1 84 84 ILE CB C 13 38.904 0.300 . 1 . . . . A 84 ILE CB . 36589 1 1040 . 1 . 1 84 84 ILE CG1 C 13 31.222 0.300 . 1 . . . . A 84 ILE CG1 . 36589 1 1041 . 1 . 1 84 84 ILE CG2 C 13 17.080 0.300 . 1 . . . . A 84 ILE CG2 . 36589 1 1042 . 1 . 1 84 84 ILE CD1 C 13 14.101 0.300 . 1 . . . . A 84 ILE CD1 . 36589 1 1043 . 1 . 1 84 84 ILE N N 15 117.093 0.300 . 1 . . . . A 84 ILE N . 36589 1 1044 . 1 . 1 85 85 ASP H H 1 8.760 0.030 . 1 . . . . A 85 ASP H . 36589 1 1045 . 1 . 1 85 85 ASP HA H 1 4.378 0.030 . 1 . . . . A 85 ASP HA . 36589 1 1046 . 1 . 1 85 85 ASP HB2 H 1 2.518 0.030 . 2 . . . . A 85 ASP HB2 . 36589 1 1047 . 1 . 1 85 85 ASP HB3 H 1 2.870 0.030 . 2 . . . . A 85 ASP HB3 . 36589 1 1048 . 1 . 1 85 85 ASP C C 13 180.149 0.300 . 1 . . . . A 85 ASP C . 36589 1 1049 . 1 . 1 85 85 ASP CA C 13 57.778 0.300 . 1 . . . . A 85 ASP CA . 36589 1 1050 . 1 . 1 85 85 ASP CB C 13 40.505 0.300 . 1 . . . . A 85 ASP CB . 36589 1 1051 . 1 . 1 85 85 ASP N N 15 118.547 0.300 . 1 . . . . A 85 ASP N . 36589 1 1052 . 1 . 1 86 86 VAL H H 1 7.966 0.030 . 1 . . . . A 86 VAL H . 36589 1 1053 . 1 . 1 86 86 VAL HA H 1 3.561 0.030 . 1 . . . . A 86 VAL HA . 36589 1 1054 . 1 . 1 86 86 VAL HB H 1 2.139 0.030 . 1 . . . . A 86 VAL HB . 36589 1 1055 . 1 . 1 86 86 VAL HG11 H 1 0.965 0.030 . 2 . . . . A 86 VAL HG11 . 36589 1 1056 . 1 . 1 86 86 VAL HG12 H 1 0.965 0.030 . 2 . . . . A 86 VAL HG12 . 36589 1 1057 . 1 . 1 86 86 VAL HG13 H 1 0.965 0.030 . 2 . . . . A 86 VAL HG13 . 36589 1 1058 . 1 . 1 86 86 VAL HG21 H 1 0.630 0.030 . 2 . . . . A 86 VAL HG21 . 36589 1 1059 . 1 . 1 86 86 VAL HG22 H 1 0.630 0.030 . 2 . . . . A 86 VAL HG22 . 36589 1 1060 . 1 . 1 86 86 VAL HG23 H 1 0.630 0.030 . 2 . . . . A 86 VAL HG23 . 36589 1 1061 . 1 . 1 86 86 VAL C C 13 177.029 0.300 . 1 . . . . A 86 VAL C . 36589 1 1062 . 1 . 1 86 86 VAL CA C 13 67.093 0.300 . 1 . . . . A 86 VAL CA . 36589 1 1063 . 1 . 1 86 86 VAL CB C 13 31.363 0.300 . 1 . . . . A 86 VAL CB . 36589 1 1064 . 1 . 1 86 86 VAL CG1 C 13 26.378 0.300 . 2 . . . . A 86 VAL CG1 . 36589 1 1065 . 1 . 1 86 86 VAL CG2 C 13 22.089 0.300 . 2 . . . . A 86 VAL CG2 . 36589 1 1066 . 1 . 1 86 86 VAL N N 15 119.149 0.300 . 1 . . . . A 86 VAL N . 36589 1 1067 . 1 . 1 87 87 VAL H H 1 8.711 0.030 . 1 . . . . A 87 VAL H . 36589 1 1068 . 1 . 1 87 87 VAL HA H 1 3.671 0.030 . 1 . . . . A 87 VAL HA . 36589 1 1069 . 1 . 1 87 87 VAL HB H 1 2.229 0.030 . 1 . . . . A 87 VAL HB . 36589 1 1070 . 1 . 1 87 87 VAL HG11 H 1 1.247 0.030 . 2 . . . . A 87 VAL HG11 . 36589 1 1071 . 1 . 1 87 87 VAL HG12 H 1 1.247 0.030 . 2 . . . . A 87 VAL HG12 . 36589 1 1072 . 1 . 1 87 87 VAL HG13 H 1 1.247 0.030 . 2 . . . . A 87 VAL HG13 . 36589 1 1073 . 1 . 1 87 87 VAL HG21 H 1 1.055 0.030 . 2 . . . . A 87 VAL HG21 . 36589 1 1074 . 1 . 1 87 87 VAL HG22 H 1 1.055 0.030 . 2 . . . . A 87 VAL HG22 . 36589 1 1075 . 1 . 1 87 87 VAL HG23 H 1 1.055 0.030 . 2 . . . . A 87 VAL HG23 . 36589 1 1076 . 1 . 1 87 87 VAL C C 13 180.200 0.300 . 1 . . . . A 87 VAL C . 36589 1 1077 . 1 . 1 87 87 VAL CA C 13 67.796 0.300 . 1 . . . . A 87 VAL CA . 36589 1 1078 . 1 . 1 87 87 VAL CB C 13 31.422 0.300 . 1 . . . . A 87 VAL CB . 36589 1 1079 . 1 . 1 87 87 VAL CG1 C 13 25.085 0.300 . 2 . . . . A 87 VAL CG1 . 36589 1 1080 . 1 . 1 87 87 VAL CG2 C 13 23.083 0.300 . 2 . . . . A 87 VAL CG2 . 36589 1 1081 . 1 . 1 87 87 VAL N N 15 120.010 0.300 . 1 . . . . A 87 VAL N . 36589 1 1082 . 1 . 1 88 88 VAL H H 1 9.291 0.030 . 1 . . . . A 88 VAL H . 36589 1 1083 . 1 . 1 88 88 VAL HA H 1 3.796 0.030 . 1 . . . . A 88 VAL HA . 36589 1 1084 . 1 . 1 88 88 VAL HB H 1 2.237 0.030 . 1 . . . . A 88 VAL HB . 36589 1 1085 . 1 . 1 88 88 VAL HG11 H 1 1.310 0.030 . 2 . . . . A 88 VAL HG11 . 36589 1 1086 . 1 . 1 88 88 VAL HG12 H 1 1.310 0.030 . 2 . . . . A 88 VAL HG12 . 36589 1 1087 . 1 . 1 88 88 VAL HG13 H 1 1.310 0.030 . 2 . . . . A 88 VAL HG13 . 36589 1 1088 . 1 . 1 88 88 VAL HG21 H 1 0.933 0.030 . 2 . . . . A 88 VAL HG21 . 36589 1 1089 . 1 . 1 88 88 VAL HG22 H 1 0.933 0.030 . 2 . . . . A 88 VAL HG22 . 36589 1 1090 . 1 . 1 88 88 VAL HG23 H 1 0.933 0.030 . 2 . . . . A 88 VAL HG23 . 36589 1 1091 . 1 . 1 88 88 VAL C C 13 178.818 0.300 . 1 . . . . A 88 VAL C . 36589 1 1092 . 1 . 1 88 88 VAL CA C 13 67.202 0.300 . 1 . . . . A 88 VAL CA . 36589 1 1093 . 1 . 1 88 88 VAL CB C 13 32.328 0.300 . 1 . . . . A 88 VAL CB . 36589 1 1094 . 1 . 1 88 88 VAL CG1 C 13 23.604 0.300 . 2 . . . . A 88 VAL CG1 . 36589 1 1095 . 1 . 1 88 88 VAL CG2 C 13 20.846 0.300 . 2 . . . . A 88 VAL CG2 . 36589 1 1096 . 1 . 1 88 88 VAL N N 15 125.424 0.300 . 1 . . . . A 88 VAL N . 36589 1 1097 . 1 . 1 89 89 MET H H 1 7.627 0.030 . 1 . . . . A 89 MET H . 36589 1 1098 . 1 . 1 89 89 MET HA H 1 4.052 0.030 . 1 . . . . A 89 MET HA . 36589 1 1099 . 1 . 1 89 89 MET HB2 H 1 2.056 0.030 . 2 . . . . A 89 MET HB2 . 36589 1 1100 . 1 . 1 89 89 MET HB3 H 1 2.344 0.030 . 2 . . . . A 89 MET HB3 . 36589 1 1101 . 1 . 1 89 89 MET HG2 H 1 2.477 0.030 . 2 . . . . A 89 MET HG2 . 36589 1 1102 . 1 . 1 89 89 MET HG3 H 1 2.752 0.030 . 2 . . . . A 89 MET HG3 . 36589 1 1103 . 1 . 1 89 89 MET HE1 H 1 1.990 0.030 . 1 . . . . A 89 MET HE1 . 36589 1 1104 . 1 . 1 89 89 MET HE2 H 1 1.990 0.030 . 1 . . . . A 89 MET HE2 . 36589 1 1105 . 1 . 1 89 89 MET HE3 H 1 1.990 0.030 . 1 . . . . A 89 MET HE3 . 36589 1 1106 . 1 . 1 89 89 MET C C 13 178.869 0.300 . 1 . . . . A 89 MET C . 36589 1 1107 . 1 . 1 89 89 MET CA C 13 59.792 0.300 . 1 . . . . A 89 MET CA . 36589 1 1108 . 1 . 1 89 89 MET CB C 13 33.929 0.300 . 1 . . . . A 89 MET CB . 36589 1 1109 . 1 . 1 89 89 MET CG C 13 32.802 0.300 . 1 . . . . A 89 MET CG . 36589 1 1110 . 1 . 1 89 89 MET CE C 13 17.456 0.300 . 1 . . . . A 89 MET CE . 36589 1 1111 . 1 . 1 89 89 MET N N 15 120.157 0.300 . 1 . . . . A 89 MET N . 36589 1 1112 . 1 . 1 90 90 VAL H H 1 8.782 0.030 . 1 . . . . A 90 VAL H . 36589 1 1113 . 1 . 1 90 90 VAL HA H 1 3.873 0.030 . 1 . . . . A 90 VAL HA . 36589 1 1114 . 1 . 1 90 90 VAL HB H 1 2.181 0.030 . 1 . . . . A 90 VAL HB . 36589 1 1115 . 1 . 1 90 90 VAL HG11 H 1 1.116 0.030 . 2 . . . . A 90 VAL HG11 . 36589 1 1116 . 1 . 1 90 90 VAL HG12 H 1 1.116 0.030 . 2 . . . . A 90 VAL HG12 . 36589 1 1117 . 1 . 1 90 90 VAL HG13 H 1 1.116 0.030 . 2 . . . . A 90 VAL HG13 . 36589 1 1118 . 1 . 1 90 90 VAL HG21 H 1 1.180 0.030 . 2 . . . . A 90 VAL HG21 . 36589 1 1119 . 1 . 1 90 90 VAL HG22 H 1 1.180 0.030 . 2 . . . . A 90 VAL HG22 . 36589 1 1120 . 1 . 1 90 90 VAL HG23 H 1 1.180 0.030 . 2 . . . . A 90 VAL HG23 . 36589 1 1121 . 1 . 1 90 90 VAL C C 13 177.583 0.300 . 1 . . . . A 90 VAL C . 36589 1 1122 . 1 . 1 90 90 VAL CA C 13 65.491 0.300 . 1 . . . . A 90 VAL CA . 36589 1 1123 . 1 . 1 90 90 VAL CB C 13 33.180 0.300 . 1 . . . . A 90 VAL CB . 36589 1 1124 . 1 . 1 90 90 VAL CG1 C 13 23.297 0.300 . 2 . . . . A 90 VAL CG1 . 36589 1 1125 . 1 . 1 90 90 VAL CG2 C 13 23.858 0.300 . 2 . . . . A 90 VAL CG2 . 36589 1 1126 . 1 . 1 90 90 VAL N N 15 116.775 0.300 . 1 . . . . A 90 VAL N . 36589 1 1127 . 1 . 1 91 91 SER H H 1 8.640 0.030 . 1 . . . . A 91 SER H . 36589 1 1128 . 1 . 1 91 91 SER HA H 1 4.131 0.030 . 1 . . . . A 91 SER HA . 36589 1 1129 . 1 . 1 91 91 SER HB2 H 1 3.719 0.030 . 2 . . . . A 91 SER HB2 . 36589 1 1130 . 1 . 1 91 91 SER HB3 H 1 3.954 0.030 . 2 . . . . A 91 SER HB3 . 36589 1 1131 . 1 . 1 91 91 SER C C 13 176.010 0.300 . 1 . . . . A 91 SER C . 36589 1 1132 . 1 . 1 91 91 SER CA C 13 60.669 0.300 . 1 . . . . A 91 SER CA . 36589 1 1133 . 1 . 1 91 91 SER CB C 13 65.237 0.300 . 1 . . . . A 91 SER CB . 36589 1 1134 . 1 . 1 91 91 SER N N 15 112.837 0.300 . 1 . . . . A 91 SER N . 36589 1 1135 . 1 . 1 92 92 GLY H H 1 8.055 0.030 . 1 . . . . A 92 GLY H . 36589 1 1136 . 1 . 1 92 92 GLY HA2 H 1 3.906 0.030 . 2 . . . . A 92 GLY HA2 . 36589 1 1137 . 1 . 1 92 92 GLY HA3 H 1 4.168 0.030 . 2 . . . . A 92 GLY HA3 . 36589 1 1138 . 1 . 1 92 92 GLY C C 13 173.521 0.300 . 1 . . . . A 92 GLY C . 36589 1 1139 . 1 . 1 92 92 GLY CA C 13 46.195 0.300 . 1 . . . . A 92 GLY CA . 36589 1 1140 . 1 . 1 92 92 GLY N N 15 111.544 0.300 . 1 . . . . A 92 GLY N . 36589 1 1141 . 1 . 1 93 93 GLU H H 1 8.076 0.030 . 1 . . . . A 93 GLU H . 36589 1 1142 . 1 . 1 93 93 GLU HA H 1 4.736 0.030 . 1 . . . . A 93 GLU HA . 36589 1 1143 . 1 . 1 93 93 GLU HB2 H 1 1.978 0.030 . 2 . . . . A 93 GLU HB2 . 36589 1 1144 . 1 . 1 93 93 GLU HB3 H 1 1.832 0.030 . 2 . . . . A 93 GLU HB3 . 36589 1 1145 . 1 . 1 93 93 GLU HG2 H 1 2.138 0.030 . 1 . . . . A 93 GLU HG2 . 36589 1 1146 . 1 . 1 93 93 GLU HG3 H 1 2.138 0.030 . 1 . . . . A 93 GLU HG3 . 36589 1 1147 . 1 . 1 93 93 GLU C C 13 173.499 0.300 . 1 . . . . A 93 GLU C . 36589 1 1148 . 1 . 1 93 93 GLU CA C 13 53.379 0.300 . 1 . . . . A 93 GLU CA . 36589 1 1149 . 1 . 1 93 93 GLU CB C 13 30.740 0.300 . 1 . . . . A 93 GLU CB . 36589 1 1150 . 1 . 1 93 93 GLU CG C 13 35.888 0.300 . 1 . . . . A 93 GLU CG . 36589 1 1151 . 1 . 1 93 93 GLU N N 15 121.749 0.300 . 1 . . . . A 93 GLU N . 36589 1 1152 . 1 . 1 94 94 PRO HA H 1 4.550 0.030 . 1 . . . . A 94 PRO HA . 36589 1 1153 . 1 . 1 94 94 PRO HB2 H 1 1.962 0.030 . 2 . . . . A 94 PRO HB2 . 36589 1 1154 . 1 . 1 94 94 PRO HB3 H 1 2.072 0.030 . 2 . . . . A 94 PRO HB3 . 36589 1 1155 . 1 . 1 94 94 PRO HG2 H 1 2.029 0.030 . 1 . . . . A 94 PRO HG2 . 36589 1 1156 . 1 . 1 94 94 PRO HG3 H 1 2.029 0.030 . 1 . . . . A 94 PRO HG3 . 36589 1 1157 . 1 . 1 94 94 PRO HD2 H 1 3.729 0.030 . 2 . . . . A 94 PRO HD2 . 36589 1 1158 . 1 . 1 94 94 PRO HD3 H 1 3.818 0.030 . 2 . . . . A 94 PRO HD3 . 36589 1 1159 . 1 . 1 94 94 PRO C C 13 176.108 0.300 . 1 . . . . A 94 PRO C . 36589 1 1160 . 1 . 1 94 94 PRO CA C 13 62.021 0.300 . 1 . . . . A 94 PRO CA . 36589 1 1161 . 1 . 1 94 94 PRO CB C 13 30.717 0.300 . 1 . . . . A 94 PRO CB . 36589 1 1162 . 1 . 1 94 94 PRO CG C 13 27.406 0.300 . 1 . . . . A 94 PRO CG . 36589 1 1163 . 1 . 1 94 94 PRO CD C 13 50.243 0.300 . 1 . . . . A 94 PRO CD . 36589 1 1164 . 1 . 1 95 95 LEU H H 1 7.893 0.030 . 1 . . . . A 95 LEU H . 36589 1 1165 . 1 . 1 95 95 LEU HA H 1 4.517 0.030 . 1 . . . . A 95 LEU HA . 36589 1 1166 . 1 . 1 95 95 LEU HB2 H 1 1.578 0.030 . 1 . . . . A 95 LEU HB2 . 36589 1 1167 . 1 . 1 95 95 LEU HB3 H 1 1.578 0.030 . 1 . . . . A 95 LEU HB3 . 36589 1 1168 . 1 . 1 95 95 LEU HG H 1 1.690 0.030 . 1 . . . . A 95 LEU HG . 36589 1 1169 . 1 . 1 95 95 LEU HD11 H 1 0.937 0.030 . 2 . . . . A 95 LEU HD11 . 36589 1 1170 . 1 . 1 95 95 LEU HD12 H 1 0.937 0.030 . 2 . . . . A 95 LEU HD12 . 36589 1 1171 . 1 . 1 95 95 LEU HD13 H 1 0.937 0.030 . 2 . . . . A 95 LEU HD13 . 36589 1 1172 . 1 . 1 95 95 LEU HD21 H 1 0.976 0.030 . 2 . . . . A 95 LEU HD21 . 36589 1 1173 . 1 . 1 95 95 LEU HD22 H 1 0.976 0.030 . 2 . . . . A 95 LEU HD22 . 36589 1 1174 . 1 . 1 95 95 LEU HD23 H 1 0.976 0.030 . 2 . . . . A 95 LEU HD23 . 36589 1 1175 . 1 . 1 95 95 LEU C C 13 177.481 0.300 . 1 . . . . A 95 LEU C . 36589 1 1176 . 1 . 1 95 95 LEU CA C 13 54.461 0.300 . 1 . . . . A 95 LEU CA . 36589 1 1177 . 1 . 1 95 95 LEU CB C 13 44.077 0.300 . 1 . . . . A 95 LEU CB . 36589 1 1178 . 1 . 1 95 95 LEU CG C 13 27.172 0.300 . 1 . . . . A 95 LEU CG . 36589 1 1179 . 1 . 1 95 95 LEU CD1 C 13 25.009 0.300 . 2 . . . . A 95 LEU CD1 . 36589 1 1180 . 1 . 1 95 95 LEU CD2 C 13 26.329 0.300 . 2 . . . . A 95 LEU CD2 . 36589 1 1181 . 1 . 1 95 95 LEU N N 15 121.941 0.300 . 1 . . . . A 95 LEU N . 36589 1 1182 . 1 . 1 96 96 LEU H H 1 8.737 0.030 . 1 . . . . A 96 LEU H . 36589 1 1183 . 1 . 1 96 96 LEU HA H 1 4.426 0.030 . 1 . . . . A 96 LEU HA . 36589 1 1184 . 1 . 1 96 96 LEU HB2 H 1 1.667 0.030 . 2 . . . . A 96 LEU HB2 . 36589 1 1185 . 1 . 1 96 96 LEU HB3 H 1 1.559 0.030 . 2 . . . . A 96 LEU HB3 . 36589 1 1186 . 1 . 1 96 96 LEU HG H 1 1.716 0.030 . 1 . . . . A 96 LEU HG . 36589 1 1187 . 1 . 1 96 96 LEU HD11 H 1 0.932 0.030 . 2 . . . . A 96 LEU HD11 . 36589 1 1188 . 1 . 1 96 96 LEU HD12 H 1 0.932 0.030 . 2 . . . . A 96 LEU HD12 . 36589 1 1189 . 1 . 1 96 96 LEU HD13 H 1 0.932 0.030 . 2 . . . . A 96 LEU HD13 . 36589 1 1190 . 1 . 1 96 96 LEU HD21 H 1 0.870 0.030 . 2 . . . . A 96 LEU HD21 . 36589 1 1191 . 1 . 1 96 96 LEU HD22 H 1 0.870 0.030 . 2 . . . . A 96 LEU HD22 . 36589 1 1192 . 1 . 1 96 96 LEU HD23 H 1 0.870 0.030 . 2 . . . . A 96 LEU HD23 . 36589 1 1193 . 1 . 1 96 96 LEU C C 13 177.135 0.300 . 1 . . . . A 96 LEU C . 36589 1 1194 . 1 . 1 96 96 LEU CA C 13 54.830 0.300 . 1 . . . . A 96 LEU CA . 36589 1 1195 . 1 . 1 96 96 LEU CB C 13 42.360 0.300 . 1 . . . . A 96 LEU CB . 36589 1 1196 . 1 . 1 96 96 LEU CG C 13 27.446 0.300 . 1 . . . . A 96 LEU CG . 36589 1 1197 . 1 . 1 96 96 LEU CD1 C 13 25.030 0.300 . 2 . . . . A 96 LEU CD1 . 36589 1 1198 . 1 . 1 96 96 LEU CD2 C 13 22.855 0.300 . 2 . . . . A 96 LEU CD2 . 36589 1 1199 . 1 . 1 96 96 LEU N N 15 123.122 0.300 . 1 . . . . A 96 LEU N . 36589 1 1200 . 1 . 1 97 97 ALA H H 1 7.503 0.030 . 1 . . . . A 97 ALA H . 36589 1 1201 . 1 . 1 97 97 ALA HA H 1 4.501 0.030 . 1 . . . . A 97 ALA HA . 36589 1 1202 . 1 . 1 97 97 ALA HB1 H 1 1.186 0.030 . 1 . . . . A 97 ALA HB1 . 36589 1 1203 . 1 . 1 97 97 ALA HB2 H 1 1.186 0.030 . 1 . . . . A 97 ALA HB2 . 36589 1 1204 . 1 . 1 97 97 ALA HB3 H 1 1.186 0.030 . 1 . . . . A 97 ALA HB3 . 36589 1 1205 . 1 . 1 97 97 ALA C C 13 175.910 0.300 . 1 . . . . A 97 ALA C . 36589 1 1206 . 1 . 1 97 97 ALA CA C 13 52.137 0.300 . 1 . . . . A 97 ALA CA . 36589 1 1207 . 1 . 1 97 97 ALA CB C 13 18.722 0.300 . 1 . . . . A 97 ALA CB . 36589 1 1208 . 1 . 1 97 97 ALA N N 15 121.726 0.300 . 1 . . . . A 97 ALA N . 36589 1 1209 . 1 . 1 98 98 LYS H H 1 9.528 0.030 . 1 . . . . A 98 LYS H . 36589 1 1210 . 1 . 1 98 98 LYS HA H 1 5.077 0.030 . 1 . . . . A 98 LYS HA . 36589 1 1211 . 1 . 1 98 98 LYS HB2 H 1 2.017 0.030 . 2 . . . . A 98 LYS HB2 . 36589 1 1212 . 1 . 1 98 98 LYS HB3 H 1 1.775 0.030 . 2 . . . . A 98 LYS HB3 . 36589 1 1213 . 1 . 1 98 98 LYS HG2 H 1 1.645 0.030 . 1 . . . . A 98 LYS HG2 . 36589 1 1214 . 1 . 1 98 98 LYS HG3 H 1 1.645 0.030 . 1 . . . . A 98 LYS HG3 . 36589 1 1215 . 1 . 1 98 98 LYS HD2 H 1 1.740 0.030 . 2 . . . . A 98 LYS HD2 . 36589 1 1216 . 1 . 1 98 98 LYS HD3 H 1 1.808 0.030 . 2 . . . . A 98 LYS HD3 . 36589 1 1217 . 1 . 1 98 98 LYS HE2 H 1 3.106 0.030 . 1 . . . . A 98 LYS HE2 . 36589 1 1218 . 1 . 1 98 98 LYS HE3 H 1 3.106 0.030 . 1 . . . . A 98 LYS HE3 . 36589 1 1219 . 1 . 1 98 98 LYS C C 13 176.010 0.300 . 1 . . . . A 98 LYS C . 36589 1 1220 . 1 . 1 98 98 LYS CA C 13 51.502 0.300 . 1 . . . . A 98 LYS CA . 36589 1 1221 . 1 . 1 98 98 LYS CB C 13 34.102 0.300 . 1 . . . . A 98 LYS CB . 36589 1 1222 . 1 . 1 98 98 LYS CG C 13 24.249 0.300 . 1 . . . . A 98 LYS CG . 36589 1 1223 . 1 . 1 98 98 LYS CD C 13 29.109 0.300 . 1 . . . . A 98 LYS CD . 36589 1 1224 . 1 . 1 98 98 LYS CE C 13 42.547 0.300 . 1 . . . . A 98 LYS CE . 36589 1 1225 . 1 . 1 98 98 LYS N N 15 121.829 0.300 . 1 . . . . A 98 LYS N . 36589 1 1226 . 1 . 1 99 99 PRO HA H 1 4.076 0.030 . 1 . . . . A 99 PRO HA . 36589 1 1227 . 1 . 1 99 99 PRO HB2 H 1 2.472 0.030 . 2 . . . . A 99 PRO HB2 . 36589 1 1228 . 1 . 1 99 99 PRO HB3 H 1 2.345 0.030 . 2 . . . . A 99 PRO HB3 . 36589 1 1229 . 1 . 1 99 99 PRO HG2 H 1 1.771 0.030 . 2 . . . . A 99 PRO HG2 . 36589 1 1230 . 1 . 1 99 99 PRO HG3 H 1 2.368 0.030 . 2 . . . . A 99 PRO HG3 . 36589 1 1231 . 1 . 1 99 99 PRO HD2 H 1 3.865 0.030 . 2 . . . . A 99 PRO HD2 . 36589 1 1232 . 1 . 1 99 99 PRO HD3 H 1 4.105 0.030 . 2 . . . . A 99 PRO HD3 . 36589 1 1233 . 1 . 1 99 99 PRO C C 13 176.407 0.300 . 1 . . . . A 99 PRO C . 36589 1 1234 . 1 . 1 99 99 PRO CA C 13 66.407 0.300 . 1 . . . . A 99 PRO CA . 36589 1 1235 . 1 . 1 99 99 PRO CB C 13 33.933 0.300 . 1 . . . . A 99 PRO CB . 36589 1 1236 . 1 . 1 99 99 PRO CG C 13 27.895 0.300 . 1 . . . . A 99 PRO CG . 36589 1 1237 . 1 . 1 99 99 PRO CD C 13 51.125 0.300 . 1 . . . . A 99 PRO CD . 36589 1 1238 . 1 . 1 100 100 ALA H H 1 9.264 0.030 . 1 . . . . A 100 ALA H . 36589 1 1239 . 1 . 1 100 100 ALA HA H 1 3.960 0.030 . 1 . . . . A 100 ALA HA . 36589 1 1240 . 1 . 1 100 100 ALA HB1 H 1 1.497 0.030 . 1 . . . . A 100 ALA HB1 . 36589 1 1241 . 1 . 1 100 100 ALA HB2 H 1 1.497 0.030 . 1 . . . . A 100 ALA HB2 . 36589 1 1242 . 1 . 1 100 100 ALA HB3 H 1 1.497 0.030 . 1 . . . . A 100 ALA HB3 . 36589 1 1243 . 1 . 1 100 100 ALA C C 13 180.721 0.300 . 1 . . . . A 100 ALA C . 36589 1 1244 . 1 . 1 100 100 ALA CA C 13 55.728 0.300 . 1 . . . . A 100 ALA CA . 36589 1 1245 . 1 . 1 100 100 ALA CB C 13 18.610 0.300 . 1 . . . . A 100 ALA CB . 36589 1 1246 . 1 . 1 100 100 ALA N N 15 117.628 0.300 . 1 . . . . A 100 ALA N . 36589 1 1247 . 1 . 1 101 101 ARG H H 1 7.337 0.030 . 1 . . . . A 101 ARG H . 36589 1 1248 . 1 . 1 101 101 ARG HA H 1 4.256 0.030 . 1 . . . . A 101 ARG HA . 36589 1 1249 . 1 . 1 101 101 ARG HB2 H 1 1.741 0.030 . 2 . . . . A 101 ARG HB2 . 36589 1 1250 . 1 . 1 101 101 ARG HB3 H 1 2.589 0.030 . 2 . . . . A 101 ARG HB3 . 36589 1 1251 . 1 . 1 101 101 ARG HG2 H 1 1.879 0.030 . 2 . . . . A 101 ARG HG2 . 36589 1 1252 . 1 . 1 101 101 ARG HG3 H 1 1.794 0.030 . 2 . . . . A 101 ARG HG3 . 36589 1 1253 . 1 . 1 101 101 ARG HD2 H 1 3.230 0.030 . 1 . . . . A 101 ARG HD2 . 36589 1 1254 . 1 . 1 101 101 ARG HD3 H 1 3.230 0.030 . 1 . . . . A 101 ARG HD3 . 36589 1 1255 . 1 . 1 101 101 ARG C C 13 177.885 0.300 . 1 . . . . A 101 ARG C . 36589 1 1256 . 1 . 1 101 101 ARG CA C 13 58.141 0.300 . 1 . . . . A 101 ARG CA . 36589 1 1257 . 1 . 1 101 101 ARG CB C 13 29.245 0.300 . 1 . . . . A 101 ARG CB . 36589 1 1258 . 1 . 1 101 101 ARG CG C 13 27.071 0.300 . 1 . . . . A 101 ARG CG . 36589 1 1259 . 1 . 1 101 101 ARG CD C 13 42.861 0.300 . 1 . . . . A 101 ARG CD . 36589 1 1260 . 1 . 1 101 101 ARG N N 15 115.478 0.300 . 1 . . . . A 101 ARG N . 36589 1 1261 . 1 . 1 102 102 ILE H H 1 8.012 0.030 . 1 . . . . A 102 ILE H . 36589 1 1262 . 1 . 1 102 102 ILE HA H 1 3.787 0.030 . 1 . . . . A 102 ILE HA . 36589 1 1263 . 1 . 1 102 102 ILE HB H 1 1.993 0.030 . 1 . . . . A 102 ILE HB . 36589 1 1264 . 1 . 1 102 102 ILE HG12 H 1 1.840 0.030 . 2 . . . . A 102 ILE HG12 . 36589 1 1265 . 1 . 1 102 102 ILE HG13 H 1 1.527 0.030 . 2 . . . . A 102 ILE HG13 . 36589 1 1266 . 1 . 1 102 102 ILE HG21 H 1 0.939 0.030 . 1 . . . . A 102 ILE HG21 . 36589 1 1267 . 1 . 1 102 102 ILE HG22 H 1 0.939 0.030 . 1 . . . . A 102 ILE HG22 . 36589 1 1268 . 1 . 1 102 102 ILE HG23 H 1 0.939 0.030 . 1 . . . . A 102 ILE HG23 . 36589 1 1269 . 1 . 1 102 102 ILE HD11 H 1 0.766 0.030 . 1 . . . . A 102 ILE HD11 . 36589 1 1270 . 1 . 1 102 102 ILE HD12 H 1 0.766 0.030 . 1 . . . . A 102 ILE HD12 . 36589 1 1271 . 1 . 1 102 102 ILE HD13 H 1 0.766 0.030 . 1 . . . . A 102 ILE HD13 . 36589 1 1272 . 1 . 1 102 102 ILE C C 13 181.618 0.300 . 1 . . . . A 102 ILE C . 36589 1 1273 . 1 . 1 102 102 ILE CA C 13 65.585 0.300 . 1 . . . . A 102 ILE CA . 36589 1 1274 . 1 . 1 102 102 ILE CB C 13 38.379 0.300 . 1 . . . . A 102 ILE CB . 36589 1 1275 . 1 . 1 102 102 ILE CG1 C 13 26.385 0.300 . 1 . . . . A 102 ILE CG1 . 36589 1 1276 . 1 . 1 102 102 ILE CG2 C 13 18.634 0.300 . 1 . . . . A 102 ILE CG2 . 36589 1 1277 . 1 . 1 102 102 ILE CD1 C 13 14.130 0.300 . 1 . . . . A 102 ILE CD1 . 36589 1 1278 . 1 . 1 102 102 ILE N N 15 120.492 0.300 . 1 . . . . A 102 ILE N . 36589 1 1279 . 1 . 1 103 103 VAL H H 1 8.457 0.030 . 1 . . . . A 103 VAL H . 36589 1 1280 . 1 . 1 103 103 VAL HA H 1 3.733 0.030 . 1 . . . . A 103 VAL HA . 36589 1 1281 . 1 . 1 103 103 VAL HB H 1 2.145 0.030 . 1 . . . . A 103 VAL HB . 36589 1 1282 . 1 . 1 103 103 VAL HG11 H 1 1.039 0.030 . 2 . . . . A 103 VAL HG11 . 36589 1 1283 . 1 . 1 103 103 VAL HG12 H 1 1.039 0.030 . 2 . . . . A 103 VAL HG12 . 36589 1 1284 . 1 . 1 103 103 VAL HG13 H 1 1.039 0.030 . 2 . . . . A 103 VAL HG13 . 36589 1 1285 . 1 . 1 103 103 VAL HG21 H 1 0.981 0.030 . 2 . . . . A 103 VAL HG21 . 36589 1 1286 . 1 . 1 103 103 VAL HG22 H 1 0.981 0.030 . 2 . . . . A 103 VAL HG22 . 36589 1 1287 . 1 . 1 103 103 VAL HG23 H 1 0.981 0.030 . 2 . . . . A 103 VAL HG23 . 36589 1 1288 . 1 . 1 103 103 VAL C C 13 176.130 0.300 . 1 . . . . A 103 VAL C . 36589 1 1289 . 1 . 1 103 103 VAL CA C 13 66.404 0.300 . 1 . . . . A 103 VAL CA . 36589 1 1290 . 1 . 1 103 103 VAL CB C 13 31.792 0.300 . 1 . . . . A 103 VAL CB . 36589 1 1291 . 1 . 1 103 103 VAL CG1 C 13 23.945 0.300 . 2 . . . . A 103 VAL CG1 . 36589 1 1292 . 1 . 1 103 103 VAL CG2 C 13 21.904 0.300 . 2 . . . . A 103 VAL CG2 . 36589 1 1293 . 1 . 1 103 103 VAL N N 15 118.398 0.300 . 1 . . . . A 103 VAL N . 36589 1 1294 . 1 . 1 104 104 ALA H H 1 7.040 0.030 . 1 . . . . A 104 ALA H . 36589 1 1295 . 1 . 1 104 104 ALA HA H 1 4.370 0.030 . 1 . . . . A 104 ALA HA . 36589 1 1296 . 1 . 1 104 104 ALA HB1 H 1 1.351 0.030 . 1 . . . . A 104 ALA HB1 . 36589 1 1297 . 1 . 1 104 104 ALA HB2 H 1 1.351 0.030 . 1 . . . . A 104 ALA HB2 . 36589 1 1298 . 1 . 1 104 104 ALA HB3 H 1 1.351 0.030 . 1 . . . . A 104 ALA HB3 . 36589 1 1299 . 1 . 1 104 104 ALA C C 13 176.687 0.300 . 1 . . . . A 104 ALA C . 36589 1 1300 . 1 . 1 104 104 ALA CA C 13 52.292 0.300 . 1 . . . . A 104 ALA CA . 36589 1 1301 . 1 . 1 104 104 ALA CB C 13 19.571 0.300 . 1 . . . . A 104 ALA CB . 36589 1 1302 . 1 . 1 104 104 ALA N N 15 120.155 0.300 . 1 . . . . A 104 ALA N . 36589 1 1303 . 1 . 1 105 105 GLY H H 1 7.742 0.030 . 1 . . . . A 105 GLY H . 36589 1 1304 . 1 . 1 105 105 GLY HA2 H 1 4.001 0.030 . 1 . . . . A 105 GLY HA2 . 36589 1 1305 . 1 . 1 105 105 GLY HA3 H 1 4.001 0.030 . 1 . . . . A 105 GLY HA3 . 36589 1 1306 . 1 . 1 105 105 GLY C C 13 173.810 0.300 . 1 . . . . A 105 GLY C . 36589 1 1307 . 1 . 1 105 105 GLY CA C 13 45.545 0.300 . 1 . . . . A 105 GLY CA . 36589 1 1308 . 1 . 1 105 105 GLY N N 15 106.385 0.300 . 1 . . . . A 105 GLY N . 36589 1 1309 . 1 . 1 106 106 HIS H H 1 7.942 0.030 . 1 . . . . A 106 HIS H . 36589 1 1310 . 1 . 1 106 106 HIS HA H 1 4.995 0.030 . 1 . . . . A 106 HIS HA . 36589 1 1311 . 1 . 1 106 106 HIS HB2 H 1 2.889 0.030 . 2 . . . . A 106 HIS HB2 . 36589 1 1312 . 1 . 1 106 106 HIS HB3 H 1 3.286 0.030 . 2 . . . . A 106 HIS HB3 . 36589 1 1313 . 1 . 1 106 106 HIS HD2 H 1 6.863 0.030 . 1 . . . . A 106 HIS HD2 . 36589 1 1314 . 1 . 1 106 106 HIS HE1 H 1 7.809 0.030 . 1 . . . . A 106 HIS HE1 . 36589 1 1315 . 1 . 1 106 106 HIS C C 13 174.830 0.300 . 1 . . . . A 106 HIS C . 36589 1 1316 . 1 . 1 106 106 HIS CA C 13 54.128 0.300 . 1 . . . . A 106 HIS CA . 36589 1 1317 . 1 . 1 106 106 HIS CB C 13 33.916 0.300 . 1 . . . . A 106 HIS CB . 36589 1 1318 . 1 . 1 106 106 HIS CD2 C 13 118.217 0.300 . 1 . . . . A 106 HIS CD2 . 36589 1 1319 . 1 . 1 106 106 HIS CE1 C 13 139.089 0.300 . 1 . . . . A 106 HIS CE1 . 36589 1 1320 . 1 . 1 106 106 HIS N N 15 118.088 0.300 . 1 . . . . A 106 HIS N . 36589 1 1321 . 1 . 1 107 107 GLU H H 1 9.407 0.030 . 1 . . . . A 107 GLU H . 36589 1 1322 . 1 . 1 107 107 GLU HA H 1 4.326 0.030 . 1 . . . . A 107 GLU HA . 36589 1 1323 . 1 . 1 107 107 GLU HB2 H 1 2.061 0.030 . 2 . . . . A 107 GLU HB2 . 36589 1 1324 . 1 . 1 107 107 GLU HB3 H 1 2.130 0.030 . 2 . . . . A 107 GLU HB3 . 36589 1 1325 . 1 . 1 107 107 GLU HG2 H 1 2.355 0.030 . 1 . . . . A 107 GLU HG2 . 36589 1 1326 . 1 . 1 107 107 GLU HG3 H 1 2.355 0.030 . 1 . . . . A 107 GLU HG3 . 36589 1 1327 . 1 . 1 107 107 GLU C C 13 174.337 0.300 . 1 . . . . A 107 GLU C . 36589 1 1328 . 1 . 1 107 107 GLU CA C 13 56.312 0.300 . 1 . . . . A 107 GLU CA . 36589 1 1329 . 1 . 1 107 107 GLU CB C 13 29.311 0.300 . 1 . . . . A 107 GLU CB . 36589 1 1330 . 1 . 1 107 107 GLU CG C 13 36.820 0.300 . 1 . . . . A 107 GLU CG . 36589 1 1331 . 1 . 1 107 107 GLU N N 15 115.772 0.300 . 1 . . . . A 107 GLU N . 36589 1 1332 . 1 . 1 108 108 PRO HA H 1 4.700 0.030 . 1 . . . . A 108 PRO HA . 36589 1 1333 . 1 . 1 108 108 PRO HB2 H 1 2.145 0.030 . 1 . . . . A 108 PRO HB2 . 36589 1 1334 . 1 . 1 108 108 PRO HB3 H 1 2.145 0.030 . 1 . . . . A 108 PRO HB3 . 36589 1 1335 . 1 . 1 108 108 PRO HG2 H 1 2.380 0.030 . 2 . . . . A 108 PRO HG2 . 36589 1 1336 . 1 . 1 108 108 PRO HG3 H 1 2.108 0.030 . 2 . . . . A 108 PRO HG3 . 36589 1 1337 . 1 . 1 108 108 PRO HD2 H 1 3.595 0.030 . 2 . . . . A 108 PRO HD2 . 36589 1 1338 . 1 . 1 108 108 PRO HD3 H 1 4.014 0.030 . 2 . . . . A 108 PRO HD3 . 36589 1 1339 . 1 . 1 108 108 PRO C C 13 179.506 0.300 . 1 . . . . A 108 PRO C . 36589 1 1340 . 1 . 1 108 108 PRO CA C 13 64.971 0.300 . 1 . . . . A 108 PRO CA . 36589 1 1341 . 1 . 1 108 108 PRO CB C 13 31.493 0.300 . 1 . . . . A 108 PRO CB . 36589 1 1342 . 1 . 1 108 108 PRO CG C 13 28.375 0.300 . 1 . . . . A 108 PRO CG . 36589 1 1343 . 1 . 1 108 108 PRO CD C 13 51.258 0.300 . 1 . . . . A 108 PRO CD . 36589 1 1344 . 1 . 1 109 109 GLU H H 1 10.984 0.030 . 1 . . . . A 109 GLU H . 36589 1 1345 . 1 . 1 109 109 GLU HA H 1 4.198 0.030 . 1 . . . . A 109 GLU HA . 36589 1 1346 . 1 . 1 109 109 GLU HB2 H 1 2.048 0.030 . 1 . . . . A 109 GLU HB2 . 36589 1 1347 . 1 . 1 109 109 GLU HB3 H 1 2.048 0.030 . 1 . . . . A 109 GLU HB3 . 36589 1 1348 . 1 . 1 109 109 GLU HG2 H 1 2.316 0.030 . 2 . . . . A 109 GLU HG2 . 36589 1 1349 . 1 . 1 109 109 GLU HG3 H 1 2.442 0.030 . 2 . . . . A 109 GLU HG3 . 36589 1 1350 . 1 . 1 109 109 GLU C C 13 178.904 0.300 . 1 . . . . A 109 GLU C . 36589 1 1351 . 1 . 1 109 109 GLU CA C 13 60.733 0.300 . 1 . . . . A 109 GLU CA . 36589 1 1352 . 1 . 1 109 109 GLU CB C 13 27.392 0.300 . 1 . . . . A 109 GLU CB . 36589 1 1353 . 1 . 1 109 109 GLU CG C 13 35.805 0.300 . 1 . . . . A 109 GLU CG . 36589 1 1354 . 1 . 1 109 109 GLU N N 15 125.786 0.300 . 1 . . . . A 109 GLU N . 36589 1 1355 . 1 . 1 110 110 ARG H H 1 7.866 0.030 . 1 . . . . A 110 ARG H . 36589 1 1356 . 1 . 1 110 110 ARG HA H 1 4.422 0.030 . 1 . . . . A 110 ARG HA . 36589 1 1357 . 1 . 1 110 110 ARG HB2 H 1 1.772 0.030 . 2 . . . . A 110 ARG HB2 . 36589 1 1358 . 1 . 1 110 110 ARG HB3 H 1 2.497 0.030 . 2 . . . . A 110 ARG HB3 . 36589 1 1359 . 1 . 1 110 110 ARG HG2 H 1 1.927 0.030 . 2 . . . . A 110 ARG HG2 . 36589 1 1360 . 1 . 1 110 110 ARG HG3 H 1 1.762 0.030 . 2 . . . . A 110 ARG HG3 . 36589 1 1361 . 1 . 1 110 110 ARG HD2 H 1 3.081 0.030 . 2 . . . . A 110 ARG HD2 . 36589 1 1362 . 1 . 1 110 110 ARG HD3 H 1 3.182 0.030 . 2 . . . . A 110 ARG HD3 . 36589 1 1363 . 1 . 1 110 110 ARG HE H 1 7.473 0.030 . 1 . . . . A 110 ARG HE . 36589 1 1364 . 1 . 1 110 110 ARG C C 13 179.966 0.300 . 1 . . . . A 110 ARG C . 36589 1 1365 . 1 . 1 110 110 ARG CA C 13 57.905 0.300 . 1 . . . . A 110 ARG CA . 36589 1 1366 . 1 . 1 110 110 ARG CB C 13 29.923 0.300 . 1 . . . . A 110 ARG CB . 36589 1 1367 . 1 . 1 110 110 ARG CG C 13 27.308 0.300 . 1 . . . . A 110 ARG CG . 36589 1 1368 . 1 . 1 110 110 ARG CD C 13 43.730 0.300 . 1 . . . . A 110 ARG CD . 36589 1 1369 . 1 . 1 110 110 ARG N N 15 120.821 0.300 . 1 . . . . A 110 ARG N . 36589 1 1370 . 1 . 1 111 111 THR H H 1 7.755 0.030 . 1 . . . . A 111 THR H . 36589 1 1371 . 1 . 1 111 111 THR HA H 1 3.683 0.030 . 1 . . . . A 111 THR HA . 36589 1 1372 . 1 . 1 111 111 THR HB H 1 4.399 0.030 . 1 . . . . A 111 THR HB . 36589 1 1373 . 1 . 1 111 111 THR HG21 H 1 1.225 0.030 . 1 . . . . A 111 THR HG21 . 36589 1 1374 . 1 . 1 111 111 THR HG22 H 1 1.225 0.030 . 1 . . . . A 111 THR HG22 . 36589 1 1375 . 1 . 1 111 111 THR HG23 H 1 1.225 0.030 . 1 . . . . A 111 THR HG23 . 36589 1 1376 . 1 . 1 111 111 THR C C 13 176.143 0.300 . 1 . . . . A 111 THR C . 36589 1 1377 . 1 . 1 111 111 THR CA C 13 66.671 0.300 . 1 . . . . A 111 THR CA . 36589 1 1378 . 1 . 1 111 111 THR CB C 13 66.817 0.300 . 1 . . . . A 111 THR CB . 36589 1 1379 . 1 . 1 111 111 THR CG2 C 13 25.344 0.300 . 1 . . . . A 111 THR CG2 . 36589 1 1380 . 1 . 1 111 111 THR N N 15 120.003 0.300 . 1 . . . . A 111 THR N . 36589 1 1381 . 1 . 1 112 112 ASN H H 1 8.551 0.030 . 1 . . . . A 112 ASN H . 36589 1 1382 . 1 . 1 112 112 ASN HA H 1 4.126 0.030 . 1 . . . . A 112 ASN HA . 36589 1 1383 . 1 . 1 112 112 ASN HB2 H 1 2.226 0.030 . 2 . . . . A 112 ASN HB2 . 36589 1 1384 . 1 . 1 112 112 ASN HB3 H 1 2.751 0.030 . 2 . . . . A 112 ASN HB3 . 36589 1 1385 . 1 . 1 112 112 ASN HD21 H 1 7.281 0.030 . 2 . . . . A 112 ASN HD21 . 36589 1 1386 . 1 . 1 112 112 ASN HD22 H 1 7.479 0.030 . 2 . . . . A 112 ASN HD22 . 36589 1 1387 . 1 . 1 112 112 ASN C C 13 176.032 0.300 . 1 . . . . A 112 ASN C . 36589 1 1388 . 1 . 1 112 112 ASN CA C 13 58.504 0.300 . 1 . . . . A 112 ASN CA . 36589 1 1389 . 1 . 1 112 112 ASN CB C 13 39.826 0.300 . 1 . . . . A 112 ASN CB . 36589 1 1390 . 1 . 1 112 112 ASN N N 15 119.888 0.300 . 1 . . . . A 112 ASN N . 36589 1 1391 . 1 . 1 112 112 ASN ND2 N 15 109.038 0.300 . 1 . . . . A 112 ASN ND2 . 36589 1 1392 . 1 . 1 113 113 GLU H H 1 7.869 0.030 . 1 . . . . A 113 GLU H . 36589 1 1393 . 1 . 1 113 113 GLU HA H 1 3.820 0.030 . 1 . . . . A 113 GLU HA . 36589 1 1394 . 1 . 1 113 113 GLU HB2 H 1 2.120 0.030 . 2 . . . . A 113 GLU HB2 . 36589 1 1395 . 1 . 1 113 113 GLU HB3 H 1 2.315 0.030 . 2 . . . . A 113 GLU HB3 . 36589 1 1396 . 1 . 1 113 113 GLU HG2 H 1 2.517 0.030 . 2 . . . . A 113 GLU HG2 . 36589 1 1397 . 1 . 1 113 113 GLU HG3 H 1 2.231 0.030 . 2 . . . . A 113 GLU HG3 . 36589 1 1398 . 1 . 1 113 113 GLU C C 13 177.903 0.300 . 1 . . . . A 113 GLU C . 36589 1 1399 . 1 . 1 113 113 GLU CA C 13 60.173 0.300 . 1 . . . . A 113 GLU CA . 36589 1 1400 . 1 . 1 113 113 GLU CB C 13 29.429 0.300 . 1 . . . . A 113 GLU CB . 36589 1 1401 . 1 . 1 113 113 GLU CG C 13 36.660 0.300 . 1 . . . . A 113 GLU CG . 36589 1 1402 . 1 . 1 113 113 GLU N N 15 120.562 0.300 . 1 . . . . A 113 GLU N . 36589 1 1403 . 1 . 1 114 114 LEU H H 1 7.357 0.030 . 1 . . . . A 114 LEU H . 36589 1 1404 . 1 . 1 114 114 LEU HA H 1 4.128 0.030 . 1 . . . . A 114 LEU HA . 36589 1 1405 . 1 . 1 114 114 LEU HB2 H 1 1.439 0.030 . 2 . . . . A 114 LEU HB2 . 36589 1 1406 . 1 . 1 114 114 LEU HB3 H 1 2.547 0.030 . 2 . . . . A 114 LEU HB3 . 36589 1 1407 . 1 . 1 114 114 LEU HG H 1 1.544 0.030 . 1 . . . . A 114 LEU HG . 36589 1 1408 . 1 . 1 114 114 LEU HD11 H 1 0.957 0.030 . 2 . . . . A 114 LEU HD11 . 36589 1 1409 . 1 . 1 114 114 LEU HD12 H 1 0.957 0.030 . 2 . . . . A 114 LEU HD12 . 36589 1 1410 . 1 . 1 114 114 LEU HD13 H 1 0.957 0.030 . 2 . . . . A 114 LEU HD13 . 36589 1 1411 . 1 . 1 114 114 LEU HD21 H 1 0.845 0.030 . 2 . . . . A 114 LEU HD21 . 36589 1 1412 . 1 . 1 114 114 LEU HD22 H 1 0.845 0.030 . 2 . . . . A 114 LEU HD22 . 36589 1 1413 . 1 . 1 114 114 LEU HD23 H 1 0.845 0.030 . 2 . . . . A 114 LEU HD23 . 36589 1 1414 . 1 . 1 114 114 LEU C C 13 177.205 0.300 . 1 . . . . A 114 LEU C . 36589 1 1415 . 1 . 1 114 114 LEU CA C 13 58.764 0.300 . 1 . . . . A 114 LEU CA . 36589 1 1416 . 1 . 1 114 114 LEU CB C 13 40.836 0.300 . 1 . . . . A 114 LEU CB . 36589 1 1417 . 1 . 1 114 114 LEU CG C 13 28.099 0.300 . 1 . . . . A 114 LEU CG . 36589 1 1418 . 1 . 1 114 114 LEU CD1 C 13 23.757 0.300 . 2 . . . . A 114 LEU CD1 . 36589 1 1419 . 1 . 1 114 114 LEU CD2 C 13 25.116 0.300 . 2 . . . . A 114 LEU CD2 . 36589 1 1420 . 1 . 1 114 114 LEU N N 15 118.442 0.300 . 1 . . . . A 114 LEU N . 36589 1 1421 . 1 . 1 115 115 LEU H H 1 7.645 0.030 . 1 . . . . A 115 LEU H . 36589 1 1422 . 1 . 1 115 115 LEU HA H 1 3.931 0.030 . 1 . . . . A 115 LEU HA . 36589 1 1423 . 1 . 1 115 115 LEU HB2 H 1 1.412 0.030 . 2 . . . . A 115 LEU HB2 . 36589 1 1424 . 1 . 1 115 115 LEU HB3 H 1 2.235 0.030 . 2 . . . . A 115 LEU HB3 . 36589 1 1425 . 1 . 1 115 115 LEU HG H 1 2.000 0.030 . 1 . . . . A 115 LEU HG . 36589 1 1426 . 1 . 1 115 115 LEU HD11 H 1 0.689 0.030 . 2 . . . . A 115 LEU HD11 . 36589 1 1427 . 1 . 1 115 115 LEU HD12 H 1 0.689 0.030 . 2 . . . . A 115 LEU HD12 . 36589 1 1428 . 1 . 1 115 115 LEU HD13 H 1 0.689 0.030 . 2 . . . . A 115 LEU HD13 . 36589 1 1429 . 1 . 1 115 115 LEU HD21 H 1 0.722 0.030 . 2 . . . . A 115 LEU HD21 . 36589 1 1430 . 1 . 1 115 115 LEU HD22 H 1 0.722 0.030 . 2 . . . . A 115 LEU HD22 . 36589 1 1431 . 1 . 1 115 115 LEU HD23 H 1 0.722 0.030 . 2 . . . . A 115 LEU HD23 . 36589 1 1432 . 1 . 1 115 115 LEU C C 13 178.603 0.300 . 1 . . . . A 115 LEU C . 36589 1 1433 . 1 . 1 115 115 LEU CA C 13 58.104 0.300 . 1 . . . . A 115 LEU CA . 36589 1 1434 . 1 . 1 115 115 LEU CB C 13 41.627 0.300 . 1 . . . . A 115 LEU CB . 36589 1 1435 . 1 . 1 115 115 LEU CG C 13 26.235 0.300 . 1 . . . . A 115 LEU CG . 36589 1 1436 . 1 . 1 115 115 LEU CD1 C 13 25.216 0.300 . 2 . . . . A 115 LEU CD1 . 36589 1 1437 . 1 . 1 115 115 LEU CD2 C 13 21.140 0.300 . 2 . . . . A 115 LEU CD2 . 36589 1 1438 . 1 . 1 115 115 LEU N N 15 116.646 0.300 . 1 . . . . A 115 LEU N . 36589 1 1439 . 1 . 1 116 116 GLN H H 1 8.686 0.030 . 1 . . . . A 116 GLN H . 36589 1 1440 . 1 . 1 116 116 GLN HA H 1 3.777 0.030 . 1 . . . . A 116 GLN HA . 36589 1 1441 . 1 . 1 116 116 GLN HB2 H 1 1.988 0.030 . 2 . . . . A 116 GLN HB2 . 36589 1 1442 . 1 . 1 116 116 GLN HB3 H 1 2.404 0.030 . 2 . . . . A 116 GLN HB3 . 36589 1 1443 . 1 . 1 116 116 GLN HG2 H 1 2.838 0.030 . 2 . . . . A 116 GLN HG2 . 36589 1 1444 . 1 . 1 116 116 GLN HG3 H 1 2.081 0.030 . 2 . . . . A 116 GLN HG3 . 36589 1 1445 . 1 . 1 116 116 GLN HE21 H 1 6.377 0.030 . 2 . . . . A 116 GLN HE21 . 36589 1 1446 . 1 . 1 116 116 GLN HE22 H 1 7.962 0.030 . 2 . . . . A 116 GLN HE22 . 36589 1 1447 . 1 . 1 116 116 GLN C C 13 179.052 0.300 . 1 . . . . A 116 GLN C . 36589 1 1448 . 1 . 1 116 116 GLN CA C 13 58.950 0.300 . 1 . . . . A 116 GLN CA . 36589 1 1449 . 1 . 1 116 116 GLN CB C 13 27.054 0.300 . 1 . . . . A 116 GLN CB . 36589 1 1450 . 1 . 1 116 116 GLN CG C 13 34.491 0.300 . 1 . . . . A 116 GLN CG . 36589 1 1451 . 1 . 1 116 116 GLN N N 15 117.810 0.300 . 1 . . . . A 116 GLN N . 36589 1 1452 . 1 . 1 116 116 GLN NE2 N 15 110.920 0.300 . 1 . . . . A 116 GLN NE2 . 36589 1 1453 . 1 . 1 117 117 ILE H H 1 8.426 0.030 . 1 . . . . A 117 ILE H . 36589 1 1454 . 1 . 1 117 117 ILE HA H 1 3.966 0.030 . 1 . . . . A 117 ILE HA . 36589 1 1455 . 1 . 1 117 117 ILE HB H 1 2.066 0.030 . 1 . . . . A 117 ILE HB . 36589 1 1456 . 1 . 1 117 117 ILE HG12 H 1 1.563 0.030 . 2 . . . . A 117 ILE HG12 . 36589 1 1457 . 1 . 1 117 117 ILE HG13 H 1 1.616 0.030 . 2 . . . . A 117 ILE HG13 . 36589 1 1458 . 1 . 1 117 117 ILE HG21 H 1 1.001 0.030 . 1 . . . . A 117 ILE HG21 . 36589 1 1459 . 1 . 1 117 117 ILE HG22 H 1 1.001 0.030 . 1 . . . . A 117 ILE HG22 . 36589 1 1460 . 1 . 1 117 117 ILE HG23 H 1 1.001 0.030 . 1 . . . . A 117 ILE HG23 . 36589 1 1461 . 1 . 1 117 117 ILE HD11 H 1 0.817 0.030 . 1 . . . . A 117 ILE HD11 . 36589 1 1462 . 1 . 1 117 117 ILE HD12 H 1 0.817 0.030 . 1 . . . . A 117 ILE HD12 . 36589 1 1463 . 1 . 1 117 117 ILE HD13 H 1 0.817 0.030 . 1 . . . . A 117 ILE HD13 . 36589 1 1464 . 1 . 1 117 117 ILE C C 13 179.288 0.300 . 1 . . . . A 117 ILE C . 36589 1 1465 . 1 . 1 117 117 ILE CA C 13 63.618 0.300 . 1 . . . . A 117 ILE CA . 36589 1 1466 . 1 . 1 117 117 ILE CB C 13 36.753 0.300 . 1 . . . . A 117 ILE CB . 36589 1 1467 . 1 . 1 117 117 ILE CG1 C 13 28.905 0.300 . 1 . . . . A 117 ILE CG1 . 36589 1 1468 . 1 . 1 117 117 ILE CG2 C 13 19.139 0.300 . 1 . . . . A 117 ILE CG2 . 36589 1 1469 . 1 . 1 117 117 ILE CD1 C 13 11.807 0.300 . 1 . . . . A 117 ILE CD1 . 36589 1 1470 . 1 . 1 117 117 ILE N N 15 121.179 0.300 . 1 . . . . A 117 ILE N . 36589 1 1471 . 1 . 1 118 118 ILE H H 1 8.498 0.030 . 1 . . . . A 118 ILE H . 36589 1 1472 . 1 . 1 118 118 ILE HA H 1 3.493 0.030 . 1 . . . . A 118 ILE HA . 36589 1 1473 . 1 . 1 118 118 ILE HB H 1 2.156 0.030 . 1 . . . . A 118 ILE HB . 36589 1 1474 . 1 . 1 118 118 ILE HG12 H 1 2.184 0.030 . 2 . . . . A 118 ILE HG12 . 36589 1 1475 . 1 . 1 118 118 ILE HG13 H 1 1.033 0.030 . 2 . . . . A 118 ILE HG13 . 36589 1 1476 . 1 . 1 118 118 ILE HG21 H 1 0.939 0.030 . 1 . . . . A 118 ILE HG21 . 36589 1 1477 . 1 . 1 118 118 ILE HG22 H 1 0.939 0.030 . 1 . . . . A 118 ILE HG22 . 36589 1 1478 . 1 . 1 118 118 ILE HG23 H 1 0.939 0.030 . 1 . . . . A 118 ILE HG23 . 36589 1 1479 . 1 . 1 118 118 ILE HD11 H 1 0.832 0.030 . 1 . . . . A 118 ILE HD11 . 36589 1 1480 . 1 . 1 118 118 ILE HD12 H 1 0.832 0.030 . 1 . . . . A 118 ILE HD12 . 36589 1 1481 . 1 . 1 118 118 ILE HD13 H 1 0.832 0.030 . 1 . . . . A 118 ILE HD13 . 36589 1 1482 . 1 . 1 118 118 ILE C C 13 177.916 0.300 . 1 . . . . A 118 ILE C . 36589 1 1483 . 1 . 1 118 118 ILE CA C 13 67.701 0.300 . 1 . . . . A 118 ILE CA . 36589 1 1484 . 1 . 1 118 118 ILE CB C 13 37.849 0.300 . 1 . . . . A 118 ILE CB . 36589 1 1485 . 1 . 1 118 118 ILE CG1 C 13 31.325 0.300 . 1 . . . . A 118 ILE CG1 . 36589 1 1486 . 1 . 1 118 118 ILE CG2 C 13 18.070 0.300 . 1 . . . . A 118 ILE CG2 . 36589 1 1487 . 1 . 1 118 118 ILE CD1 C 13 12.998 0.300 . 1 . . . . A 118 ILE CD1 . 36589 1 1488 . 1 . 1 118 118 ILE N N 15 123.218 0.300 . 1 . . . . A 118 ILE N . 36589 1 1489 . 1 . 1 119 119 GLY H H 1 8.254 0.030 . 1 . . . . A 119 GLY H . 36589 1 1490 . 1 . 1 119 119 GLY HA2 H 1 3.521 0.030 . 1 . . . . A 119 GLY HA2 . 36589 1 1491 . 1 . 1 119 119 GLY HA3 H 1 3.521 0.030 . 1 . . . . A 119 GLY HA3 . 36589 1 1492 . 1 . 1 119 119 GLY C C 13 174.630 0.300 . 1 . . . . A 119 GLY C . 36589 1 1493 . 1 . 1 119 119 GLY CA C 13 48.370 0.300 . 1 . . . . A 119 GLY CA . 36589 1 1494 . 1 . 1 119 119 GLY N N 15 105.057 0.300 . 1 . . . . A 119 GLY N . 36589 1 1495 . 1 . 1 120 120 LYS H H 1 8.330 0.030 . 1 . . . . A 120 LYS H . 36589 1 1496 . 1 . 1 120 120 LYS HA H 1 3.965 0.030 . 1 . . . . A 120 LYS HA . 36589 1 1497 . 1 . 1 120 120 LYS HB2 H 1 2.028 0.030 . 1 . . . . A 120 LYS HB2 . 36589 1 1498 . 1 . 1 120 120 LYS HB3 H 1 2.028 0.030 . 1 . . . . A 120 LYS HB3 . 36589 1 1499 . 1 . 1 120 120 LYS HG2 H 1 1.540 0.030 . 2 . . . . A 120 LYS HG2 . 36589 1 1500 . 1 . 1 120 120 LYS HG3 H 1 1.422 0.030 . 2 . . . . A 120 LYS HG3 . 36589 1 1501 . 1 . 1 120 120 LYS HD2 H 1 1.694 0.030 . 1 . . . . A 120 LYS HD2 . 36589 1 1502 . 1 . 1 120 120 LYS HD3 H 1 1.694 0.030 . 1 . . . . A 120 LYS HD3 . 36589 1 1503 . 1 . 1 120 120 LYS HE2 H 1 2.932 0.030 . 1 . . . . A 120 LYS HE2 . 36589 1 1504 . 1 . 1 120 120 LYS HE3 H 1 2.932 0.030 . 1 . . . . A 120 LYS HE3 . 36589 1 1505 . 1 . 1 120 120 LYS C C 13 178.915 0.300 . 1 . . . . A 120 LYS C . 36589 1 1506 . 1 . 1 120 120 LYS CA C 13 60.360 0.300 . 1 . . . . A 120 LYS CA . 36589 1 1507 . 1 . 1 120 120 LYS CB C 13 32.796 0.300 . 1 . . . . A 120 LYS CB . 36589 1 1508 . 1 . 1 120 120 LYS CG C 13 25.147 0.300 . 1 . . . . A 120 LYS CG . 36589 1 1509 . 1 . 1 120 120 LYS CD C 13 29.860 0.300 . 1 . . . . A 120 LYS CD . 36589 1 1510 . 1 . 1 120 120 LYS CE C 13 41.896 0.300 . 1 . . . . A 120 LYS CE . 36589 1 1511 . 1 . 1 120 120 LYS N N 15 122.838 0.300 . 1 . . . . A 120 LYS N . 36589 1 1512 . 1 . 1 121 121 CYS H H 1 8.385 0.030 . 1 . . . . A 121 CYS H . 36589 1 1513 . 1 . 1 121 121 CYS HA H 1 3.859 0.030 . 1 . . . . A 121 CYS HA . 36589 1 1514 . 1 . 1 121 121 CYS HB2 H 1 1.817 0.030 . 2 . . . . A 121 CYS HB2 . 36589 1 1515 . 1 . 1 121 121 CYS HB3 H 1 2.593 0.030 . 2 . . . . A 121 CYS HB3 . 36589 1 1516 . 1 . 1 121 121 CYS C C 13 176.503 0.300 . 1 . . . . A 121 CYS C . 36589 1 1517 . 1 . 1 121 121 CYS CA C 13 64.170 0.300 . 1 . . . . A 121 CYS CA . 36589 1 1518 . 1 . 1 121 121 CYS CB C 13 27.453 0.300 . 1 . . . . A 121 CYS CB . 36589 1 1519 . 1 . 1 121 121 CYS N N 15 117.251 0.300 . 1 . . . . A 121 CYS N . 36589 1 1520 . 1 . 1 122 122 CYS H H 1 7.673 0.030 . 1 . . . . A 122 CYS H . 36589 1 1521 . 1 . 1 122 122 CYS HA H 1 4.051 0.030 . 1 . . . . A 122 CYS HA . 36589 1 1522 . 1 . 1 122 122 CYS HB2 H 1 2.773 0.030 . 2 . . . . A 122 CYS HB2 . 36589 1 1523 . 1 . 1 122 122 CYS HB3 H 1 3.104 0.030 . 2 . . . . A 122 CYS HB3 . 36589 1 1524 . 1 . 1 122 122 CYS C C 13 179.192 0.300 . 1 . . . . A 122 CYS C . 36589 1 1525 . 1 . 1 122 122 CYS CA C 13 63.128 0.300 . 1 . . . . A 122 CYS CA . 36589 1 1526 . 1 . 1 122 122 CYS CB C 13 27.392 0.300 . 1 . . . . A 122 CYS CB . 36589 1 1527 . 1 . 1 122 122 CYS N N 15 116.575 0.300 . 1 . . . . A 122 CYS N . 36589 1 1528 . 1 . 1 123 123 LEU H H 1 8.720 0.030 . 1 . . . . A 123 LEU H . 36589 1 1529 . 1 . 1 123 123 LEU HA H 1 4.064 0.030 . 1 . . . . A 123 LEU HA . 36589 1 1530 . 1 . 1 123 123 LEU HB2 H 1 1.588 0.030 . 2 . . . . A 123 LEU HB2 . 36589 1 1531 . 1 . 1 123 123 LEU HB3 H 1 1.781 0.030 . 2 . . . . A 123 LEU HB3 . 36589 1 1532 . 1 . 1 123 123 LEU HG H 1 1.702 0.030 . 1 . . . . A 123 LEU HG . 36589 1 1533 . 1 . 1 123 123 LEU HD11 H 1 0.876 0.030 . 2 . . . . A 123 LEU HD11 . 36589 1 1534 . 1 . 1 123 123 LEU HD12 H 1 0.876 0.030 . 2 . . . . A 123 LEU HD12 . 36589 1 1535 . 1 . 1 123 123 LEU HD13 H 1 0.876 0.030 . 2 . . . . A 123 LEU HD13 . 36589 1 1536 . 1 . 1 123 123 LEU HD21 H 1 0.923 0.030 . 2 . . . . A 123 LEU HD21 . 36589 1 1537 . 1 . 1 123 123 LEU HD22 H 1 0.923 0.030 . 2 . . . . A 123 LEU HD22 . 36589 1 1538 . 1 . 1 123 123 LEU HD23 H 1 0.923 0.030 . 2 . . . . A 123 LEU HD23 . 36589 1 1539 . 1 . 1 123 123 LEU C C 13 178.465 0.300 . 1 . . . . A 123 LEU C . 36589 1 1540 . 1 . 1 123 123 LEU CA C 13 57.842 0.300 . 1 . . . . A 123 LEU CA . 36589 1 1541 . 1 . 1 123 123 LEU CB C 13 41.949 0.300 . 1 . . . . A 123 LEU CB . 36589 1 1542 . 1 . 1 123 123 LEU CG C 13 26.797 0.300 . 1 . . . . A 123 LEU CG . 36589 1 1543 . 1 . 1 123 123 LEU CD1 C 13 23.694 0.300 . 2 . . . . A 123 LEU CD1 . 36589 1 1544 . 1 . 1 123 123 LEU CD2 C 13 24.748 0.300 . 2 . . . . A 123 LEU CD2 . 36589 1 1545 . 1 . 1 123 123 LEU N N 15 124.025 0.300 . 1 . . . . A 123 LEU N . 36589 1 1546 . 1 . 1 124 124 ASN H H 1 7.742 0.030 . 1 . . . . A 124 ASN H . 36589 1 1547 . 1 . 1 124 124 ASN HA H 1 4.697 0.030 . 1 . . . . A 124 ASN HA . 36589 1 1548 . 1 . 1 124 124 ASN HB2 H 1 2.577 0.030 . 2 . . . . A 124 ASN HB2 . 36589 1 1549 . 1 . 1 124 124 ASN HB3 H 1 2.940 0.030 . 2 . . . . A 124 ASN HB3 . 36589 1 1550 . 1 . 1 124 124 ASN HD21 H 1 7.077 0.030 . 2 . . . . A 124 ASN HD21 . 36589 1 1551 . 1 . 1 124 124 ASN HD22 H 1 7.418 0.030 . 2 . . . . A 124 ASN HD22 . 36589 1 1552 . 1 . 1 124 124 ASN C C 13 172.972 0.300 . 1 . . . . A 124 ASN C . 36589 1 1553 . 1 . 1 124 124 ASN CA C 13 53.279 0.300 . 1 . . . . A 124 ASN CA . 36589 1 1554 . 1 . 1 124 124 ASN CB C 13 38.562 0.300 . 1 . . . . A 124 ASN CB . 36589 1 1555 . 1 . 1 124 124 ASN N N 15 114.436 0.300 . 1 . . . . A 124 ASN N . 36589 1 1556 . 1 . 1 124 124 ASN ND2 N 15 112.298 0.300 . 1 . . . . A 124 ASN ND2 . 36589 1 1557 . 1 . 1 125 125 LYS H H 1 7.774 0.030 . 1 . . . . A 125 LYS H . 36589 1 1558 . 1 . 1 125 125 LYS HA H 1 3.958 0.030 . 1 . . . . A 125 LYS HA . 36589 1 1559 . 1 . 1 125 125 LYS HB2 H 1 2.021 0.030 . 1 . . . . A 125 LYS HB2 . 36589 1 1560 . 1 . 1 125 125 LYS HB3 H 1 2.021 0.030 . 1 . . . . A 125 LYS HB3 . 36589 1 1561 . 1 . 1 125 125 LYS HG2 H 1 1.441 0.030 . 1 . . . . A 125 LYS HG2 . 36589 1 1562 . 1 . 1 125 125 LYS HG3 H 1 1.441 0.030 . 1 . . . . A 125 LYS HG3 . 36589 1 1563 . 1 . 1 125 125 LYS HD2 H 1 1.748 0.030 . 2 . . . . A 125 LYS HD2 . 36589 1 1564 . 1 . 1 125 125 LYS HD3 H 1 1.819 0.030 . 2 . . . . A 125 LYS HD3 . 36589 1 1565 . 1 . 1 125 125 LYS HE2 H 1 3.096 0.030 . 1 . . . . A 125 LYS HE2 . 36589 1 1566 . 1 . 1 125 125 LYS HE3 H 1 3.096 0.030 . 1 . . . . A 125 LYS HE3 . 36589 1 1567 . 1 . 1 125 125 LYS C C 13 175.960 0.300 . 1 . . . . A 125 LYS C . 36589 1 1568 . 1 . 1 125 125 LYS CA C 13 56.842 0.300 . 1 . . . . A 125 LYS CA . 36589 1 1569 . 1 . 1 125 125 LYS CB C 13 28.921 0.300 . 1 . . . . A 125 LYS CB . 36589 1 1570 . 1 . 1 125 125 LYS CG C 13 25.030 0.300 . 1 . . . . A 125 LYS CG . 36589 1 1571 . 1 . 1 125 125 LYS CD C 13 29.218 0.300 . 1 . . . . A 125 LYS CD . 36589 1 1572 . 1 . 1 125 125 LYS CE C 13 42.173 0.300 . 1 . . . . A 125 LYS CE . 36589 1 1573 . 1 . 1 125 125 LYS N N 15 116.215 0.300 . 1 . . . . A 125 LYS N . 36589 1 1574 . 1 . 1 126 126 LEU H H 1 7.772 0.030 . 1 . . . . A 126 LEU H . 36589 1 1575 . 1 . 1 126 126 LEU HA H 1 4.360 0.030 . 1 . . . . A 126 LEU HA . 36589 1 1576 . 1 . 1 126 126 LEU HB2 H 1 1.413 0.030 . 2 . . . . A 126 LEU HB2 . 36589 1 1577 . 1 . 1 126 126 LEU HB3 H 1 1.501 0.030 . 2 . . . . A 126 LEU HB3 . 36589 1 1578 . 1 . 1 126 126 LEU HG H 1 1.633 0.030 . 1 . . . . A 126 LEU HG . 36589 1 1579 . 1 . 1 126 126 LEU HD11 H 1 0.983 0.030 . 2 . . . . A 126 LEU HD11 . 36589 1 1580 . 1 . 1 126 126 LEU HD12 H 1 0.983 0.030 . 2 . . . . A 126 LEU HD12 . 36589 1 1581 . 1 . 1 126 126 LEU HD13 H 1 0.983 0.030 . 2 . . . . A 126 LEU HD13 . 36589 1 1582 . 1 . 1 126 126 LEU HD21 H 1 0.916 0.030 . 2 . . . . A 126 LEU HD21 . 36589 1 1583 . 1 . 1 126 126 LEU HD22 H 1 0.916 0.030 . 2 . . . . A 126 LEU HD22 . 36589 1 1584 . 1 . 1 126 126 LEU HD23 H 1 0.916 0.030 . 2 . . . . A 126 LEU HD23 . 36589 1 1585 . 1 . 1 126 126 LEU C C 13 177.006 0.300 . 1 . . . . A 126 LEU C . 36589 1 1586 . 1 . 1 126 126 LEU CA C 13 54.775 0.300 . 1 . . . . A 126 LEU CA . 36589 1 1587 . 1 . 1 126 126 LEU CB C 13 42.053 0.300 . 1 . . . . A 126 LEU CB . 36589 1 1588 . 1 . 1 126 126 LEU CG C 13 27.126 0.300 . 1 . . . . A 126 LEU CG . 36589 1 1589 . 1 . 1 126 126 LEU CD1 C 13 26.148 0.300 . 2 . . . . A 126 LEU CD1 . 36589 1 1590 . 1 . 1 126 126 LEU CD2 C 13 22.065 0.300 . 2 . . . . A 126 LEU CD2 . 36589 1 1591 . 1 . 1 126 126 LEU N N 15 117.801 0.300 . 1 . . . . A 126 LEU N . 36589 1 1592 . 1 . 1 127 127 SER H H 1 8.514 0.030 . 1 . . . . A 127 SER H . 36589 1 1593 . 1 . 1 127 127 SER HA H 1 4.741 0.030 . 1 . . . . A 127 SER HA . 36589 1 1594 . 1 . 1 127 127 SER HB2 H 1 4.141 0.030 . 2 . . . . A 127 SER HB2 . 36589 1 1595 . 1 . 1 127 127 SER HB3 H 1 3.918 0.030 . 2 . . . . A 127 SER HB3 . 36589 1 1596 . 1 . 1 127 127 SER C C 13 176.835 0.300 . 1 . . . . A 127 SER C . 36589 1 1597 . 1 . 1 127 127 SER CA C 13 57.401 0.300 . 1 . . . . A 127 SER CA . 36589 1 1598 . 1 . 1 127 127 SER CB C 13 63.978 0.300 . 1 . . . . A 127 SER CB . 36589 1 1599 . 1 . 1 127 127 SER N N 15 115.112 0.300 . 1 . . . . A 127 SER N . 36589 1 1600 . 1 . 1 128 128 SER H H 1 9.293 0.030 . 1 . . . . A 128 SER H . 36589 1 1601 . 1 . 1 128 128 SER HA H 1 4.654 0.030 . 1 . . . . A 128 SER HA . 36589 1 1602 . 1 . 1 128 128 SER HB2 H 1 3.874 0.030 . 2 . . . . A 128 SER HB2 . 36589 1 1603 . 1 . 1 128 128 SER HB3 H 1 3.149 0.030 . 2 . . . . A 128 SER HB3 . 36589 1 1604 . 1 . 1 128 128 SER C C 13 174.540 0.300 . 1 . . . . A 128 SER C . 36589 1 1605 . 1 . 1 128 128 SER CA C 13 57.610 0.300 . 1 . . . . A 128 SER CA . 36589 1 1606 . 1 . 1 128 128 SER CB C 13 64.444 0.300 . 1 . . . . A 128 SER CB . 36589 1 1607 . 1 . 1 128 128 SER N N 15 118.095 0.300 . 1 . . . . A 128 SER N . 36589 1 1608 . 1 . 1 129 129 ASP H H 1 7.837 0.030 . 1 . . . . A 129 ASP H . 36589 1 1609 . 1 . 1 129 129 ASP HA H 1 4.293 0.030 . 1 . . . . A 129 ASP HA . 36589 1 1610 . 1 . 1 129 129 ASP HB2 H 1 2.623 0.030 . 2 . . . . A 129 ASP HB2 . 36589 1 1611 . 1 . 1 129 129 ASP HB3 H 1 2.700 0.030 . 2 . . . . A 129 ASP HB3 . 36589 1 1612 . 1 . 1 129 129 ASP C C 13 177.956 0.300 . 1 . . . . A 129 ASP C . 36589 1 1613 . 1 . 1 129 129 ASP CA C 13 58.897 0.300 . 1 . . . . A 129 ASP CA . 36589 1 1614 . 1 . 1 129 129 ASP CB C 13 39.959 0.300 . 1 . . . . A 129 ASP CB . 36589 1 1615 . 1 . 1 129 129 ASP N N 15 123.532 0.300 . 1 . . . . A 129 ASP N . 36589 1 1616 . 1 . 1 130 130 ASP H H 1 8.598 0.030 . 1 . . . . A 130 ASP H . 36589 1 1617 . 1 . 1 130 130 ASP HA H 1 4.423 0.030 . 1 . . . . A 130 ASP HA . 36589 1 1618 . 1 . 1 130 130 ASP HB2 H 1 2.607 0.030 . 2 . . . . A 130 ASP HB2 . 36589 1 1619 . 1 . 1 130 130 ASP HB3 H 1 2.679 0.030 . 2 . . . . A 130 ASP HB3 . 36589 1 1620 . 1 . 1 130 130 ASP C C 13 177.238 0.300 . 1 . . . . A 130 ASP C . 36589 1 1621 . 1 . 1 130 130 ASP CA C 13 57.613 0.300 . 1 . . . . A 130 ASP CA . 36589 1 1622 . 1 . 1 130 130 ASP CB C 13 41.485 0.300 . 1 . . . . A 130 ASP CB . 36589 1 1623 . 1 . 1 130 130 ASP N N 15 120.383 0.300 . 1 . . . . A 130 ASP N . 36589 1 1624 . 1 . 1 131 131 ALA H H 1 8.169 0.030 . 1 . . . . A 131 ALA H . 36589 1 1625 . 1 . 1 131 131 ALA HA H 1 4.214 0.030 . 1 . . . . A 131 ALA HA . 36589 1 1626 . 1 . 1 131 131 ALA HB1 H 1 1.450 0.030 . 1 . . . . A 131 ALA HB1 . 36589 1 1627 . 1 . 1 131 131 ALA HB2 H 1 1.450 0.030 . 1 . . . . A 131 ALA HB2 . 36589 1 1628 . 1 . 1 131 131 ALA HB3 H 1 1.450 0.030 . 1 . . . . A 131 ALA HB3 . 36589 1 1629 . 1 . 1 131 131 ALA C C 13 178.872 0.300 . 1 . . . . A 131 ALA C . 36589 1 1630 . 1 . 1 131 131 ALA CA C 13 54.893 0.300 . 1 . . . . A 131 ALA CA . 36589 1 1631 . 1 . 1 131 131 ALA CB C 13 20.649 0.300 . 1 . . . . A 131 ALA CB . 36589 1 1632 . 1 . 1 131 131 ALA N N 15 122.669 0.300 . 1 . . . . A 131 ALA N . 36589 1 1633 . 1 . 1 132 132 VAL H H 1 8.752 0.030 . 1 . . . . A 132 VAL H . 36589 1 1634 . 1 . 1 132 132 VAL HA H 1 3.206 0.030 . 1 . . . . A 132 VAL HA . 36589 1 1635 . 1 . 1 132 132 VAL HB H 1 2.052 0.030 . 1 . . . . A 132 VAL HB . 36589 1 1636 . 1 . 1 132 132 VAL HG11 H 1 0.786 0.030 . 2 . . . . A 132 VAL HG11 . 36589 1 1637 . 1 . 1 132 132 VAL HG12 H 1 0.786 0.030 . 2 . . . . A 132 VAL HG12 . 36589 1 1638 . 1 . 1 132 132 VAL HG13 H 1 0.786 0.030 . 2 . . . . A 132 VAL HG13 . 36589 1 1639 . 1 . 1 132 132 VAL HG21 H 1 0.625 0.030 . 2 . . . . A 132 VAL HG21 . 36589 1 1640 . 1 . 1 132 132 VAL HG22 H 1 0.625 0.030 . 2 . . . . A 132 VAL HG22 . 36589 1 1641 . 1 . 1 132 132 VAL HG23 H 1 0.625 0.030 . 2 . . . . A 132 VAL HG23 . 36589 1 1642 . 1 . 1 132 132 VAL C C 13 176.695 0.300 . 1 . . . . A 132 VAL C . 36589 1 1643 . 1 . 1 132 132 VAL CA C 13 67.220 0.300 . 1 . . . . A 132 VAL CA . 36589 1 1644 . 1 . 1 132 132 VAL CB C 13 31.745 0.300 . 1 . . . . A 132 VAL CB . 36589 1 1645 . 1 . 1 132 132 VAL CG1 C 13 24.187 0.300 . 2 . . . . A 132 VAL CG1 . 36589 1 1646 . 1 . 1 132 132 VAL CG2 C 13 20.569 0.300 . 2 . . . . A 132 VAL CG2 . 36589 1 1647 . 1 . 1 132 132 VAL N N 15 117.261 0.300 . 1 . . . . A 132 VAL N . 36589 1 1648 . 1 . 1 133 133 ARG H H 1 7.393 0.030 . 1 . . . . A 133 ARG H . 36589 1 1649 . 1 . 1 133 133 ARG HA H 1 3.855 0.030 . 1 . . . . A 133 ARG HA . 36589 1 1650 . 1 . 1 133 133 ARG HB2 H 1 1.913 0.030 . 2 . . . . A 133 ARG HB2 . 36589 1 1651 . 1 . 1 133 133 ARG HB3 H 1 2.044 0.030 . 2 . . . . A 133 ARG HB3 . 36589 1 1652 . 1 . 1 133 133 ARG HG2 H 1 1.544 0.030 . 2 . . . . A 133 ARG HG2 . 36589 1 1653 . 1 . 1 133 133 ARG HG3 H 1 1.736 0.030 . 2 . . . . A 133 ARG HG3 . 36589 1 1654 . 1 . 1 133 133 ARG HD2 H 1 3.279 0.030 . 2 . . . . A 133 ARG HD2 . 36589 1 1655 . 1 . 1 133 133 ARG HD3 H 1 3.202 0.030 . 2 . . . . A 133 ARG HD3 . 36589 1 1656 . 1 . 1 133 133 ARG C C 13 179.643 0.300 . 1 . . . . A 133 ARG C . 36589 1 1657 . 1 . 1 133 133 ARG CA C 13 59.743 0.300 . 1 . . . . A 133 ARG CA . 36589 1 1658 . 1 . 1 133 133 ARG CB C 13 29.764 0.300 . 1 . . . . A 133 ARG CB . 36589 1 1659 . 1 . 1 133 133 ARG CG C 13 27.234 0.300 . 1 . . . . A 133 ARG CG . 36589 1 1660 . 1 . 1 133 133 ARG CD C 13 43.252 0.300 . 1 . . . . A 133 ARG CD . 36589 1 1661 . 1 . 1 133 133 ARG N N 15 117.370 0.300 . 1 . . . . A 133 ARG N . 36589 1 1662 . 1 . 1 134 134 ARG H H 1 7.947 0.030 . 1 . . . . A 134 ARG H . 36589 1 1663 . 1 . 1 134 134 ARG HA H 1 3.900 0.030 . 1 . . . . A 134 ARG HA . 36589 1 1664 . 1 . 1 134 134 ARG HB2 H 1 1.875 0.030 . 1 . . . . A 134 ARG HB2 . 36589 1 1665 . 1 . 1 134 134 ARG HB3 H 1 1.875 0.030 . 1 . . . . A 134 ARG HB3 . 36589 1 1666 . 1 . 1 134 134 ARG HG2 H 1 1.620 0.030 . 2 . . . . A 134 ARG HG2 . 36589 1 1667 . 1 . 1 134 134 ARG HG3 H 1 1.847 0.030 . 2 . . . . A 134 ARG HG3 . 36589 1 1668 . 1 . 1 134 134 ARG HD2 H 1 3.103 0.030 . 2 . . . . A 134 ARG HD2 . 36589 1 1669 . 1 . 1 134 134 ARG HD3 H 1 3.164 0.030 . 2 . . . . A 134 ARG HD3 . 36589 1 1670 . 1 . 1 134 134 ARG C C 13 178.882 0.300 . 1 . . . . A 134 ARG C . 36589 1 1671 . 1 . 1 134 134 ARG CA C 13 60.056 0.300 . 1 . . . . A 134 ARG CA . 36589 1 1672 . 1 . 1 134 134 ARG CB C 13 30.491 0.300 . 1 . . . . A 134 ARG CB . 36589 1 1673 . 1 . 1 134 134 ARG CG C 13 27.876 0.300 . 1 . . . . A 134 ARG CG . 36589 1 1674 . 1 . 1 134 134 ARG CD C 13 44.078 0.300 . 1 . . . . A 134 ARG CD . 36589 1 1675 . 1 . 1 134 134 ARG N N 15 118.684 0.300 . 1 . . . . A 134 ARG N . 36589 1 1676 . 1 . 1 135 135 VAL H H 1 8.777 0.030 . 1 . . . . A 135 VAL H . 36589 1 1677 . 1 . 1 135 135 VAL HA H 1 3.748 0.030 . 1 . . . . A 135 VAL HA . 36589 1 1678 . 1 . 1 135 135 VAL HB H 1 1.937 0.030 . 1 . . . . A 135 VAL HB . 36589 1 1679 . 1 . 1 135 135 VAL HG11 H 1 1.065 0.030 . 2 . . . . A 135 VAL HG11 . 36589 1 1680 . 1 . 1 135 135 VAL HG12 H 1 1.065 0.030 . 2 . . . . A 135 VAL HG12 . 36589 1 1681 . 1 . 1 135 135 VAL HG13 H 1 1.065 0.030 . 2 . . . . A 135 VAL HG13 . 36589 1 1682 . 1 . 1 135 135 VAL HG21 H 1 0.991 0.030 . 2 . . . . A 135 VAL HG21 . 36589 1 1683 . 1 . 1 135 135 VAL HG22 H 1 0.991 0.030 . 2 . . . . A 135 VAL HG22 . 36589 1 1684 . 1 . 1 135 135 VAL HG23 H 1 0.991 0.030 . 2 . . . . A 135 VAL HG23 . 36589 1 1685 . 1 . 1 135 135 VAL C C 13 180.674 0.300 . 1 . . . . A 135 VAL C . 36589 1 1686 . 1 . 1 135 135 VAL CA C 13 66.692 0.300 . 1 . . . . A 135 VAL CA . 36589 1 1687 . 1 . 1 135 135 VAL CB C 13 31.796 0.300 . 1 . . . . A 135 VAL CB . 36589 1 1688 . 1 . 1 135 135 VAL CG1 C 13 24.349 0.300 . 2 . . . . A 135 VAL CG1 . 36589 1 1689 . 1 . 1 135 135 VAL CG2 C 13 21.267 0.300 . 2 . . . . A 135 VAL CG2 . 36589 1 1690 . 1 . 1 135 135 VAL N N 15 121.328 0.300 . 1 . . . . A 135 VAL N . 36589 1 1691 . 1 . 1 136 136 LEU H H 1 8.483 0.030 . 1 . . . . A 136 LEU H . 36589 1 1692 . 1 . 1 136 136 LEU HA H 1 4.109 0.030 . 1 . . . . A 136 LEU HA . 36589 1 1693 . 1 . 1 136 136 LEU HB2 H 1 1.411 0.030 . 2 . . . . A 136 LEU HB2 . 36589 1 1694 . 1 . 1 136 136 LEU HB3 H 1 1.849 0.030 . 2 . . . . A 136 LEU HB3 . 36589 1 1695 . 1 . 1 136 136 LEU HG H 1 1.808 0.030 . 1 . . . . A 136 LEU HG . 36589 1 1696 . 1 . 1 136 136 LEU HD11 H 1 0.840 0.030 . 2 . . . . A 136 LEU HD11 . 36589 1 1697 . 1 . 1 136 136 LEU HD12 H 1 0.840 0.030 . 2 . . . . A 136 LEU HD12 . 36589 1 1698 . 1 . 1 136 136 LEU HD13 H 1 0.840 0.030 . 2 . . . . A 136 LEU HD13 . 36589 1 1699 . 1 . 1 136 136 LEU HD21 H 1 0.888 0.030 . 2 . . . . A 136 LEU HD21 . 36589 1 1700 . 1 . 1 136 136 LEU HD22 H 1 0.888 0.030 . 2 . . . . A 136 LEU HD22 . 36589 1 1701 . 1 . 1 136 136 LEU HD23 H 1 0.888 0.030 . 2 . . . . A 136 LEU HD23 . 36589 1 1702 . 1 . 1 136 136 LEU C C 13 178.804 0.300 . 1 . . . . A 136 LEU C . 36589 1 1703 . 1 . 1 136 136 LEU CA C 13 57.281 0.300 . 1 . . . . A 136 LEU CA . 36589 1 1704 . 1 . 1 136 136 LEU CB C 13 41.457 0.300 . 1 . . . . A 136 LEU CB . 36589 1 1705 . 1 . 1 136 136 LEU CG C 13 26.643 0.300 . 1 . . . . A 136 LEU CG . 36589 1 1706 . 1 . 1 136 136 LEU CD1 C 13 25.834 0.300 . 2 . . . . A 136 LEU CD1 . 36589 1 1707 . 1 . 1 136 136 LEU CD2 C 13 21.533 0.300 . 2 . . . . A 136 LEU CD2 . 36589 1 1708 . 1 . 1 136 136 LEU N N 15 120.366 0.300 . 1 . . . . A 136 LEU N . 36589 1 1709 . 1 . 1 137 137 ALA H H 1 7.622 0.030 . 1 . . . . A 137 ALA H . 36589 1 1710 . 1 . 1 137 137 ALA HA H 1 4.354 0.030 . 1 . . . . A 137 ALA HA . 36589 1 1711 . 1 . 1 137 137 ALA HB1 H 1 1.522 0.030 . 1 . . . . A 137 ALA HB1 . 36589 1 1712 . 1 . 1 137 137 ALA HB2 H 1 1.522 0.030 . 1 . . . . A 137 ALA HB2 . 36589 1 1713 . 1 . 1 137 137 ALA HB3 H 1 1.522 0.030 . 1 . . . . A 137 ALA HB3 . 36589 1 1714 . 1 . 1 137 137 ALA C C 13 178.205 0.300 . 1 . . . . A 137 ALA C . 36589 1 1715 . 1 . 1 137 137 ALA CA C 13 52.871 0.300 . 1 . . . . A 137 ALA CA . 36589 1 1716 . 1 . 1 137 137 ALA CB C 13 18.986 0.300 . 1 . . . . A 137 ALA CB . 36589 1 1717 . 1 . 1 137 137 ALA N N 15 119.998 0.300 . 1 . . . . A 137 ALA N . 36589 1 1718 . 1 . 1 138 138 GLY H H 1 7.840 0.030 . 1 . . . . A 138 GLY H . 36589 1 1719 . 1 . 1 138 138 GLY HA2 H 1 3.919 0.030 . 2 . . . . A 138 GLY HA2 . 36589 1 1720 . 1 . 1 138 138 GLY HA3 H 1 4.058 0.030 . 2 . . . . A 138 GLY HA3 . 36589 1 1721 . 1 . 1 138 138 GLY C C 13 174.486 0.300 . 1 . . . . A 138 GLY C . 36589 1 1722 . 1 . 1 138 138 GLY CA C 13 45.789 0.300 . 1 . . . . A 138 GLY CA . 36589 1 1723 . 1 . 1 138 138 GLY N N 15 106.976 0.300 . 1 . . . . A 138 GLY N . 36589 1 1724 . 1 . 1 139 139 GLU H H 1 8.107 0.030 . 1 . . . . A 139 GLU H . 36589 1 1725 . 1 . 1 139 139 GLU HA H 1 4.325 0.030 . 1 . . . . A 139 GLU HA . 36589 1 1726 . 1 . 1 139 139 GLU HB2 H 1 1.844 0.030 . 2 . . . . A 139 GLU HB2 . 36589 1 1727 . 1 . 1 139 139 GLU HB3 H 1 2.088 0.030 . 2 . . . . A 139 GLU HB3 . 36589 1 1728 . 1 . 1 139 139 GLU HG2 H 1 2.274 0.030 . 2 . . . . A 139 GLU HG2 . 36589 1 1729 . 1 . 1 139 139 GLU HG3 H 1 2.230 0.030 . 2 . . . . A 139 GLU HG3 . 36589 1 1730 . 1 . 1 139 139 GLU C C 13 175.143 0.300 . 1 . . . . A 139 GLU C . 36589 1 1731 . 1 . 1 139 139 GLU CA C 13 56.310 0.300 . 1 . . . . A 139 GLU CA . 36589 1 1732 . 1 . 1 139 139 GLU CB C 13 30.744 0.300 . 1 . . . . A 139 GLU CB . 36589 1 1733 . 1 . 1 139 139 GLU CG C 13 36.357 0.300 . 1 . . . . A 139 GLU CG . 36589 1 1734 . 1 . 1 139 139 GLU N N 15 120.921 0.300 . 1 . . . . A 139 GLU N . 36589 1 1735 . 1 . 1 140 140 LYS H H 1 7.818 0.030 . 1 . . . . A 140 LYS H . 36589 1 1736 . 1 . 1 140 140 LYS HA H 1 4.156 0.030 . 1 . . . . A 140 LYS HA . 36589 1 1737 . 1 . 1 140 140 LYS HB2 H 1 1.831 0.030 . 2 . . . . A 140 LYS HB2 . 36589 1 1738 . 1 . 1 140 140 LYS HB3 H 1 1.706 0.030 . 2 . . . . A 140 LYS HB3 . 36589 1 1739 . 1 . 1 140 140 LYS HG2 H 1 1.387 0.030 . 1 . . . . A 140 LYS HG2 . 36589 1 1740 . 1 . 1 140 140 LYS HG3 H 1 1.387 0.030 . 1 . . . . A 140 LYS HG3 . 36589 1 1741 . 1 . 1 140 140 LYS HD2 H 1 1.673 0.030 . 1 . . . . A 140 LYS HD2 . 36589 1 1742 . 1 . 1 140 140 LYS HD3 H 1 1.673 0.030 . 1 . . . . A 140 LYS HD3 . 36589 1 1743 . 1 . 1 140 140 LYS HE2 H 1 3.025 0.030 . 1 . . . . A 140 LYS HE2 . 36589 1 1744 . 1 . 1 140 140 LYS HE3 H 1 3.025 0.030 . 1 . . . . A 140 LYS HE3 . 36589 1 1745 . 1 . 1 140 140 LYS C C 13 181.358 0.300 . 1 . . . . A 140 LYS C . 36589 1 1746 . 1 . 1 140 140 LYS CA C 13 57.394 0.300 . 1 . . . . A 140 LYS CA . 36589 1 1747 . 1 . 1 140 140 LYS CB C 13 33.911 0.300 . 1 . . . . A 140 LYS CB . 36589 1 1748 . 1 . 1 140 140 LYS CG C 13 24.523 0.300 . 1 . . . . A 140 LYS CG . 36589 1 1749 . 1 . 1 140 140 LYS CD C 13 29.108 0.300 . 1 . . . . A 140 LYS CD . 36589 1 1750 . 1 . 1 140 140 LYS CE C 13 42.069 0.300 . 1 . . . . A 140 LYS CE . 36589 1 1751 . 1 . 1 140 140 LYS N N 15 126.140 0.300 . 1 . . . . A 140 LYS N . 36589 1 stop_ save_