data_52362 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52362 _Entry.Title ; Backbone assignment of Hrp48 RRM12 bound to 10mer RNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-03-25 _Entry.Accession_date 2024-03-25 _Entry.Last_release_date 2024-03-25 _Entry.Original_release_date 2024-03-25 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _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 Andrea Lomoschitz . . . . 52362 2 Julia Meyer . . . . 52362 3 Kristian Schweimer . . . . 52362 4 Janosch Hennig . . . . 52362 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52362 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 306 52362 '15N chemical shifts' 160 52362 '1H chemical shifts' 160 52362 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 . . 2024-12-26 . original BMRB . 52362 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52362 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 39504588 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; The Drosophila RNA binding protein Hrp48 binds a specific RNA sequence of the msl-2 mRNA 3' UTR to regulate translation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biophys. Chem.' _Citation.Journal_name_full 'Biophysical chemistry' _Citation.Journal_volume 316 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 1873-4200 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 107346 _Citation.Page_last 107346 _Citation.Year 2025 _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 Andrea Lomoschitz A. . . . 52362 1 2 Julia Meyer J. . . . 52362 1 3 Tanit Guitart T. . . . 52362 1 4 Miroslav Krepl M. . . . 52362 1 5 Karine Lapouge K. . . . 52362 1 6 Clara Hayn C. . . . 52362 1 7 Kristian Schweimer K. . . . 52362 1 8 Bernd Simon B. . . . 52362 1 9 Jiri Sponer J. . . . 52362 1 10 Fatima Gebauer F. . . . 52362 1 11 Janosch Hennig J. . . . 52362 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52362 _Assembly.ID 1 _Assembly.Name 'Hrp48 RRM12+10mer RNA' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange yes _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Hrp48 RRM12' 1 $entity_1 . . yes native yes yes . . . 52362 1 2 '10mer RNA' 2 $entity_2 . . yes native yes yes . . . 52362 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52362 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMEEDERGKLFVGGLSWET TQENLSRYFCRFGDIIDCVV MKNNESGRSRGFGFVTFADP TNVNHVLQNGPHTLDGRTID PKPCNPRTLQKPKKGGGYKV FLGGLPSNVTETDLRTFFNR YGKVTEVVIMYDQEKKKSRG FGFLSFEEESSVEHVTNERY INLNGKQVEIKKAEP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'N-terminal GA from expression tag' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 175 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 52362 1 2 . ALA . 52362 1 3 . MET . 52362 1 4 . GLU . 52362 1 5 . GLU . 52362 1 6 . ASP . 52362 1 7 . GLU . 52362 1 8 . ARG . 52362 1 9 . GLY . 52362 1 10 . LYS . 52362 1 11 . LEU . 52362 1 12 . PHE . 52362 1 13 . VAL . 52362 1 14 . GLY . 52362 1 15 . GLY . 52362 1 16 . LEU . 52362 1 17 . SER . 52362 1 18 . TRP . 52362 1 19 . GLU . 52362 1 20 . THR . 52362 1 21 . THR . 52362 1 22 . GLN . 52362 1 23 . GLU . 52362 1 24 . ASN . 52362 1 25 . LEU . 52362 1 26 . SER . 52362 1 27 . ARG . 52362 1 28 . TYR . 52362 1 29 . PHE . 52362 1 30 . CYS . 52362 1 31 . ARG . 52362 1 32 . PHE . 52362 1 33 . GLY . 52362 1 34 . ASP . 52362 1 35 . ILE . 52362 1 36 . ILE . 52362 1 37 . ASP . 52362 1 38 . CYS . 52362 1 39 . VAL . 52362 1 40 . VAL . 52362 1 41 . MET . 52362 1 42 . LYS . 52362 1 43 . ASN . 52362 1 44 . ASN . 52362 1 45 . GLU . 52362 1 46 . SER . 52362 1 47 . GLY . 52362 1 48 . ARG . 52362 1 49 . SER . 52362 1 50 . ARG . 52362 1 51 . GLY . 52362 1 52 . PHE . 52362 1 53 . GLY . 52362 1 54 . PHE . 52362 1 55 . VAL . 52362 1 56 . THR . 52362 1 57 . PHE . 52362 1 58 . ALA . 52362 1 59 . ASP . 52362 1 60 . PRO . 52362 1 61 . THR . 52362 1 62 . ASN . 52362 1 63 . VAL . 52362 1 64 . ASN . 52362 1 65 . HIS . 52362 1 66 . VAL . 52362 1 67 . LEU . 52362 1 68 . GLN . 52362 1 69 . ASN . 52362 1 70 . GLY . 52362 1 71 . PRO . 52362 1 72 . HIS . 52362 1 73 . THR . 52362 1 74 . LEU . 52362 1 75 . ASP . 52362 1 76 . GLY . 52362 1 77 . ARG . 52362 1 78 . THR . 52362 1 79 . ILE . 52362 1 80 . ASP . 52362 1 81 . PRO . 52362 1 82 . LYS . 52362 1 83 . PRO . 52362 1 84 . CYS . 52362 1 85 . ASN . 52362 1 86 . PRO . 52362 1 87 . ARG . 52362 1 88 . THR . 52362 1 89 . LEU . 52362 1 90 . GLN . 52362 1 91 . LYS . 52362 1 92 . PRO . 52362 1 93 . LYS . 52362 1 94 . LYS . 52362 1 95 . GLY . 52362 1 96 . GLY . 52362 1 97 . GLY . 52362 1 98 . TYR . 52362 1 99 . LYS . 52362 1 100 . VAL . 52362 1 101 . PHE . 52362 1 102 . LEU . 52362 1 103 . GLY . 52362 1 104 . GLY . 52362 1 105 . LEU . 52362 1 106 . PRO . 52362 1 107 . SER . 52362 1 108 . ASN . 52362 1 109 . VAL . 52362 1 110 . THR . 52362 1 111 . GLU . 52362 1 112 . THR . 52362 1 113 . ASP . 52362 1 114 . LEU . 52362 1 115 . ARG . 52362 1 116 . THR . 52362 1 117 . PHE . 52362 1 118 . PHE . 52362 1 119 . ASN . 52362 1 120 . ARG . 52362 1 121 . TYR . 52362 1 122 . GLY . 52362 1 123 . LYS . 52362 1 124 . VAL . 52362 1 125 . THR . 52362 1 126 . GLU . 52362 1 127 . VAL . 52362 1 128 . VAL . 52362 1 129 . ILE . 52362 1 130 . MET . 52362 1 131 . TYR . 52362 1 132 . ASP . 52362 1 133 . GLN . 52362 1 134 . GLU . 52362 1 135 . LYS . 52362 1 136 . LYS . 52362 1 137 . LYS . 52362 1 138 . SER . 52362 1 139 . ARG . 52362 1 140 . GLY . 52362 1 141 . PHE . 52362 1 142 . GLY . 52362 1 143 . PHE . 52362 1 144 . LEU . 52362 1 145 . SER . 52362 1 146 . PHE . 52362 1 147 . GLU . 52362 1 148 . GLU . 52362 1 149 . GLU . 52362 1 150 . SER . 52362 1 151 . SER . 52362 1 152 . VAL . 52362 1 153 . GLU . 52362 1 154 . HIS . 52362 1 155 . VAL . 52362 1 156 . THR . 52362 1 157 . ASN . 52362 1 158 . GLU . 52362 1 159 . ARG . 52362 1 160 . TYR . 52362 1 161 . ILE . 52362 1 162 . ASN . 52362 1 163 . LEU . 52362 1 164 . ASN . 52362 1 165 . GLY . 52362 1 166 . LYS . 52362 1 167 . GLN . 52362 1 168 . VAL . 52362 1 169 . GLU . 52362 1 170 . ILE . 52362 1 171 . LYS . 52362 1 172 . LYS . 52362 1 173 . ALA . 52362 1 174 . GLU . 52362 1 175 . PRO . 52362 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 52362 1 . ALA 2 2 52362 1 . MET 3 3 52362 1 . GLU 4 4 52362 1 . GLU 5 5 52362 1 . ASP 6 6 52362 1 . GLU 7 7 52362 1 . ARG 8 8 52362 1 . GLY 9 9 52362 1 . LYS 10 10 52362 1 . LEU 11 11 52362 1 . PHE 12 12 52362 1 . VAL 13 13 52362 1 . GLY 14 14 52362 1 . GLY 15 15 52362 1 . LEU 16 16 52362 1 . SER 17 17 52362 1 . TRP 18 18 52362 1 . GLU 19 19 52362 1 . THR 20 20 52362 1 . THR 21 21 52362 1 . GLN 22 22 52362 1 . GLU 23 23 52362 1 . ASN 24 24 52362 1 . LEU 25 25 52362 1 . SER 26 26 52362 1 . ARG 27 27 52362 1 . TYR 28 28 52362 1 . PHE 29 29 52362 1 . CYS 30 30 52362 1 . ARG 31 31 52362 1 . PHE 32 32 52362 1 . GLY 33 33 52362 1 . ASP 34 34 52362 1 . ILE 35 35 52362 1 . ILE 36 36 52362 1 . ASP 37 37 52362 1 . CYS 38 38 52362 1 . VAL 39 39 52362 1 . VAL 40 40 52362 1 . MET 41 41 52362 1 . LYS 42 42 52362 1 . ASN 43 43 52362 1 . ASN 44 44 52362 1 . GLU 45 45 52362 1 . SER 46 46 52362 1 . GLY 47 47 52362 1 . ARG 48 48 52362 1 . SER 49 49 52362 1 . ARG 50 50 52362 1 . GLY 51 51 52362 1 . PHE 52 52 52362 1 . GLY 53 53 52362 1 . PHE 54 54 52362 1 . VAL 55 55 52362 1 . THR 56 56 52362 1 . PHE 57 57 52362 1 . ALA 58 58 52362 1 . ASP 59 59 52362 1 . PRO 60 60 52362 1 . THR 61 61 52362 1 . ASN 62 62 52362 1 . VAL 63 63 52362 1 . ASN 64 64 52362 1 . HIS 65 65 52362 1 . VAL 66 66 52362 1 . LEU 67 67 52362 1 . GLN 68 68 52362 1 . ASN 69 69 52362 1 . GLY 70 70 52362 1 . PRO 71 71 52362 1 . HIS 72 72 52362 1 . THR 73 73 52362 1 . LEU 74 74 52362 1 . ASP 75 75 52362 1 . GLY 76 76 52362 1 . ARG 77 77 52362 1 . THR 78 78 52362 1 . ILE 79 79 52362 1 . ASP 80 80 52362 1 . PRO 81 81 52362 1 . LYS 82 82 52362 1 . PRO 83 83 52362 1 . CYS 84 84 52362 1 . ASN 85 85 52362 1 . PRO 86 86 52362 1 . ARG 87 87 52362 1 . THR 88 88 52362 1 . LEU 89 89 52362 1 . GLN 90 90 52362 1 . LYS 91 91 52362 1 . PRO 92 92 52362 1 . LYS 93 93 52362 1 . LYS 94 94 52362 1 . GLY 95 95 52362 1 . GLY 96 96 52362 1 . GLY 97 97 52362 1 . TYR 98 98 52362 1 . LYS 99 99 52362 1 . VAL 100 100 52362 1 . PHE 101 101 52362 1 . LEU 102 102 52362 1 . GLY 103 103 52362 1 . GLY 104 104 52362 1 . LEU 105 105 52362 1 . PRO 106 106 52362 1 . SER 107 107 52362 1 . ASN 108 108 52362 1 . VAL 109 109 52362 1 . THR 110 110 52362 1 . GLU 111 111 52362 1 . THR 112 112 52362 1 . ASP 113 113 52362 1 . LEU 114 114 52362 1 . ARG 115 115 52362 1 . THR 116 116 52362 1 . PHE 117 117 52362 1 . PHE 118 118 52362 1 . ASN 119 119 52362 1 . ARG 120 120 52362 1 . TYR 121 121 52362 1 . GLY 122 122 52362 1 . LYS 123 123 52362 1 . VAL 124 124 52362 1 . THR 125 125 52362 1 . GLU 126 126 52362 1 . VAL 127 127 52362 1 . VAL 128 128 52362 1 . ILE 129 129 52362 1 . MET 130 130 52362 1 . TYR 131 131 52362 1 . ASP 132 132 52362 1 . GLN 133 133 52362 1 . GLU 134 134 52362 1 . LYS 135 135 52362 1 . LYS 136 136 52362 1 . LYS 137 137 52362 1 . SER 138 138 52362 1 . ARG 139 139 52362 1 . GLY 140 140 52362 1 . PHE 141 141 52362 1 . GLY 142 142 52362 1 . PHE 143 143 52362 1 . LEU 144 144 52362 1 . SER 145 145 52362 1 . PHE 146 146 52362 1 . GLU 147 147 52362 1 . GLU 148 148 52362 1 . GLU 149 149 52362 1 . SER 150 150 52362 1 . SER 151 151 52362 1 . VAL 152 152 52362 1 . GLU 153 153 52362 1 . HIS 154 154 52362 1 . VAL 155 155 52362 1 . THR 156 156 52362 1 . ASN 157 157 52362 1 . GLU 158 158 52362 1 . ARG 159 159 52362 1 . TYR 160 160 52362 1 . ILE 161 161 52362 1 . ASN 162 162 52362 1 . LEU 163 163 52362 1 . ASN 164 164 52362 1 . GLY 165 165 52362 1 . LYS 166 166 52362 1 . GLN 167 167 52362 1 . VAL 168 168 52362 1 . GLU 169 169 52362 1 . ILE 170 170 52362 1 . LYS 171 171 52362 1 . LYS 172 172 52362 1 . ALA 173 173 52362 1 . GLU 174 174 52362 1 . PRO 175 175 52362 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 52362 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; UAGGAUUAAG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 10 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 . U . 52362 2 2 . A . 52362 2 3 . G . 52362 2 4 . G . 52362 2 5 . A . 52362 2 6 . U . 52362 2 7 . U . 52362 2 8 . A . 52362 2 9 . A . 52362 2 10 . G . 52362 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . U 1 1 52362 2 . A 2 2 52362 2 . G 3 3 52362 2 . G 4 4 52362 2 . A 5 5 52362 2 . U 6 6 52362 2 . U 7 7 52362 2 . A 8 8 52362 2 . A 9 9 52362 2 . G 10 10 52362 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52362 _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 . 7227 organism . 'Drosophila melanogaster' 'fruit fly' . . Eukaryota Metazoa Drosophila melanogaster . . . . . . . . . . . . . 52362 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52362 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pETM11 . . . 52362 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52362 _Sample.ID 1 _Sample.Name 'Hrp48 RRM12+10mer RNA' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 'Hrp48 RRM12' '[U-95% 13C; U-95% 15N]' . . 1 $entity_1 . . 205 160 250 uM . . . . 52362 1 2 '10mer RNA' 'natural abundance' . . 2 $entity_2 . . 307.5 240 375 uM . . . . 52362 1 3 D2O [U-2H] . . . . . . 5 . . % . . . . 52362 1 4 MES 'natural abundance' . . . . . . 20 . . mM . . . . 52362 1 5 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 52362 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 52362 _Sample_condition_list.ID 1 _Sample_condition_list.Name condition_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.4 . M 52362 1 pH 6.5 . pH 52362 1 pressure 1 . atm 52362 1 temperature 298 . K 52362 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52362 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52362 1 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 52362 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Avance 600' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52362 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Avance 800' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52362 _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 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52362 1 2 '3D HNCA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52362 1 3 '3D CBCACONH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52362 1 4 '3D HNCACB' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 52362 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 52362 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name reference_1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 52362 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.000000000 . . . . . 52362 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 52362 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 52362 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '13C 15N Hrp48 RRM12+10mer RNA' _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 '2D 1H-15N HSQC' . . . 52362 1 2 '3D HNCA' . . . 52362 1 3 '3D CBCACONH' . . . 52362 1 4 '3D HNCACB' . . . 52362 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52362 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 2 2 ALA H H 1 8.26 0.03 . 1 . . . . . 2 ALA H . 52362 1 2 . 1 . 1 2 2 ALA CA C 13 51.16 0.20 . 1 . . . . . 2 ALA CA . 52362 1 3 . 1 . 1 2 2 ALA CB C 13 17.16 0.20 . 1 . . . . . 2 ALA CB . 52362 1 4 . 1 . 1 2 2 ALA N N 15 129.66 0.20 . 1 . . . . . 2 ALA N . 52362 1 5 . 1 . 1 3 3 MET H H 1 8.47 0.03 . 1 . . . . . 3 MET H . 52362 1 6 . 1 . 1 3 3 MET CA C 13 53.13 0.20 . 1 . . . . . 3 MET CA . 52362 1 7 . 1 . 1 3 3 MET CB C 13 29.92 0.20 . 1 . . . . . 3 MET CB . 52362 1 8 . 1 . 1 3 3 MET N N 15 119.07 0.20 . 1 . . . . . 3 MET N . 52362 1 9 . 1 . 1 4 4 GLU H H 1 8.37 0.03 . 1 . . . . . 4 GLU H . 52362 1 10 . 1 . 1 4 4 GLU CA C 13 54.20 0.20 . 1 . . . . . 4 GLU CA . 52362 1 11 . 1 . 1 4 4 GLU CB C 13 27.40 0.20 . 1 . . . . . 4 GLU CB . 52362 1 12 . 1 . 1 4 4 GLU N N 15 121.27 0.20 . 1 . . . . . 4 GLU N . 52362 1 13 . 1 . 1 5 5 GLU H H 1 8.42 0.03 . 1 . . . . . 5 GLU H . 52362 1 14 . 1 . 1 5 5 GLU CA C 13 53.23 0.20 . 1 . . . . . 5 GLU CA . 52362 1 15 . 1 . 1 5 5 GLU CB C 13 27.70 0.20 . 1 . . . . . 5 GLU CB . 52362 1 16 . 1 . 1 5 5 GLU N N 15 121.26 0.20 . 1 . . . . . 5 GLU N . 52362 1 17 . 1 . 1 6 6 ASP H H 1 8.33 0.03 . 1 . . . . . 6 ASP H . 52362 1 18 . 1 . 1 6 6 ASP CA C 13 51.77 0.20 . 1 . . . . . 6 ASP CA . 52362 1 19 . 1 . 1 6 6 ASP CB C 13 38.54 0.20 . 1 . . . . . 6 ASP CB . 52362 1 20 . 1 . 1 6 6 ASP N N 15 121.51 0.20 . 1 . . . . . 6 ASP N . 52362 1 21 . 1 . 1 7 7 GLU H H 1 8.71 0.03 . 1 . . . . . 7 GLU H . 52362 1 22 . 1 . 1 7 7 GLU CA C 13 53.66 0.20 . 1 . . . . . 7 GLU CA . 52362 1 23 . 1 . 1 7 7 GLU CB C 13 27.25 0.20 . 1 . . . . . 7 GLU CB . 52362 1 24 . 1 . 1 7 7 GLU N N 15 121.22 0.20 . 1 . . . . . 7 GLU N . 52362 1 25 . 1 . 1 8 8 ARG H H 1 8.22 0.03 . 1 . . . . . 8 ARG H . 52362 1 26 . 1 . 1 8 8 ARG CA C 13 55.15 0.20 . 1 . . . . . 8 ARG CA . 52362 1 27 . 1 . 1 8 8 ARG CB C 13 27.64 0.20 . 1 . . . . . 8 ARG CB . 52362 1 28 . 1 . 1 8 8 ARG N N 15 120.73 0.20 . 1 . . . . . 8 ARG N . 52362 1 29 . 1 . 1 9 9 GLY H H 1 9.24 0.03 . 1 . . . . . 9 GLY H . 52362 1 30 . 1 . 1 9 9 GLY CA C 13 43.22 0.20 . 1 . . . . . 9 GLY CA . 52362 1 31 . 1 . 1 9 9 GLY N N 15 109.62 0.20 . 1 . . . . . 9 GLY N . 52362 1 32 . 1 . 1 10 10 LYS H H 1 7.64 0.03 . 1 . . . . . 10 LYS H . 52362 1 33 . 1 . 1 10 10 LYS CA C 13 52.89 0.20 . 1 . . . . . 10 LYS CA . 52362 1 34 . 1 . 1 10 10 LYS CB C 13 34.35 0.20 . 1 . . . . . 10 LYS CB . 52362 1 35 . 1 . 1 10 10 LYS N N 15 122.19 0.20 . 1 . . . . . 10 LYS N . 52362 1 36 . 1 . 1 11 11 LEU H H 1 9.53 0.03 . 1 . . . . . 11 LEU H . 52362 1 37 . 1 . 1 11 11 LEU CA C 13 50.63 0.20 . 1 . . . . . 11 LEU CA . 52362 1 38 . 1 . 1 11 11 LEU CB C 13 43.11 0.20 . 1 . . . . . 11 LEU CB . 52362 1 39 . 1 . 1 11 11 LEU N N 15 126.74 0.20 . 1 . . . . . 11 LEU N . 52362 1 40 . 1 . 1 12 12 PHE H H 1 8.60 0.03 . 1 . . . . . 12 PHE H . 52362 1 41 . 1 . 1 12 12 PHE CA C 13 54.48 0.20 . 1 . . . . . 12 PHE CA . 52362 1 42 . 1 . 1 12 12 PHE CB C 13 37.62 0.20 . 1 . . . . . 12 PHE CB . 52362 1 43 . 1 . 1 12 12 PHE N N 15 124.29 0.20 . 1 . . . . . 12 PHE N . 52362 1 44 . 1 . 1 13 13 VAL H H 1 7.82 0.03 . 1 . . . . . 13 VAL H . 52362 1 45 . 1 . 1 13 13 VAL CA C 13 58.25 0.20 . 1 . . . . . 13 VAL CA . 52362 1 46 . 1 . 1 13 13 VAL CB C 13 29.91 0.20 . 1 . . . . . 13 VAL CB . 52362 1 47 . 1 . 1 13 13 VAL N N 15 126.30 0.20 . 1 . . . . . 13 VAL N . 52362 1 48 . 1 . 1 14 14 GLY H H 1 7.66 0.03 . 1 . . . . . 14 GLY H . 52362 1 49 . 1 . 1 14 14 GLY CA C 13 40.45 0.20 . 1 . . . . . 14 GLY CA . 52362 1 50 . 1 . 1 14 14 GLY N N 15 112.69 0.20 . 1 . . . . . 14 GLY N . 52362 1 51 . 1 . 1 15 15 GLY H H 1 7.11 0.03 . 1 . . . . . 15 GLY H . 52362 1 52 . 1 . 1 15 15 GLY CA C 13 43.72 0.20 . 1 . . . . . 15 GLY CA . 52362 1 53 . 1 . 1 15 15 GLY N N 15 107.79 0.20 . 1 . . . . . 15 GLY N . 52362 1 54 . 1 . 1 16 16 LEU H H 1 7.54 0.03 . 1 . . . . . 16 LEU H . 52362 1 55 . 1 . 1 16 16 LEU CA C 13 51.10 0.20 . 1 . . . . . 16 LEU CA . 52362 1 56 . 1 . 1 16 16 LEU CB C 13 40.13 0.20 . 1 . . . . . 16 LEU CB . 52362 1 57 . 1 . 1 16 16 LEU N N 15 114.48 0.20 . 1 . . . . . 16 LEU N . 52362 1 58 . 1 . 1 17 17 SER H H 1 9.01 0.03 . 1 . . . . . 17 SER H . 52362 1 59 . 1 . 1 17 17 SER CA C 13 55.19 0.20 . 1 . . . . . 17 SER CA . 52362 1 60 . 1 . 1 17 17 SER CB C 13 60.19 0.20 . 1 . . . . . 17 SER CB . 52362 1 61 . 1 . 1 17 17 SER N N 15 115.36 0.20 . 1 . . . . . 17 SER N . 52362 1 62 . 1 . 1 18 18 TRP H H 1 8.37 0.03 . 1 . . . . . 18 TRP H . 52362 1 63 . 1 . 1 18 18 TRP HE1 H 1 9.75 0.03 . 1 . . . . . 18 TRP HE1 . 52362 1 64 . 1 . 1 18 18 TRP CA C 13 56.16 0.20 . 1 . . . . . 18 TRP CA . 52362 1 65 . 1 . 1 18 18 TRP CB C 13 25.49 0.20 . 1 . . . . . 18 TRP CB . 52362 1 66 . 1 . 1 18 18 TRP N N 15 128.23 0.20 . 1 . . . . . 18 TRP N . 52362 1 67 . 1 . 1 18 18 TRP NE1 N 15 128.33 0.20 . 1 . . . . . 18 TRP NE1 . 52362 1 68 . 1 . 1 19 19 GLU H H 1 7.84 0.03 . 1 . . . . . 19 GLU H . 52362 1 69 . 1 . 1 19 19 GLU CA C 13 53.78 0.20 . 1 . . . . . 19 GLU CA . 52362 1 70 . 1 . 1 19 19 GLU CB C 13 27.25 0.20 . 1 . . . . . 19 GLU CB . 52362 1 71 . 1 . 1 19 19 GLU N N 15 115.53 0.20 . 1 . . . . . 19 GLU N . 52362 1 72 . 1 . 1 20 20 THR H H 1 7.60 0.03 . 1 . . . . . 20 THR H . 52362 1 73 . 1 . 1 20 20 THR CA C 13 62.32 0.20 . 1 . . . . . 20 THR CA . 52362 1 74 . 1 . 1 20 20 THR CB C 13 65.43 0.20 . 1 . . . . . 20 THR CB . 52362 1 75 . 1 . 1 20 20 THR N N 15 117.93 0.20 . 1 . . . . . 20 THR N . 52362 1 76 . 1 . 1 21 21 THR H H 1 7.22 0.03 . 1 . . . . . 21 THR H . 52362 1 77 . 1 . 1 21 21 THR CA C 13 56.36 0.20 . 1 . . . . . 21 THR CA . 52362 1 78 . 1 . 1 21 21 THR CB C 13 69.26 0.20 . 1 . . . . . 21 THR CB . 52362 1 79 . 1 . 1 21 21 THR N N 15 118.78 0.20 . 1 . . . . . 21 THR N . 52362 1 80 . 1 . 1 22 22 GLN H H 1 9.19 0.03 . 1 . . . . . 22 GLN H . 52362 1 81 . 1 . 1 22 22 GLN CA C 13 56.94 0.20 . 1 . . . . . 22 GLN CA . 52362 1 82 . 1 . 1 22 22 GLN CB C 13 25.11 0.20 . 1 . . . . . 22 GLN CB . 52362 1 83 . 1 . 1 22 22 GLN N N 15 121.24 0.20 . 1 . . . . . 22 GLN N . 52362 1 84 . 1 . 1 23 23 GLU H H 1 8.70 0.03 . 1 . . . . . 23 GLU H . 52362 1 85 . 1 . 1 23 23 GLU CA C 13 57.32 0.20 . 1 . . . . . 23 GLU CA . 52362 1 86 . 1 . 1 23 23 GLU CB C 13 26.12 0.20 . 1 . . . . . 23 GLU CB . 52362 1 87 . 1 . 1 23 23 GLU N N 15 119.80 0.20 . 1 . . . . . 23 GLU N . 52362 1 88 . 1 . 1 24 24 ASN H H 1 7.68 0.03 . 1 . . . . . 24 ASN H . 52362 1 89 . 1 . 1 24 24 ASN CA C 13 52.73 0.20 . 1 . . . . . 24 ASN CA . 52362 1 90 . 1 . 1 24 24 ASN CB C 13 35.16 0.20 . 1 . . . . . 24 ASN CB . 52362 1 91 . 1 . 1 24 24 ASN N N 15 120.14 0.20 . 1 . . . . . 24 ASN N . 52362 1 92 . 1 . 1 25 25 LEU H H 1 8.27 0.03 . 1 . . . . . 25 LEU H . 52362 1 93 . 1 . 1 25 25 LEU CA C 13 55.30 0.20 . 1 . . . . . 25 LEU CA . 52362 1 94 . 1 . 1 25 25 LEU CB C 13 40.24 0.20 . 1 . . . . . 25 LEU CB . 52362 1 95 . 1 . 1 25 25 LEU N N 15 122.38 0.20 . 1 . . . . . 25 LEU N . 52362 1 96 . 1 . 1 26 26 SER H H 1 8.45 0.03 . 1 . . . . . 26 SER H . 52362 1 97 . 1 . 1 26 26 SER CA C 13 58.99 0.20 . 1 . . . . . 26 SER CA . 52362 1 98 . 1 . 1 26 26 SER CB C 13 60.36 0.20 . 1 . . . . . 26 SER CB . 52362 1 99 . 1 . 1 26 26 SER N N 15 114.86 0.20 . 1 . . . . . 26 SER N . 52362 1 100 . 1 . 1 27 27 ARG H H 1 8.21 0.03 . 1 . . . . . 27 ARG H . 52362 1 101 . 1 . 1 27 27 ARG CA C 13 56.48 0.20 . 1 . . . . . 27 ARG CA . 52362 1 102 . 1 . 1 27 27 ARG CB C 13 27.48 0.20 . 1 . . . . . 27 ARG CB . 52362 1 103 . 1 . 1 27 27 ARG N N 15 120.05 0.20 . 1 . . . . . 27 ARG N . 52362 1 104 . 1 . 1 28 28 TYR H H 1 7.66 0.03 . 1 . . . . . 28 TYR H . 52362 1 105 . 1 . 1 28 28 TYR CA C 13 59.37 0.20 . 1 . . . . . 28 TYR CA . 52362 1 106 . 1 . 1 28 28 TYR CB C 13 36.70 0.20 . 1 . . . . . 28 TYR CB . 52362 1 107 . 1 . 1 28 28 TYR N N 15 117.32 0.20 . 1 . . . . . 28 TYR N . 52362 1 108 . 1 . 1 29 29 PHE H H 1 8.15 0.03 . 1 . . . . . 29 PHE H . 52362 1 109 . 1 . 1 29 29 PHE CA C 13 60.80 0.20 . 1 . . . . . 29 PHE CA . 52362 1 110 . 1 . 1 29 29 PHE CB C 13 36.68 0.20 . 1 . . . . . 29 PHE CB . 52362 1 111 . 1 . 1 29 29 PHE N N 15 113.31 0.20 . 1 . . . . . 29 PHE N . 52362 1 112 . 1 . 1 30 30 CYS H H 1 8.83 0.03 . 1 . . . . . 30 CYS H . 52362 1 113 . 1 . 1 30 30 CYS CA C 13 58.11 0.20 . 1 . . . . . 30 CYS CA . 52362 1 114 . 1 . 1 30 30 CYS CB C 13 23.21 0.20 . 1 . . . . . 30 CYS CB . 52362 1 115 . 1 . 1 30 30 CYS N N 15 118.75 0.20 . 1 . . . . . 30 CYS N . 52362 1 116 . 1 . 1 31 31 ARG H H 1 7.01 0.03 . 1 . . . . . 31 ARG H . 52362 1 117 . 1 . 1 31 31 ARG CA C 13 55.02 0.20 . 1 . . . . . 31 ARG CA . 52362 1 118 . 1 . 1 31 31 ARG CB C 13 26.43 0.20 . 1 . . . . . 31 ARG CB . 52362 1 119 . 1 . 1 31 31 ARG N N 15 120.10 0.20 . 1 . . . . . 31 ARG N . 52362 1 120 . 1 . 1 32 32 PHE H H 1 8.03 0.03 . 1 . . . . . 32 PHE H . 52362 1 121 . 1 . 1 32 32 PHE CA C 13 55.71 0.20 . 1 . . . . . 32 PHE CA . 52362 1 122 . 1 . 1 32 32 PHE CB C 13 37.07 0.20 . 1 . . . . . 32 PHE CB . 52362 1 123 . 1 . 1 32 32 PHE N N 15 116.18 0.20 . 1 . . . . . 32 PHE N . 52362 1 124 . 1 . 1 33 33 GLY H H 1 7.33 0.03 . 1 . . . . . 33 GLY H . 52362 1 125 . 1 . 1 33 33 GLY CA C 13 41.98 0.20 . 1 . . . . . 33 GLY CA . 52362 1 126 . 1 . 1 33 33 GLY N N 15 106.00 0.20 . 1 . . . . . 33 GLY N . 52362 1 127 . 1 . 1 34 34 ASP H H 1 7.88 0.03 . 1 . . . . . 34 ASP H . 52362 1 128 . 1 . 1 34 34 ASP CA C 13 52.62 0.20 . 1 . . . . . 34 ASP CA . 52362 1 129 . 1 . 1 34 34 ASP CB C 13 38.33 0.20 . 1 . . . . . 34 ASP CB . 52362 1 130 . 1 . 1 34 34 ASP N N 15 116.09 0.20 . 1 . . . . . 34 ASP N . 52362 1 131 . 1 . 1 35 35 ILE H H 1 8.81 0.03 . 1 . . . . . 35 ILE H . 52362 1 132 . 1 . 1 35 35 ILE CA C 13 57.57 0.20 . 1 . . . . . 35 ILE CA . 52362 1 133 . 1 . 1 35 35 ILE CB C 13 37.46 0.20 . 1 . . . . . 35 ILE CB . 52362 1 134 . 1 . 1 35 35 ILE N N 15 124.92 0.20 . 1 . . . . . 35 ILE N . 52362 1 135 . 1 . 1 36 36 ILE H H 1 8.64 0.03 . 1 . . . . . 36 ILE H . 52362 1 136 . 1 . 1 36 36 ILE CA C 13 58.65 0.20 . 1 . . . . . 36 ILE CA . 52362 1 137 . 1 . 1 36 36 ILE CB C 13 36.34 0.20 . 1 . . . . . 36 ILE CB . 52362 1 138 . 1 . 1 36 36 ILE N N 15 121.60 0.20 . 1 . . . . . 36 ILE N . 52362 1 139 . 1 . 1 37 37 ASP H H 1 7.31 0.03 . 1 . . . . . 37 ASP H . 52362 1 140 . 1 . 1 37 37 ASP CA C 13 51.99 0.20 . 1 . . . . . 37 ASP CA . 52362 1 141 . 1 . 1 37 37 ASP CB C 13 41.49 0.20 . 1 . . . . . 37 ASP CB . 52362 1 142 . 1 . 1 37 37 ASP N N 15 119.28 0.20 . 1 . . . . . 37 ASP N . 52362 1 143 . 1 . 1 38 38 CYS H H 1 8.03 0.03 . 1 . . . . . 38 CYS H . 52362 1 144 . 1 . 1 38 38 CYS CA C 13 55.41 0.20 . 1 . . . . . 38 CYS CA . 52362 1 145 . 1 . 1 38 38 CYS CB C 13 24.90 0.20 . 1 . . . . . 38 CYS CB . 52362 1 146 . 1 . 1 38 38 CYS N N 15 124.82 0.20 . 1 . . . . . 38 CYS N . 52362 1 147 . 1 . 1 39 39 VAL H H 1 8.70 0.03 . 1 . . . . . 39 VAL H . 52362 1 148 . 1 . 1 39 39 VAL CA C 13 57.26 0.20 . 1 . . . . . 39 VAL CA . 52362 1 149 . 1 . 1 39 39 VAL CB C 13 33.35 0.20 . 1 . . . . . 39 VAL CB . 52362 1 150 . 1 . 1 39 39 VAL N N 15 126.60 0.20 . 1 . . . . . 39 VAL N . 52362 1 151 . 1 . 1 40 40 VAL H H 1 7.90 0.03 . 1 . . . . . 40 VAL H . 52362 1 152 . 1 . 1 40 40 VAL CA C 13 59.41 0.20 . 1 . . . . . 40 VAL CA . 52362 1 153 . 1 . 1 40 40 VAL CB C 13 31.68 0.20 . 1 . . . . . 40 VAL CB . 52362 1 154 . 1 . 1 40 40 VAL N N 15 124.52 0.20 . 1 . . . . . 40 VAL N . 52362 1 155 . 1 . 1 41 41 MET H H 1 8.32 0.03 . 1 . . . . . 41 MET H . 52362 1 156 . 1 . 1 41 41 MET CA C 13 51.83 0.20 . 1 . . . . . 41 MET CA . 52362 1 157 . 1 . 1 41 41 MET CB C 13 28.39 0.20 . 1 . . . . . 41 MET CB . 52362 1 158 . 1 . 1 41 41 MET N N 15 126.09 0.20 . 1 . . . . . 41 MET N . 52362 1 159 . 1 . 1 43 43 ASN H H 1 8.82 0.03 . 1 . . . . . 43 ASN H . 52362 1 160 . 1 . 1 43 43 ASN CA C 13 50.20 0.20 . 1 . . . . . 43 ASN CA . 52362 1 161 . 1 . 1 43 43 ASN CB C 13 36.63 0.20 . 1 . . . . . 43 ASN CB . 52362 1 162 . 1 . 1 43 43 ASN N N 15 121.99 0.20 . 1 . . . . . 43 ASN N . 52362 1 163 . 1 . 1 45 45 GLU H H 1 8.46 0.03 . 1 . . . . . 45 GLU H . 52362 1 164 . 1 . 1 45 45 GLU CA C 13 55.89 0.20 . 1 . . . . . 45 GLU CA . 52362 1 165 . 1 . 1 45 45 GLU CB C 13 27.17 0.20 . 1 . . . . . 45 GLU CB . 52362 1 166 . 1 . 1 45 45 GLU N N 15 118.85 0.20 . 1 . . . . . 45 GLU N . 52362 1 167 . 1 . 1 46 46 SER H H 1 8.06 0.03 . 1 . . . . . 46 SER H . 52362 1 168 . 1 . 1 46 46 SER CA C 13 55.27 0.20 . 1 . . . . . 46 SER CA . 52362 1 169 . 1 . 1 46 46 SER CB C 13 62.61 0.20 . 1 . . . . . 46 SER CB . 52362 1 170 . 1 . 1 46 46 SER N N 15 112.31 0.20 . 1 . . . . . 46 SER N . 52362 1 171 . 1 . 1 47 47 GLY H H 1 8.22 0.03 . 1 . . . . . 47 GLY H . 52362 1 172 . 1 . 1 47 47 GLY CA C 13 43.00 0.20 . 1 . . . . . 47 GLY CA . 52362 1 173 . 1 . 1 47 47 GLY N N 15 112.00 0.20 . 1 . . . . . 47 GLY N . 52362 1 174 . 1 . 1 48 48 ARG H H 1 7.67 0.03 . 1 . . . . . 48 ARG H . 52362 1 175 . 1 . 1 48 48 ARG CA C 13 52.84 0.20 . 1 . . . . . 48 ARG CA . 52362 1 176 . 1 . 1 48 48 ARG CB C 13 28.70 0.20 . 1 . . . . . 48 ARG CB . 52362 1 177 . 1 . 1 48 48 ARG N N 15 119.55 0.20 . 1 . . . . . 48 ARG N . 52362 1 178 . 1 . 1 49 49 SER H H 1 8.61 0.03 . 1 . . . . . 49 SER H . 52362 1 179 . 1 . 1 49 49 SER CA C 13 55.66 0.20 . 1 . . . . . 49 SER CA . 52362 1 180 . 1 . 1 49 49 SER CB C 13 61.38 0.20 . 1 . . . . . 49 SER CB . 52362 1 181 . 1 . 1 49 49 SER N N 15 114.73 0.20 . 1 . . . . . 49 SER N . 52362 1 182 . 1 . 1 50 50 ARG H H 1 8.87 0.03 . 1 . . . . . 50 ARG H . 52362 1 183 . 1 . 1 50 50 ARG CA C 13 53.43 0.20 . 1 . . . . . 50 ARG CA . 52362 1 184 . 1 . 1 50 50 ARG CB C 13 29.00 0.20 . 1 . . . . . 50 ARG CB . 52362 1 185 . 1 . 1 50 50 ARG N N 15 123.27 0.20 . 1 . . . . . 50 ARG N . 52362 1 186 . 1 . 1 51 51 GLY H H 1 9.01 0.03 . 1 . . . . . 51 GLY H . 52362 1 187 . 1 . 1 51 51 GLY CA C 13 42.57 0.20 . 1 . . . . . 51 GLY CA . 52362 1 188 . 1 . 1 51 51 GLY N N 15 107.78 0.20 . 1 . . . . . 51 GLY N . 52362 1 189 . 1 . 1 52 52 PHE H H 1 7.01 0.03 . 1 . . . . . 52 PHE H . 52362 1 190 . 1 . 1 52 52 PHE CA C 13 52.01 0.20 . 1 . . . . . 52 PHE CA . 52362 1 191 . 1 . 1 52 52 PHE CB C 13 39.44 0.20 . 1 . . . . . 52 PHE CB . 52362 1 192 . 1 . 1 52 52 PHE N N 15 111.89 0.20 . 1 . . . . . 52 PHE N . 52362 1 193 . 1 . 1 53 53 GLY H H 1 7.87 0.03 . 1 . . . . . 53 GLY H . 52362 1 194 . 1 . 1 53 53 GLY CA C 13 41.81 0.20 . 1 . . . . . 53 GLY CA . 52362 1 195 . 1 . 1 53 53 GLY N N 15 106.08 0.20 . 1 . . . . . 53 GLY N . 52362 1 196 . 1 . 1 54 54 PHE H H 1 8.33 0.03 . 1 . . . . . 54 PHE H . 52362 1 197 . 1 . 1 54 54 PHE CA C 13 53.39 0.20 . 1 . . . . . 54 PHE CA . 52362 1 198 . 1 . 1 54 54 PHE CB C 13 41.20 0.20 . 1 . . . . . 54 PHE CB . 52362 1 199 . 1 . 1 54 54 PHE N N 15 113.10 0.20 . 1 . . . . . 54 PHE N . 52362 1 200 . 1 . 1 55 55 VAL H H 1 8.69 0.03 . 1 . . . . . 55 VAL H . 52362 1 201 . 1 . 1 55 55 VAL CA C 13 57.37 0.20 . 1 . . . . . 55 VAL CA . 52362 1 202 . 1 . 1 55 55 VAL CB C 13 32.89 0.20 . 1 . . . . . 55 VAL CB . 52362 1 203 . 1 . 1 55 55 VAL N N 15 120.30 0.20 . 1 . . . . . 55 VAL N . 52362 1 204 . 1 . 1 56 56 THR H H 1 8.58 0.03 . 1 . . . . . 56 THR H . 52362 1 205 . 1 . 1 56 56 THR CA C 13 58.23 0.20 . 1 . . . . . 56 THR CA . 52362 1 206 . 1 . 1 56 56 THR CB C 13 66.82 0.20 . 1 . . . . . 56 THR CB . 52362 1 207 . 1 . 1 56 56 THR N N 15 120.94 0.20 . 1 . . . . . 56 THR N . 52362 1 208 . 1 . 1 57 57 PHE H H 1 8.94 0.03 . 1 . . . . . 57 PHE H . 52362 1 209 . 1 . 1 57 57 PHE CA C 13 55.67 0.20 . 1 . . . . . 57 PHE CA . 52362 1 210 . 1 . 1 57 57 PHE CB C 13 38.61 0.20 . 1 . . . . . 57 PHE CB . 52362 1 211 . 1 . 1 57 57 PHE N N 15 127.26 0.20 . 1 . . . . . 57 PHE N . 52362 1 212 . 1 . 1 58 58 ALA H H 1 8.11 0.03 . 1 . . . . . 58 ALA H . 52362 1 213 . 1 . 1 58 58 ALA CA C 13 51.66 0.20 . 1 . . . . . 58 ALA CA . 52362 1 214 . 1 . 1 58 58 ALA CB C 13 16.27 0.20 . 1 . . . . . 58 ALA CB . 52362 1 215 . 1 . 1 58 58 ALA N N 15 122.59 0.20 . 1 . . . . . 58 ALA N . 52362 1 216 . 1 . 1 59 59 ASP H H 1 8.64 0.03 . 1 . . . . . 59 ASP H . 52362 1 217 . 1 . 1 59 59 ASP CA C 13 46.49 0.20 . 1 . . . . . 59 ASP CA . 52362 1 218 . 1 . 1 59 59 ASP CB C 13 38.99 0.20 . 1 . . . . . 59 ASP CB . 52362 1 219 . 1 . 1 59 59 ASP N N 15 115.86 0.20 . 1 . . . . . 59 ASP N . 52362 1 220 . 1 . 1 60 60 PRO CA C 13 62.15 0.20 . 1 . . . . . 60 PRO CA . 52362 1 221 . 1 . 1 60 60 PRO CB C 13 29.77 0.20 . 1 . . . . . 60 PRO CB . 52362 1 222 . 1 . 1 61 61 THR H H 1 8.42 0.03 . 1 . . . . . 61 THR H . 52362 1 223 . 1 . 1 61 61 THR CA C 13 62.15 0.20 . 1 . . . . . 61 THR CA . 52362 1 224 . 1 . 1 61 61 THR CB C 13 66.06 0.20 . 1 . . . . . 61 THR CB . 52362 1 225 . 1 . 1 61 61 THR N N 15 113.17 0.20 . 1 . . . . . 61 THR N . 52362 1 226 . 1 . 1 62 62 ASN H H 1 7.97 0.03 . 1 . . . . . 62 ASN H . 52362 1 227 . 1 . 1 62 62 ASN CA C 13 52.41 0.20 . 1 . . . . . 62 ASN CA . 52362 1 228 . 1 . 1 62 62 ASN CB C 13 35.05 0.20 . 1 . . . . . 62 ASN CB . 52362 1 229 . 1 . 1 62 62 ASN N N 15 117.82 0.20 . 1 . . . . . 62 ASN N . 52362 1 230 . 1 . 1 63 63 VAL H H 1 7.36 0.03 . 1 . . . . . 63 VAL H . 52362 1 231 . 1 . 1 63 63 VAL CA C 13 64.70 0.20 . 1 . . . . . 63 VAL CA . 52362 1 232 . 1 . 1 63 63 VAL CB C 13 28.72 0.20 . 1 . . . . . 63 VAL CB . 52362 1 233 . 1 . 1 63 63 VAL N N 15 119.56 0.20 . 1 . . . . . 63 VAL N . 52362 1 234 . 1 . 1 64 64 ASN H H 1 7.44 0.03 . 1 . . . . . 64 ASN H . 52362 1 235 . 1 . 1 64 64 ASN CA C 13 53.49 0.20 . 1 . . . . . 64 ASN CA . 52362 1 236 . 1 . 1 64 64 ASN CB C 13 34.99 0.20 . 1 . . . . . 64 ASN CB . 52362 1 237 . 1 . 1 64 64 ASN N N 15 116.15 0.20 . 1 . . . . . 64 ASN N . 52362 1 238 . 1 . 1 65 65 HIS H H 1 7.09 0.03 . 1 . . . . . 65 HIS H . 52362 1 239 . 1 . 1 65 65 HIS CA C 13 55.28 0.20 . 1 . . . . . 65 HIS CA . 52362 1 240 . 1 . 1 65 65 HIS CB C 13 26.88 0.20 . 1 . . . . . 65 HIS CB . 52362 1 241 . 1 . 1 65 65 HIS N N 15 116.32 0.20 . 1 . . . . . 65 HIS N . 52362 1 242 . 1 . 1 66 66 VAL H H 1 7.57 0.03 . 1 . . . . . 66 VAL H . 52362 1 243 . 1 . 1 66 66 VAL CA C 13 63.99 0.20 . 1 . . . . . 66 VAL CA . 52362 1 244 . 1 . 1 66 66 VAL CB C 13 28.69 0.20 . 1 . . . . . 66 VAL CB . 52362 1 245 . 1 . 1 66 66 VAL N N 15 118.39 0.20 . 1 . . . . . 66 VAL N . 52362 1 246 . 1 . 1 67 67 LEU H H 1 7.83 0.03 . 1 . . . . . 67 LEU H . 52362 1 247 . 1 . 1 67 67 LEU CA C 13 54.58 0.20 . 1 . . . . . 67 LEU CA . 52362 1 248 . 1 . 1 67 67 LEU CB C 13 37.85 0.20 . 1 . . . . . 67 LEU CB . 52362 1 249 . 1 . 1 67 67 LEU N N 15 118.39 0.20 . 1 . . . . . 67 LEU N . 52362 1 250 . 1 . 1 68 68 GLN H H 1 7.79 0.03 . 1 . . . . . 68 GLN H . 52362 1 251 . 1 . 1 68 68 GLN CA C 13 53.53 0.20 . 1 . . . . . 68 GLN CA . 52362 1 252 . 1 . 1 68 68 GLN CB C 13 26.25 0.20 . 1 . . . . . 68 GLN CB . 52362 1 253 . 1 . 1 68 68 GLN N N 15 115.38 0.20 . 1 . . . . . 68 GLN N . 52362 1 254 . 1 . 1 69 69 ASN H H 1 7.38 0.03 . 1 . . . . . 69 ASN H . 52362 1 255 . 1 . 1 69 69 ASN CA C 13 50.83 0.20 . 1 . . . . . 69 ASN CA . 52362 1 256 . 1 . 1 69 69 ASN CB C 13 37.44 0.20 . 1 . . . . . 69 ASN CB . 52362 1 257 . 1 . 1 69 69 ASN N N 15 118.20 0.20 . 1 . . . . . 69 ASN N . 52362 1 258 . 1 . 1 70 70 GLY H H 1 7.95 0.03 . 1 . . . . . 70 GLY H . 52362 1 259 . 1 . 1 70 70 GLY CA C 13 41.18 0.20 . 1 . . . . . 70 GLY CA . 52362 1 260 . 1 . 1 70 70 GLY N N 15 106.63 0.20 . 1 . . . . . 70 GLY N . 52362 1 261 . 1 . 1 71 71 PRO CA C 13 59.15 0.20 . 1 . . . . . 71 PRO CA . 52362 1 262 . 1 . 1 71 71 PRO CB C 13 32.58 0.20 . 1 . . . . . 71 PRO CB . 52362 1 263 . 1 . 1 72 72 HIS H H 1 9.58 0.03 . 1 . . . . . 72 HIS H . 52362 1 264 . 1 . 1 72 72 HIS CA C 13 53.29 0.20 . 1 . . . . . 72 HIS CA . 52362 1 265 . 1 . 1 72 72 HIS CB C 13 30.07 0.20 . 1 . . . . . 72 HIS CB . 52362 1 266 . 1 . 1 72 72 HIS N N 15 123.02 0.20 . 1 . . . . . 72 HIS N . 52362 1 267 . 1 . 1 73 73 THR H H 1 8.20 0.03 . 1 . . . . . 73 THR H . 52362 1 268 . 1 . 1 73 73 THR CA C 13 57.47 0.20 . 1 . . . . . 73 THR CA . 52362 1 269 . 1 . 1 73 73 THR CB C 13 67.55 0.20 . 1 . . . . . 73 THR CB . 52362 1 270 . 1 . 1 73 73 THR N N 15 118.69 0.20 . 1 . . . . . 73 THR N . 52362 1 271 . 1 . 1 74 74 LEU H H 1 8.59 0.03 . 1 . . . . . 74 LEU H . 52362 1 272 . 1 . 1 74 74 LEU CA C 13 51.39 0.20 . 1 . . . . . 74 LEU CA . 52362 1 273 . 1 . 1 74 74 LEU CB C 13 41.86 0.20 . 1 . . . . . 74 LEU CB . 52362 1 274 . 1 . 1 74 74 LEU N N 15 125.26 0.20 . 1 . . . . . 74 LEU N . 52362 1 275 . 1 . 1 75 75 ASP H H 1 9.48 0.03 . 1 . . . . . 75 ASP H . 52362 1 276 . 1 . 1 75 75 ASP CA C 13 52.93 0.20 . 1 . . . . . 75 ASP CA . 52362 1 277 . 1 . 1 75 75 ASP CB C 13 36.51 0.20 . 1 . . . . . 75 ASP CB . 52362 1 278 . 1 . 1 75 75 ASP N N 15 128.07 0.20 . 1 . . . . . 75 ASP N . 52362 1 279 . 1 . 1 76 76 GLY H H 1 8.46 0.03 . 1 . . . . . 76 GLY H . 52362 1 280 . 1 . 1 76 76 GLY CA C 13 42.67 0.20 . 1 . . . . . 76 GLY CA . 52362 1 281 . 1 . 1 76 76 GLY N N 15 102.10 0.20 . 1 . . . . . 76 GLY N . 52362 1 282 . 1 . 1 77 77 ARG H H 1 7.47 0.03 . 1 . . . . . 77 ARG H . 52362 1 283 . 1 . 1 77 77 ARG CA C 13 50.14 0.20 . 1 . . . . . 77 ARG CA . 52362 1 284 . 1 . 1 77 77 ARG CB C 13 29.84 0.20 . 1 . . . . . 77 ARG CB . 52362 1 285 . 1 . 1 77 77 ARG N N 15 119.98 0.20 . 1 . . . . . 77 ARG N . 52362 1 286 . 1 . 1 78 78 THR H H 1 8.61 0.03 . 1 . . . . . 78 THR H . 52362 1 287 . 1 . 1 78 78 THR CA C 13 60.01 0.20 . 1 . . . . . 78 THR CA . 52362 1 288 . 1 . 1 78 78 THR CB C 13 65.89 0.20 . 1 . . . . . 78 THR CB . 52362 1 289 . 1 . 1 78 78 THR N N 15 119.56 0.20 . 1 . . . . . 78 THR N . 52362 1 290 . 1 . 1 79 79 ILE H H 1 8.20 0.03 . 1 . . . . . 79 ILE H . 52362 1 291 . 1 . 1 79 79 ILE CA C 13 58.15 0.20 . 1 . . . . . 79 ILE CA . 52362 1 292 . 1 . 1 79 79 ILE CB C 13 36.55 0.20 . 1 . . . . . 79 ILE CB . 52362 1 293 . 1 . 1 79 79 ILE N N 15 122.88 0.20 . 1 . . . . . 79 ILE N . 52362 1 294 . 1 . 1 80 80 ASP H H 1 8.40 0.03 . 1 . . . . . 80 ASP H . 52362 1 295 . 1 . 1 80 80 ASP CA C 13 48.70 0.20 . 1 . . . . . 80 ASP CA . 52362 1 296 . 1 . 1 80 80 ASP CB C 13 39.67 0.20 . 1 . . . . . 80 ASP CB . 52362 1 297 . 1 . 1 80 80 ASP N N 15 118.61 0.20 . 1 . . . . . 80 ASP N . 52362 1 298 . 1 . 1 81 81 PRO CA C 13 58.30 0.20 . 1 . . . . . 81 PRO CA . 52362 1 299 . 1 . 1 81 81 PRO CB C 13 29.85 0.20 . 1 . . . . . 81 PRO CB . 52362 1 300 . 1 . 1 82 82 LYS H H 1 9.70 0.03 . 1 . . . . . 82 LYS H . 52362 1 301 . 1 . 1 82 82 LYS CA C 13 50.81 0.20 . 1 . . . . . 82 LYS CA . 52362 1 302 . 1 . 1 82 82 LYS CB C 13 32.58 0.20 . 1 . . . . . 82 LYS CB . 52362 1 303 . 1 . 1 82 82 LYS N N 15 120.59 0.20 . 1 . . . . . 82 LYS N . 52362 1 304 . 1 . 1 83 83 PRO CA C 13 60.53 0.20 . 1 . . . . . 83 PRO CA . 52362 1 305 . 1 . 1 83 83 PRO CB C 13 29.30 0.20 . 1 . . . . . 83 PRO CB . 52362 1 306 . 1 . 1 84 84 CYS H H 1 8.27 0.03 . 1 . . . . . 84 CYS H . 52362 1 307 . 1 . 1 84 84 CYS CA C 13 57.48 0.20 . 1 . . . . . 84 CYS CA . 52362 1 308 . 1 . 1 84 84 CYS CB C 13 25.72 0.20 . 1 . . . . . 84 CYS CB . 52362 1 309 . 1 . 1 84 84 CYS N N 15 125.03 0.20 . 1 . . . . . 84 CYS N . 52362 1 310 . 1 . 1 85 85 ASN H H 1 8.69 0.03 . 1 . . . . . 85 ASN H . 52362 1 311 . 1 . 1 85 85 ASN CA C 13 48.20 0.20 . 1 . . . . . 85 ASN CA . 52362 1 312 . 1 . 1 85 85 ASN CB C 13 36.40 0.20 . 1 . . . . . 85 ASN CB . 52362 1 313 . 1 . 1 85 85 ASN N N 15 120.05 0.20 . 1 . . . . . 85 ASN N . 52362 1 314 . 1 . 1 86 86 PRO CA C 13 60.03 0.20 . 1 . . . . . 86 PRO CA . 52362 1 315 . 1 . 1 86 86 PRO CB C 13 31.91 0.20 . 1 . . . . . 86 PRO CB . 52362 1 316 . 1 . 1 87 87 ARG H H 1 8.32 0.03 . 1 . . . . . 87 ARG H . 52362 1 317 . 1 . 1 87 87 ARG CA C 13 53.90 0.20 . 1 . . . . . 87 ARG CA . 52362 1 318 . 1 . 1 87 87 ARG CB C 13 27.55 0.20 . 1 . . . . . 87 ARG CB . 52362 1 319 . 1 . 1 87 87 ARG N N 15 119.66 0.20 . 1 . . . . . 87 ARG N . 52362 1 320 . 1 . 1 88 88 THR H H 1 8.27 0.03 . 1 . . . . . 88 THR H . 52362 1 321 . 1 . 1 88 88 THR CA C 13 59.56 0.20 . 1 . . . . . 88 THR CA . 52362 1 322 . 1 . 1 88 88 THR CB C 13 66.95 0.20 . 1 . . . . . 88 THR CB . 52362 1 323 . 1 . 1 88 88 THR N N 15 116.35 0.20 . 1 . . . . . 88 THR N . 52362 1 324 . 1 . 1 89 89 LEU H H 1 8.14 0.03 . 1 . . . . . 89 LEU H . 52362 1 325 . 1 . 1 89 89 LEU CA C 13 57.74 0.20 . 1 . . . . . 89 LEU CA . 52362 1 326 . 1 . 1 89 89 LEU CB C 13 36.06 0.20 . 1 . . . . . 89 LEU CB . 52362 1 327 . 1 . 1 89 89 LEU N N 15 123.48 0.20 . 1 . . . . . 89 LEU N . 52362 1 328 . 1 . 1 90 90 GLN H H 1 8.36 0.03 . 1 . . . . . 90 GLN H . 52362 1 329 . 1 . 1 90 90 GLN CA C 13 53.23 0.20 . 1 . . . . . 90 GLN CA . 52362 1 330 . 1 . 1 90 90 GLN CB C 13 30.32 0.20 . 1 . . . . . 90 GLN CB . 52362 1 331 . 1 . 1 90 90 GLN N N 15 126.34 0.20 . 1 . . . . . 90 GLN N . 52362 1 332 . 1 . 1 91 91 LYS H H 1 8.40 0.03 . 1 . . . . . 91 LYS H . 52362 1 333 . 1 . 1 91 91 LYS CA C 13 53.13 0.20 . 1 . . . . . 91 LYS CA . 52362 1 334 . 1 . 1 91 91 LYS CB C 13 26.46 0.20 . 1 . . . . . 91 LYS CB . 52362 1 335 . 1 . 1 91 91 LYS N N 15 122.73 0.20 . 1 . . . . . 91 LYS N . 52362 1 336 . 1 . 1 93 93 LYS H H 1 8.39 0.03 . 1 . . . . . 93 LYS H . 52362 1 337 . 1 . 1 93 93 LYS CA C 13 53.66 0.20 . 1 . . . . . 93 LYS CA . 52362 1 338 . 1 . 1 93 93 LYS CB C 13 30.20 0.20 . 1 . . . . . 93 LYS CB . 52362 1 339 . 1 . 1 93 93 LYS N N 15 122.35 0.20 . 1 . . . . . 93 LYS N . 52362 1 340 . 1 . 1 94 94 LYS H H 1 8.38 0.03 . 1 . . . . . 94 LYS H . 52362 1 341 . 1 . 1 94 94 LYS CA C 13 53.72 0.20 . 1 . . . . . 94 LYS CA . 52362 1 342 . 1 . 1 94 94 LYS CB C 13 30.43 0.20 . 1 . . . . . 94 LYS CB . 52362 1 343 . 1 . 1 94 94 LYS N N 15 123.66 0.20 . 1 . . . . . 94 LYS N . 52362 1 344 . 1 . 1 95 95 GLY H H 1 8.68 0.03 . 1 . . . . . 95 GLY H . 52362 1 345 . 1 . 1 95 95 GLY CA C 13 42.23 0.20 . 1 . . . . . 95 GLY CA . 52362 1 346 . 1 . 1 95 95 GLY N N 15 110.94 0.20 . 1 . . . . . 95 GLY N . 52362 1 347 . 1 . 1 96 96 GLY H H 1 8.26 0.03 . 1 . . . . . 96 GLY H . 52362 1 348 . 1 . 1 96 96 GLY CA C 13 42.17 0.20 . 1 . . . . . 96 GLY CA . 52362 1 349 . 1 . 1 96 96 GLY N N 15 108.36 0.20 . 1 . . . . . 96 GLY N . 52362 1 350 . 1 . 1 97 97 GLY H H 1 8.08 0.03 . 1 . . . . . 97 GLY H . 52362 1 351 . 1 . 1 97 97 GLY CA C 13 41.92 0.20 . 1 . . . . . 97 GLY CA . 52362 1 352 . 1 . 1 97 97 GLY N N 15 108.43 0.20 . 1 . . . . . 97 GLY N . 52362 1 353 . 1 . 1 98 98 TYR H H 1 8.58 0.03 . 1 . . . . . 98 TYR H . 52362 1 354 . 1 . 1 98 98 TYR CA C 13 57.99 0.20 . 1 . . . . . 98 TYR CA . 52362 1 355 . 1 . 1 98 98 TYR CB C 13 36.90 0.20 . 1 . . . . . 98 TYR CB . 52362 1 356 . 1 . 1 98 98 TYR N N 15 120.80 0.20 . 1 . . . . . 98 TYR N . 52362 1 357 . 1 . 1 100 100 VAL H H 1 9.53 0.03 . 1 . . . . . 100 VAL H . 52362 1 358 . 1 . 1 100 100 VAL CA C 13 57.13 0.20 . 1 . . . . . 100 VAL CA . 52362 1 359 . 1 . 1 100 100 VAL CB C 13 32.42 0.20 . 1 . . . . . 100 VAL CB . 52362 1 360 . 1 . 1 100 100 VAL N N 15 118.27 0.20 . 1 . . . . . 100 VAL N . 52362 1 361 . 1 . 1 101 101 PHE H H 1 9.24 0.03 . 1 . . . . . 101 PHE H . 52362 1 362 . 1 . 1 101 101 PHE CA C 13 53.77 0.20 . 1 . . . . . 101 PHE CA . 52362 1 363 . 1 . 1 101 101 PHE CB C 13 38.48 0.20 . 1 . . . . . 101 PHE CB . 52362 1 364 . 1 . 1 101 101 PHE N N 15 124.14 0.20 . 1 . . . . . 101 PHE N . 52362 1 365 . 1 . 1 102 102 LEU H H 1 7.48 0.03 . 1 . . . . . 102 LEU H . 52362 1 366 . 1 . 1 102 102 LEU CA C 13 49.15 0.20 . 1 . . . . . 102 LEU CA . 52362 1 367 . 1 . 1 102 102 LEU CB C 13 40.25 0.20 . 1 . . . . . 102 LEU CB . 52362 1 368 . 1 . 1 102 102 LEU N N 15 125.48 0.20 . 1 . . . . . 102 LEU N . 52362 1 369 . 1 . 1 103 103 GLY H H 1 9.24 0.03 . 1 . . . . . 103 GLY H . 52362 1 370 . 1 . 1 103 103 GLY CA C 13 42.31 0.20 . 1 . . . . . 103 GLY CA . 52362 1 371 . 1 . 1 103 103 GLY N N 15 108.39 0.20 . 1 . . . . . 103 GLY N . 52362 1 372 . 1 . 1 104 104 GLY H H 1 8.87 0.03 . 1 . . . . . 104 GLY H . 52362 1 373 . 1 . 1 104 104 GLY CA C 13 43.42 0.20 . 1 . . . . . 104 GLY CA . 52362 1 374 . 1 . 1 104 104 GLY N N 15 106.84 0.20 . 1 . . . . . 104 GLY N . 52362 1 375 . 1 . 1 105 105 LEU H H 1 7.94 0.03 . 1 . . . . . 105 LEU H . 52362 1 376 . 1 . 1 105 105 LEU CA C 13 50.01 0.20 . 1 . . . . . 105 LEU CA . 52362 1 377 . 1 . 1 105 105 LEU CB C 13 39.22 0.20 . 1 . . . . . 105 LEU CB . 52362 1 378 . 1 . 1 105 105 LEU N N 15 117.44 0.20 . 1 . . . . . 105 LEU N . 52362 1 379 . 1 . 1 107 107 SER H H 1 8.85 0.03 . 1 . . . . . 107 SER H . 52362 1 380 . 1 . 1 107 107 SER CA C 13 57.95 0.20 . 1 . . . . . 107 SER CA . 52362 1 381 . 1 . 1 107 107 SER N N 15 117.48 0.20 . 1 . . . . . 107 SER N . 52362 1 382 . 1 . 1 108 108 ASN H H 1 8.18 0.03 . 1 . . . . . 108 ASN H . 52362 1 383 . 1 . 1 108 108 ASN CA C 13 49.82 0.20 . 1 . . . . . 108 ASN CA . 52362 1 384 . 1 . 1 108 108 ASN CB C 13 34.87 0.20 . 1 . . . . . 108 ASN CB . 52362 1 385 . 1 . 1 108 108 ASN N N 15 117.27 0.20 . 1 . . . . . 108 ASN N . 52362 1 386 . 1 . 1 109 109 VAL H H 1 6.96 0.03 . 1 . . . . . 109 VAL H . 52362 1 387 . 1 . 1 109 109 VAL CA C 13 59.13 0.20 . 1 . . . . . 109 VAL CA . 52362 1 388 . 1 . 1 109 109 VAL CB C 13 29.61 0.20 . 1 . . . . . 109 VAL CB . 52362 1 389 . 1 . 1 109 109 VAL N N 15 118.24 0.20 . 1 . . . . . 109 VAL N . 52362 1 390 . 1 . 1 110 110 THR H H 1 8.67 0.03 . 1 . . . . . 110 THR H . 52362 1 391 . 1 . 1 110 110 THR CA C 13 56.77 0.20 . 1 . . . . . 110 THR CA . 52362 1 392 . 1 . 1 110 110 THR CB C 13 70.05 0.20 . 1 . . . . . 110 THR CB . 52362 1 393 . 1 . 1 110 110 THR N N 15 116.25 0.20 . 1 . . . . . 110 THR N . 52362 1 394 . 1 . 1 111 111 GLU H H 1 9.66 0.03 . 1 . . . . . 111 GLU H . 52362 1 395 . 1 . 1 111 111 GLU CA C 13 58.35 0.20 . 1 . . . . . 111 GLU CA . 52362 1 396 . 1 . 1 111 111 GLU CB C 13 25.76 0.20 . 1 . . . . . 111 GLU CB . 52362 1 397 . 1 . 1 111 111 GLU N N 15 120.52 0.20 . 1 . . . . . 111 GLU N . 52362 1 398 . 1 . 1 112 112 THR H H 1 8.35 0.03 . 1 . . . . . 112 THR H . 52362 1 399 . 1 . 1 112 112 THR CA C 13 63.76 0.20 . 1 . . . . . 112 THR CA . 52362 1 400 . 1 . 1 112 112 THR CB C 13 65.73 0.20 . 1 . . . . . 112 THR CB . 52362 1 401 . 1 . 1 112 112 THR N N 15 113.07 0.20 . 1 . . . . . 112 THR N . 52362 1 402 . 1 . 1 113 113 ASP H H 1 7.77 0.03 . 1 . . . . . 113 ASP H . 52362 1 403 . 1 . 1 113 113 ASP CA C 13 54.90 0.20 . 1 . . . . . 113 ASP CA . 52362 1 404 . 1 . 1 113 113 ASP CB C 13 38.16 0.20 . 1 . . . . . 113 ASP CB . 52362 1 405 . 1 . 1 113 113 ASP N N 15 123.09 0.20 . 1 . . . . . 113 ASP N . 52362 1 406 . 1 . 1 114 114 LEU H H 1 7.66 0.03 . 1 . . . . . 114 LEU H . 52362 1 407 . 1 . 1 114 114 LEU CA C 13 55.19 0.20 . 1 . . . . . 114 LEU CA . 52362 1 408 . 1 . 1 114 114 LEU CB C 13 39.14 0.20 . 1 . . . . . 114 LEU CB . 52362 1 409 . 1 . 1 114 114 LEU N N 15 117.87 0.20 . 1 . . . . . 114 LEU N . 52362 1 410 . 1 . 1 115 115 ARG H H 1 8.58 0.03 . 1 . . . . . 115 ARG H . 52362 1 411 . 1 . 1 115 115 ARG CA C 13 58.31 0.20 . 1 . . . . . 115 ARG CA . 52362 1 412 . 1 . 1 115 115 ARG CB C 13 27.51 0.20 . 1 . . . . . 115 ARG CB . 52362 1 413 . 1 . 1 115 115 ARG N N 15 120.30 0.20 . 1 . . . . . 115 ARG N . 52362 1 414 . 1 . 1 116 116 THR H H 1 8.50 0.03 . 1 . . . . . 116 THR H . 52362 1 415 . 1 . 1 116 116 THR CA C 13 63.55 0.20 . 1 . . . . . 116 THR CA . 52362 1 416 . 1 . 1 116 116 THR CB C 13 66.27 0.20 . 1 . . . . . 116 THR CB . 52362 1 417 . 1 . 1 116 116 THR N N 15 113.21 0.20 . 1 . . . . . 116 THR N . 52362 1 418 . 1 . 1 117 117 PHE H H 1 7.79 0.03 . 1 . . . . . 117 PHE H . 52362 1 419 . 1 . 1 117 117 PHE CA C 13 59.53 0.20 . 1 . . . . . 117 PHE CA . 52362 1 420 . 1 . 1 117 117 PHE CB C 13 36.97 0.20 . 1 . . . . . 117 PHE CB . 52362 1 421 . 1 . 1 117 117 PHE N N 15 119.91 0.20 . 1 . . . . . 117 PHE N . 52362 1 422 . 1 . 1 118 118 PHE H H 1 8.86 0.03 . 1 . . . . . 118 PHE H . 52362 1 423 . 1 . 1 118 118 PHE CA C 13 60.12 0.20 . 1 . . . . . 118 PHE CA . 52362 1 424 . 1 . 1 118 118 PHE CB C 13 35.78 0.20 . 1 . . . . . 118 PHE CB . 52362 1 425 . 1 . 1 118 118 PHE N N 15 113.27 0.20 . 1 . . . . . 118 PHE N . 52362 1 426 . 1 . 1 119 119 ASN H H 1 8.24 0.03 . 1 . . . . . 119 ASN H . 52362 1 427 . 1 . 1 119 119 ASN CA C 13 52.05 0.20 . 1 . . . . . 119 ASN CA . 52362 1 428 . 1 . 1 119 119 ASN CB C 13 35.71 0.20 . 1 . . . . . 119 ASN CB . 52362 1 429 . 1 . 1 119 119 ASN N N 15 120.64 0.20 . 1 . . . . . 119 ASN N . 52362 1 430 . 1 . 1 120 120 ARG H H 1 7.22 0.03 . 1 . . . . . 120 ARG H . 52362 1 431 . 1 . 1 120 120 ARG CA C 13 55.07 0.20 . 1 . . . . . 120 ARG CA . 52362 1 432 . 1 . 1 120 120 ARG CB C 13 26.04 0.20 . 1 . . . . . 120 ARG CB . 52362 1 433 . 1 . 1 120 120 ARG N N 15 116.03 0.20 . 1 . . . . . 120 ARG N . 52362 1 434 . 1 . 1 121 121 TYR H H 1 8.09 0.03 . 1 . . . . . 121 TYR H . 52362 1 435 . 1 . 1 121 121 TYR CA C 13 55.72 0.20 . 1 . . . . . 121 TYR CA . 52362 1 436 . 1 . 1 121 121 TYR CB C 13 36.97 0.20 . 1 . . . . . 121 TYR CB . 52362 1 437 . 1 . 1 121 121 TYR N N 15 116.61 0.20 . 1 . . . . . 121 TYR N . 52362 1 438 . 1 . 1 122 122 GLY H H 1 7.72 0.03 . 1 . . . . . 122 GLY H . 52362 1 439 . 1 . 1 122 122 GLY CA C 13 42.24 0.20 . 1 . . . . . 122 GLY CA . 52362 1 440 . 1 . 1 122 122 GLY N N 15 109.13 0.20 . 1 . . . . . 122 GLY N . 52362 1 441 . 1 . 1 123 123 LYS H H 1 8.55 0.03 . 1 . . . . . 123 LYS H . 52362 1 442 . 1 . 1 123 123 LYS CA C 13 53.72 0.20 . 1 . . . . . 123 LYS CA . 52362 1 443 . 1 . 1 123 123 LYS CB C 13 30.32 0.20 . 1 . . . . . 123 LYS CB . 52362 1 444 . 1 . 1 123 123 LYS N N 15 119.77 0.20 . 1 . . . . . 123 LYS N . 52362 1 445 . 1 . 1 124 124 VAL H H 1 8.63 0.03 . 1 . . . . . 124 VAL H . 52362 1 446 . 1 . 1 124 124 VAL CA C 13 59.40 0.20 . 1 . . . . . 124 VAL CA . 52362 1 447 . 1 . 1 124 124 VAL CB C 13 29.90 0.20 . 1 . . . . . 124 VAL CB . 52362 1 448 . 1 . 1 124 124 VAL N N 15 128.79 0.20 . 1 . . . . . 124 VAL N . 52362 1 449 . 1 . 1 125 125 THR H H 1 9.07 0.03 . 1 . . . . . 125 THR H . 52362 1 450 . 1 . 1 125 125 THR CA C 13 59.07 0.20 . 1 . . . . . 125 THR CA . 52362 1 451 . 1 . 1 125 125 THR CB C 13 65.64 0.20 . 1 . . . . . 125 THR CB . 52362 1 452 . 1 . 1 125 125 THR N N 15 120.73 0.20 . 1 . . . . . 125 THR N . 52362 1 453 . 1 . 1 126 126 GLU H H 1 7.42 0.03 . 1 . . . . . 126 GLU H . 52362 1 454 . 1 . 1 126 126 GLU CA C 13 53.61 0.20 . 1 . . . . . 126 GLU CA . 52362 1 455 . 1 . 1 126 126 GLU CB C 13 30.34 0.20 . 1 . . . . . 126 GLU CB . 52362 1 456 . 1 . 1 126 126 GLU N N 15 121.83 0.20 . 1 . . . . . 126 GLU N . 52362 1 457 . 1 . 1 127 127 VAL H H 1 8.45 0.03 . 1 . . . . . 127 VAL H . 52362 1 458 . 1 . 1 127 127 VAL CA C 13 58.78 0.20 . 1 . . . . . 127 VAL CA . 52362 1 459 . 1 . 1 127 127 VAL CB C 13 32.43 0.20 . 1 . . . . . 127 VAL CB . 52362 1 460 . 1 . 1 127 127 VAL N N 15 123.22 0.20 . 1 . . . . . 127 VAL N . 52362 1 461 . 1 . 1 128 128 VAL H H 1 8.99 0.03 . 1 . . . . . 128 VAL H . 52362 1 462 . 1 . 1 128 128 VAL CA C 13 58.08 0.20 . 1 . . . . . 128 VAL CA . 52362 1 463 . 1 . 1 128 128 VAL CB C 13 32.69 0.20 . 1 . . . . . 128 VAL CB . 52362 1 464 . 1 . 1 128 128 VAL N N 15 126.16 0.20 . 1 . . . . . 128 VAL N . 52362 1 465 . 1 . 1 129 129 ILE H H 1 8.69 0.03 . 1 . . . . . 129 ILE H . 52362 1 466 . 1 . 1 129 129 ILE CA C 13 58.28 0.20 . 1 . . . . . 129 ILE CA . 52362 1 467 . 1 . 1 129 129 ILE CB C 13 36.90 0.20 . 1 . . . . . 129 ILE CB . 52362 1 468 . 1 . 1 129 129 ILE N N 15 127.05 0.20 . 1 . . . . . 129 ILE N . 52362 1 469 . 1 . 1 130 130 MET H H 1 7.96 0.03 . 1 . . . . . 130 MET H . 52362 1 470 . 1 . 1 130 130 MET CA C 13 51.80 0.20 . 1 . . . . . 130 MET CA . 52362 1 471 . 1 . 1 130 130 MET N N 15 125.02 0.20 . 1 . . . . . 130 MET N . 52362 1 472 . 1 . 1 131 131 TYR H H 1 8.60 0.03 . 1 . . . . . 131 TYR H . 52362 1 473 . 1 . 1 131 131 TYR CA C 13 55.03 0.20 . 1 . . . . . 131 TYR CA . 52362 1 474 . 1 . 1 131 131 TYR CB C 13 39.28 0.20 . 1 . . . . . 131 TYR CB . 52362 1 475 . 1 . 1 131 131 TYR N N 15 122.78 0.20 . 1 . . . . . 131 TYR N . 52362 1 476 . 1 . 1 132 132 ASP H H 1 8.57 0.03 . 1 . . . . . 132 ASP H . 52362 1 477 . 1 . 1 132 132 ASP CA C 13 50.41 0.20 . 1 . . . . . 132 ASP CA . 52362 1 478 . 1 . 1 132 132 ASP CB C 13 38.81 0.20 . 1 . . . . . 132 ASP CB . 52362 1 479 . 1 . 1 132 132 ASP N N 15 123.07 0.20 . 1 . . . . . 132 ASP N . 52362 1 480 . 1 . 1 133 133 GLN H H 1 8.68 0.03 . 1 . . . . . 133 GLN H . 52362 1 481 . 1 . 1 133 133 GLN CA C 13 55.59 0.20 . 1 . . . . . 133 GLN CA . 52362 1 482 . 1 . 1 133 133 GLN CB C 13 25.90 0.20 . 1 . . . . . 133 GLN CB . 52362 1 483 . 1 . 1 133 133 GLN N N 15 121.49 0.20 . 1 . . . . . 133 GLN N . 52362 1 484 . 1 . 1 134 134 GLU H H 1 8.22 0.03 . 1 . . . . . 134 GLU H . 52362 1 485 . 1 . 1 134 134 GLU CA C 13 55.26 0.20 . 1 . . . . . 134 GLU CA . 52362 1 486 . 1 . 1 134 134 GLU CB C 13 27.23 0.20 . 1 . . . . . 134 GLU CB . 52362 1 487 . 1 . 1 134 134 GLU N N 15 118.30 0.20 . 1 . . . . . 134 GLU N . 52362 1 488 . 1 . 1 135 135 LYS H H 1 7.92 0.03 . 1 . . . . . 135 LYS H . 52362 1 489 . 1 . 1 135 135 LYS CA C 13 53.43 0.20 . 1 . . . . . 135 LYS CA . 52362 1 490 . 1 . 1 135 135 LYS CB C 13 29.41 0.20 . 1 . . . . . 135 LYS CB . 52362 1 491 . 1 . 1 135 135 LYS N N 15 117.10 0.20 . 1 . . . . . 135 LYS N . 52362 1 492 . 1 . 1 138 138 SER H H 1 8.76 0.03 . 1 . . . . . 138 SER H . 52362 1 493 . 1 . 1 138 138 SER CA C 13 55.26 0.20 . 1 . . . . . 138 SER CA . 52362 1 494 . 1 . 1 138 138 SER CB C 13 61.17 0.20 . 1 . . . . . 138 SER CB . 52362 1 495 . 1 . 1 138 138 SER N N 15 117.30 0.20 . 1 . . . . . 138 SER N . 52362 1 496 . 1 . 1 139 139 ARG H H 1 8.82 0.03 . 1 . . . . . 139 ARG H . 52362 1 497 . 1 . 1 139 139 ARG CA C 13 53.79 0.20 . 1 . . . . . 139 ARG CA . 52362 1 498 . 1 . 1 139 139 ARG CB C 13 28.35 0.20 . 1 . . . . . 139 ARG CB . 52362 1 499 . 1 . 1 139 139 ARG N N 15 123.47 0.20 . 1 . . . . . 139 ARG N . 52362 1 500 . 1 . 1 140 140 GLY H H 1 9.06 0.03 . 1 . . . . . 140 GLY H . 52362 1 501 . 1 . 1 140 140 GLY CA C 13 43.65 0.20 . 1 . . . . . 140 GLY CA . 52362 1 502 . 1 . 1 140 140 GLY N N 15 106.31 0.20 . 1 . . . . . 140 GLY N . 52362 1 503 . 1 . 1 141 141 PHE H H 1 7.26 0.03 . 1 . . . . . 141 PHE H . 52362 1 504 . 1 . 1 141 141 PHE CA C 13 52.16 0.20 . 1 . . . . . 141 PHE CA . 52362 1 505 . 1 . 1 141 141 PHE CB C 13 39.10 0.20 . 1 . . . . . 141 PHE CB . 52362 1 506 . 1 . 1 141 141 PHE N N 15 115.11 0.20 . 1 . . . . . 141 PHE N . 52362 1 507 . 1 . 1 142 142 GLY H H 1 7.75 0.03 . 1 . . . . . 142 GLY H . 52362 1 508 . 1 . 1 142 142 GLY CA C 13 41.71 0.20 . 1 . . . . . 142 GLY CA . 52362 1 509 . 1 . 1 142 142 GLY N N 15 105.92 0.20 . 1 . . . . . 142 GLY N . 52362 1 510 . 1 . 1 143 143 PHE H H 1 8.88 0.03 . 1 . . . . . 143 PHE H . 52362 1 511 . 1 . 1 143 143 PHE CA C 13 53.30 0.20 . 1 . . . . . 143 PHE CA . 52362 1 512 . 1 . 1 143 143 PHE CB C 13 40.89 0.20 . 1 . . . . . 143 PHE CB . 52362 1 513 . 1 . 1 143 143 PHE N N 15 114.43 0.20 . 1 . . . . . 143 PHE N . 52362 1 514 . 1 . 1 144 144 LEU H H 1 8.54 0.03 . 1 . . . . . 144 LEU H . 52362 1 515 . 1 . 1 144 144 LEU CA C 13 51.38 0.20 . 1 . . . . . 144 LEU CA . 52362 1 516 . 1 . 1 144 144 LEU CB C 13 43.61 0.20 . 1 . . . . . 144 LEU CB . 52362 1 517 . 1 . 1 144 144 LEU N N 15 122.85 0.20 . 1 . . . . . 144 LEU N . 52362 1 518 . 1 . 1 145 145 SER H H 1 8.49 0.03 . 1 . . . . . 145 SER H . 52362 1 519 . 1 . 1 145 145 SER CA C 13 53.92 0.20 . 1 . . . . . 145 SER CA . 52362 1 520 . 1 . 1 145 145 SER CB C 13 62.90 0.20 . 1 . . . . . 145 SER CB . 52362 1 521 . 1 . 1 145 145 SER N N 15 119.34 0.20 . 1 . . . . . 145 SER N . 52362 1 522 . 1 . 1 148 148 GLU H H 1 8.64 0.03 . 1 . . . . . 148 GLU H . 52362 1 523 . 1 . 1 148 148 GLU N N 15 114.64 0.20 . 1 . . . . . 148 GLU N . 52362 1 524 . 1 . 1 149 149 GLU H H 1 8.40 0.03 . 1 . . . . . 149 GLU H . 52362 1 525 . 1 . 1 149 149 GLU CA C 13 56.47 0.20 . 1 . . . . . 149 GLU CA . 52362 1 526 . 1 . 1 149 149 GLU CB C 13 26.65 0.20 . 1 . . . . . 149 GLU CB . 52362 1 527 . 1 . 1 149 149 GLU N N 15 126.10 0.20 . 1 . . . . . 149 GLU N . 52362 1 528 . 1 . 1 150 150 SER H H 1 8.49 0.03 . 1 . . . . . 150 SER H . 52362 1 529 . 1 . 1 150 150 SER CA C 13 57.92 0.20 . 1 . . . . . 150 SER CA . 52362 1 530 . 1 . 1 150 150 SER CB C 13 59.05 0.20 . 1 . . . . . 150 SER CB . 52362 1 531 . 1 . 1 150 150 SER N N 15 114.52 0.20 . 1 . . . . . 150 SER N . 52362 1 532 . 1 . 1 151 151 SER H H 1 7.14 0.03 . 1 . . . . . 151 SER H . 52362 1 533 . 1 . 1 151 151 SER CA C 13 59.53 0.20 . 1 . . . . . 151 SER CA . 52362 1 534 . 1 . 1 151 151 SER CB C 13 64.02 0.20 . 1 . . . . . 151 SER CB . 52362 1 535 . 1 . 1 151 151 SER N N 15 118.39 0.20 . 1 . . . . . 151 SER N . 52362 1 536 . 1 . 1 152 152 VAL H H 1 6.81 0.03 . 1 . . . . . 152 VAL H . 52362 1 537 . 1 . 1 152 152 VAL CA C 13 63.46 0.20 . 1 . . . . . 152 VAL CA . 52362 1 538 . 1 . 1 152 152 VAL CB C 13 28.58 0.20 . 1 . . . . . 152 VAL CB . 52362 1 539 . 1 . 1 152 152 VAL N N 15 119.43 0.20 . 1 . . . . . 152 VAL N . 52362 1 540 . 1 . 1 153 153 GLU H H 1 7.68 0.03 . 1 . . . . . 153 GLU H . 52362 1 541 . 1 . 1 153 153 GLU CA C 13 56.67 0.20 . 1 . . . . . 153 GLU CA . 52362 1 542 . 1 . 1 153 153 GLU CB C 13 26.16 0.20 . 1 . . . . . 153 GLU CB . 52362 1 543 . 1 . 1 153 153 GLU N N 15 121.76 0.20 . 1 . . . . . 153 GLU N . 52362 1 544 . 1 . 1 154 154 HIS H H 1 7.74 0.03 . 1 . . . . . 154 HIS H . 52362 1 545 . 1 . 1 154 154 HIS CA C 13 55.46 0.20 . 1 . . . . . 154 HIS CA . 52362 1 546 . 1 . 1 154 154 HIS CB C 13 27.14 0.20 . 1 . . . . . 154 HIS CB . 52362 1 547 . 1 . 1 154 154 HIS N N 15 115.42 0.20 . 1 . . . . . 154 HIS N . 52362 1 548 . 1 . 1 155 155 VAL H H 1 8.04 0.03 . 1 . . . . . 155 VAL H . 52362 1 549 . 1 . 1 155 155 VAL CA C 13 62.30 0.20 . 1 . . . . . 155 VAL CA . 52362 1 550 . 1 . 1 155 155 VAL CB C 13 28.53 0.20 . 1 . . . . . 155 VAL CB . 52362 1 551 . 1 . 1 155 155 VAL N N 15 114.17 0.20 . 1 . . . . . 155 VAL N . 52362 1 552 . 1 . 1 156 156 THR H H 1 7.76 0.03 . 1 . . . . . 156 THR H . 52362 1 553 . 1 . 1 156 156 THR CA C 13 62.21 0.20 . 1 . . . . . 156 THR CA . 52362 1 554 . 1 . 1 156 156 THR CB C 13 66.62 0.20 . 1 . . . . . 156 THR CB . 52362 1 555 . 1 . 1 156 156 THR N N 15 109.59 0.20 . 1 . . . . . 156 THR N . 52362 1 556 . 1 . 1 157 157 ASN H H 1 7.69 0.03 . 1 . . . . . 157 ASN H . 52362 1 557 . 1 . 1 157 157 ASN CA C 13 53.09 0.20 . 1 . . . . . 157 ASN CA . 52362 1 558 . 1 . 1 157 157 ASN CB C 13 35.74 0.20 . 1 . . . . . 157 ASN CB . 52362 1 559 . 1 . 1 157 157 ASN N N 15 121.08 0.20 . 1 . . . . . 157 ASN N . 52362 1 560 . 1 . 1 158 158 GLU H H 1 7.35 0.03 . 1 . . . . . 158 GLU H . 52362 1 561 . 1 . 1 158 158 GLU CA C 13 54.31 0.20 . 1 . . . . . 158 GLU CA . 52362 1 562 . 1 . 1 158 158 GLU CB C 13 27.93 0.20 . 1 . . . . . 158 GLU CB . 52362 1 563 . 1 . 1 158 158 GLU N N 15 117.41 0.20 . 1 . . . . . 158 GLU N . 52362 1 564 . 1 . 1 159 159 ARG H H 1 7.88 0.03 . 1 . . . . . 159 ARG H . 52362 1 565 . 1 . 1 159 159 ARG CA C 13 57.43 0.20 . 1 . . . . . 159 ARG CA . 52362 1 566 . 1 . 1 159 159 ARG CB C 13 27.30 0.20 . 1 . . . . . 159 ARG CB . 52362 1 567 . 1 . 1 159 159 ARG N N 15 116.23 0.20 . 1 . . . . . 159 ARG N . 52362 1 568 . 1 . 1 160 160 TYR H H 1 8.20 0.03 . 1 . . . . . 160 TYR H . 52362 1 569 . 1 . 1 160 160 TYR CA C 13 53.07 0.20 . 1 . . . . . 160 TYR CA . 52362 1 570 . 1 . 1 160 160 TYR CB C 13 39.00 0.20 . 1 . . . . . 160 TYR CB . 52362 1 571 . 1 . 1 160 160 TYR N N 15 116.06 0.20 . 1 . . . . . 160 TYR N . 52362 1 572 . 1 . 1 161 161 ILE H H 1 8.77 0.03 . 1 . . . . . 161 ILE H . 52362 1 573 . 1 . 1 161 161 ILE CA C 13 56.25 0.20 . 1 . . . . . 161 ILE CA . 52362 1 574 . 1 . 1 161 161 ILE CB C 13 39.35 0.20 . 1 . . . . . 161 ILE CB . 52362 1 575 . 1 . 1 161 161 ILE N N 15 118.01 0.20 . 1 . . . . . 161 ILE N . 52362 1 576 . 1 . 1 162 162 ASN H H 1 8.43 0.03 . 1 . . . . . 162 ASN H . 52362 1 577 . 1 . 1 162 162 ASN CA C 13 49.40 0.20 . 1 . . . . . 162 ASN CA . 52362 1 578 . 1 . 1 162 162 ASN CB C 13 37.12 0.20 . 1 . . . . . 162 ASN CB . 52362 1 579 . 1 . 1 162 162 ASN N N 15 121.78 0.20 . 1 . . . . . 162 ASN N . 52362 1 580 . 1 . 1 163 163 LEU H H 1 8.79 0.03 . 1 . . . . . 163 LEU H . 52362 1 581 . 1 . 1 163 163 LEU CA C 13 50.51 0.20 . 1 . . . . . 163 LEU CA . 52362 1 582 . 1 . 1 163 163 LEU CB C 13 40.76 0.20 . 1 . . . . . 163 LEU CB . 52362 1 583 . 1 . 1 163 163 LEU N N 15 127.22 0.20 . 1 . . . . . 163 LEU N . 52362 1 584 . 1 . 1 164 164 ASN H H 1 8.89 0.03 . 1 . . . . . 164 ASN H . 52362 1 585 . 1 . 1 164 164 ASN CA C 13 50.97 0.20 . 1 . . . . . 164 ASN CA . 52362 1 586 . 1 . 1 164 164 ASN CB C 13 34.17 0.20 . 1 . . . . . 164 ASN CB . 52362 1 587 . 1 . 1 164 164 ASN N N 15 122.96 0.20 . 1 . . . . . 164 ASN N . 52362 1 588 . 1 . 1 165 165 GLY H H 1 8.05 0.03 . 1 . . . . . 165 GLY H . 52362 1 589 . 1 . 1 165 165 GLY CA C 13 42.75 0.20 . 1 . . . . . 165 GLY CA . 52362 1 590 . 1 . 1 165 165 GLY N N 15 103.59 0.20 . 1 . . . . . 165 GLY N . 52362 1 591 . 1 . 1 166 166 LYS H H 1 7.62 0.03 . 1 . . . . . 166 LYS H . 52362 1 592 . 1 . 1 166 166 LYS CA C 13 50.60 0.20 . 1 . . . . . 166 LYS CA . 52362 1 593 . 1 . 1 166 166 LYS CB C 13 32.04 0.20 . 1 . . . . . 166 LYS CB . 52362 1 594 . 1 . 1 166 166 LYS N N 15 122.37 0.20 . 1 . . . . . 166 LYS N . 52362 1 595 . 1 . 1 167 167 GLN H H 1 8.48 0.03 . 1 . . . . . 167 GLN H . 52362 1 596 . 1 . 1 167 167 GLN CA C 13 53.39 0.20 . 1 . . . . . 167 GLN CA . 52362 1 597 . 1 . 1 167 167 GLN CB C 13 27.20 0.20 . 1 . . . . . 167 GLN CB . 52362 1 598 . 1 . 1 167 167 GLN N N 15 124.58 0.20 . 1 . . . . . 167 GLN N . 52362 1 599 . 1 . 1 168 168 VAL H H 1 9.20 0.03 . 1 . . . . . 168 VAL H . 52362 1 600 . 1 . 1 168 168 VAL CA C 13 58.35 0.20 . 1 . . . . . 168 VAL CA . 52362 1 601 . 1 . 1 168 168 VAL CB C 13 31.96 0.20 . 1 . . . . . 168 VAL CB . 52362 1 602 . 1 . 1 168 168 VAL N N 15 130.42 0.20 . 1 . . . . . 168 VAL N . 52362 1 603 . 1 . 1 169 169 GLU H H 1 8.88 0.03 . 1 . . . . . 169 GLU H . 52362 1 604 . 1 . 1 169 169 GLU CA C 13 51.89 0.20 . 1 . . . . . 169 GLU CA . 52362 1 605 . 1 . 1 169 169 GLU CB C 13 29.42 0.20 . 1 . . . . . 169 GLU CB . 52362 1 606 . 1 . 1 169 169 GLU N N 15 128.48 0.20 . 1 . . . . . 169 GLU N . 52362 1 607 . 1 . 1 170 170 ILE H H 1 8.49 0.03 . 1 . . . . . 170 ILE H . 52362 1 608 . 1 . 1 170 170 ILE CA C 13 56.31 0.20 . 1 . . . . . 170 ILE CA . 52362 1 609 . 1 . 1 170 170 ILE CB C 13 40.42 0.20 . 1 . . . . . 170 ILE CB . 52362 1 610 . 1 . 1 170 170 ILE N N 15 125.09 0.20 . 1 . . . . . 170 ILE N . 52362 1 611 . 1 . 1 171 171 LYS H H 1 8.88 0.03 . 1 . . . . . 171 LYS H . 52362 1 612 . 1 . 1 171 171 LYS CA C 13 51.20 0.20 . 1 . . . . . 171 LYS CA . 52362 1 613 . 1 . 1 171 171 LYS CB C 13 34.00 0.20 . 1 . . . . . 171 LYS CB . 52362 1 614 . 1 . 1 171 171 LYS N N 15 123.14 0.20 . 1 . . . . . 171 LYS N . 52362 1 615 . 1 . 1 172 172 LYS H H 1 9.11 0.03 . 1 . . . . . 172 LYS H . 52362 1 616 . 1 . 1 172 172 LYS CA C 13 56.25 0.20 . 1 . . . . . 172 LYS CA . 52362 1 617 . 1 . 1 172 172 LYS CB C 13 29.90 0.20 . 1 . . . . . 172 LYS CB . 52362 1 618 . 1 . 1 172 172 LYS N N 15 122.90 0.20 . 1 . . . . . 172 LYS N . 52362 1 619 . 1 . 1 173 173 ALA H H 1 8.04 0.03 . 1 . . . . . 173 ALA H . 52362 1 620 . 1 . 1 173 173 ALA CA C 13 49.65 0.20 . 1 . . . . . 173 ALA CA . 52362 1 621 . 1 . 1 173 173 ALA CB C 13 16.04 0.20 . 1 . . . . . 173 ALA CB . 52362 1 622 . 1 . 1 173 173 ALA N N 15 127.03 0.20 . 1 . . . . . 173 ALA N . 52362 1 623 . 1 . 1 174 174 GLU H H 1 8.23 0.03 . 1 . . . . . 174 GLU H . 52362 1 624 . 1 . 1 174 174 GLU CA C 13 51.39 0.20 . 1 . . . . . 174 GLU CA . 52362 1 625 . 1 . 1 174 174 GLU CB C 13 36.20 0.20 . 1 . . . . . 174 GLU CB . 52362 1 626 . 1 . 1 174 174 GLU N N 15 121.87 0.20 . 1 . . . . . 174 GLU N . 52362 1 stop_ save_