data_25025 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25025 _Entry.Title ; Conformational Plasticity Surrounding the Active Site of NADH Oxidase from Thermus thermophilus ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-06-17 _Entry.Accession_date 2014-06-17 _Entry.Last_release_date 2014-06-18 _Entry.Original_release_date 2014-06-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 . _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 Anthony Mittermaier . . . . 25025 2 Teresa Miletti . . . . 25025 3 Louis-Charles Levros . . Jr. . 25025 4 Justin 'Di Trani' . . . . 25025 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Chemistry, McGill University' . 25025 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25025 heteronucl_NOEs 3 25025 heteronucl_T1_relaxation 4 25025 heteronucl_T2_relaxation 4 25025 order_parameters 2 25025 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 464 25025 '15N chemical shifts' 165 25025 '1H chemical shifts' 165 25025 'T1 relaxation values' 426 25025 'T2 relaxation values' 426 25025 'heteronuclear NOE values' 328 25025 'order parameters' 216 25025 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 . . 2019-07-11 . original BMRB . 25025 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25025 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 25970557 _Citation.Full_citation . _Citation.Title ; Conformational plasticity surrounding the active site of NADH oxidase from Thermus thermophilus ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full 'Protein science : a publication of the Protein Society' _Citation.Journal_volume 24 _Citation.Journal_issue 7 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1469-896X _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 1114 _Citation.Page_last 1128 _Citation.Year 2015 _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 Teresa Miletti T. . . . 25025 1 2 Justin 'Di Trani' J. . . . 25025 1 3 Louis-Charles Levros L. C. Jr . 25025 1 4 Anthony Mittermaier A. . . . 25025 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25025 _Assembly.ID 1 _Assembly.Name NOX _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 52000 _Assembly.Enzyme_commission_number . _Assembly.Details homodimer _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 'NOX, 1' 1 $NOX A . yes native no no . . . 25025 1 2 'NOX, 2' 1 $NOX B . no native no no . . . 25025 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1NOX . . X-ray 1.59 . . 25025 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID unknown 25025 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NOX _Entity.Sf_category entity _Entity.Sf_framecode NOX _Entity.Entry_ID 25025 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NOX _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 ; MEATLPVLDAKTAALKRRSI RRYRKDPVPEGLLREILEAA LRAPSAWNLQPWRIVVVRDP ATKRALREAAFGQAHVEEAP VVLVLYADLEDALAHLDEVI HPGVQGERREAQKQAIQRAF AAMGQEARKAWASGQSYILL GYLLLLLEAYGLGSVPMLGF DPERVRAILGLPSRAAIPAL VALGYPAEEGYPSHRLPLER VVLWR ; _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 205 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 25025 1 2 . GLU . 25025 1 3 . ALA . 25025 1 4 . THR . 25025 1 5 . LEU . 25025 1 6 . PRO . 25025 1 7 . VAL . 25025 1 8 . LEU . 25025 1 9 . ASP . 25025 1 10 . ALA . 25025 1 11 . LYS . 25025 1 12 . THR . 25025 1 13 . ALA . 25025 1 14 . ALA . 25025 1 15 . LEU . 25025 1 16 . LYS . 25025 1 17 . ARG . 25025 1 18 . ARG . 25025 1 19 . SER . 25025 1 20 . ILE . 25025 1 21 . ARG . 25025 1 22 . ARG . 25025 1 23 . TYR . 25025 1 24 . ARG . 25025 1 25 . LYS . 25025 1 26 . ASP . 25025 1 27 . PRO . 25025 1 28 . VAL . 25025 1 29 . PRO . 25025 1 30 . GLU . 25025 1 31 . GLY . 25025 1 32 . LEU . 25025 1 33 . LEU . 25025 1 34 . ARG . 25025 1 35 . GLU . 25025 1 36 . ILE . 25025 1 37 . LEU . 25025 1 38 . GLU . 25025 1 39 . ALA . 25025 1 40 . ALA . 25025 1 41 . LEU . 25025 1 42 . ARG . 25025 1 43 . ALA . 25025 1 44 . PRO . 25025 1 45 . SER . 25025 1 46 . ALA . 25025 1 47 . TRP . 25025 1 48 . ASN . 25025 1 49 . LEU . 25025 1 50 . GLN . 25025 1 51 . PRO . 25025 1 52 . TRP . 25025 1 53 . ARG . 25025 1 54 . ILE . 25025 1 55 . VAL . 25025 1 56 . VAL . 25025 1 57 . VAL . 25025 1 58 . ARG . 25025 1 59 . ASP . 25025 1 60 . PRO . 25025 1 61 . ALA . 25025 1 62 . THR . 25025 1 63 . LYS . 25025 1 64 . ARG . 25025 1 65 . ALA . 25025 1 66 . LEU . 25025 1 67 . ARG . 25025 1 68 . GLU . 25025 1 69 . ALA . 25025 1 70 . ALA . 25025 1 71 . PHE . 25025 1 72 . GLY . 25025 1 73 . GLN . 25025 1 74 . ALA . 25025 1 75 . HIS . 25025 1 76 . VAL . 25025 1 77 . GLU . 25025 1 78 . GLU . 25025 1 79 . ALA . 25025 1 80 . PRO . 25025 1 81 . VAL . 25025 1 82 . VAL . 25025 1 83 . LEU . 25025 1 84 . VAL . 25025 1 85 . LEU . 25025 1 86 . TYR . 25025 1 87 . ALA . 25025 1 88 . ASP . 25025 1 89 . LEU . 25025 1 90 . GLU . 25025 1 91 . ASP . 25025 1 92 . ALA . 25025 1 93 . LEU . 25025 1 94 . ALA . 25025 1 95 . HIS . 25025 1 96 . LEU . 25025 1 97 . ASP . 25025 1 98 . GLU . 25025 1 99 . VAL . 25025 1 100 . ILE . 25025 1 101 . HIS . 25025 1 102 . PRO . 25025 1 103 . GLY . 25025 1 104 . VAL . 25025 1 105 . GLN . 25025 1 106 . GLY . 25025 1 107 . GLU . 25025 1 108 . ARG . 25025 1 109 . ARG . 25025 1 110 . GLU . 25025 1 111 . ALA . 25025 1 112 . GLN . 25025 1 113 . LYS . 25025 1 114 . GLN . 25025 1 115 . ALA . 25025 1 116 . ILE . 25025 1 117 . GLN . 25025 1 118 . ARG . 25025 1 119 . ALA . 25025 1 120 . PHE . 25025 1 121 . ALA . 25025 1 122 . ALA . 25025 1 123 . MET . 25025 1 124 . GLY . 25025 1 125 . GLN . 25025 1 126 . GLU . 25025 1 127 . ALA . 25025 1 128 . ARG . 25025 1 129 . LYS . 25025 1 130 . ALA . 25025 1 131 . TRP . 25025 1 132 . ALA . 25025 1 133 . SER . 25025 1 134 . GLY . 25025 1 135 . GLN . 25025 1 136 . SER . 25025 1 137 . TYR . 25025 1 138 . ILE . 25025 1 139 . LEU . 25025 1 140 . LEU . 25025 1 141 . GLY . 25025 1 142 . TYR . 25025 1 143 . LEU . 25025 1 144 . LEU . 25025 1 145 . LEU . 25025 1 146 . LEU . 25025 1 147 . LEU . 25025 1 148 . GLU . 25025 1 149 . ALA . 25025 1 150 . TYR . 25025 1 151 . GLY . 25025 1 152 . LEU . 25025 1 153 . GLY . 25025 1 154 . SER . 25025 1 155 . VAL . 25025 1 156 . PRO . 25025 1 157 . MET . 25025 1 158 . LEU . 25025 1 159 . GLY . 25025 1 160 . PHE . 25025 1 161 . ASP . 25025 1 162 . PRO . 25025 1 163 . GLU . 25025 1 164 . ARG . 25025 1 165 . VAL . 25025 1 166 . ARG . 25025 1 167 . ALA . 25025 1 168 . ILE . 25025 1 169 . LEU . 25025 1 170 . GLY . 25025 1 171 . LEU . 25025 1 172 . PRO . 25025 1 173 . SER . 25025 1 174 . ARG . 25025 1 175 . ALA . 25025 1 176 . ALA . 25025 1 177 . ILE . 25025 1 178 . PRO . 25025 1 179 . ALA . 25025 1 180 . LEU . 25025 1 181 . VAL . 25025 1 182 . ALA . 25025 1 183 . LEU . 25025 1 184 . GLY . 25025 1 185 . TYR . 25025 1 186 . PRO . 25025 1 187 . ALA . 25025 1 188 . GLU . 25025 1 189 . GLU . 25025 1 190 . GLY . 25025 1 191 . TYR . 25025 1 192 . PRO . 25025 1 193 . SER . 25025 1 194 . HIS . 25025 1 195 . ARG . 25025 1 196 . LEU . 25025 1 197 . PRO . 25025 1 198 . LEU . 25025 1 199 . GLU . 25025 1 200 . ARG . 25025 1 201 . VAL . 25025 1 202 . VAL . 25025 1 203 . LEU . 25025 1 204 . TRP . 25025 1 205 . ARG . 25025 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 . MET 1 1 25025 1 . GLU 2 2 25025 1 . ALA 3 3 25025 1 . THR 4 4 25025 1 . LEU 5 5 25025 1 . PRO 6 6 25025 1 . VAL 7 7 25025 1 . LEU 8 8 25025 1 . ASP 9 9 25025 1 . ALA 10 10 25025 1 . LYS 11 11 25025 1 . THR 12 12 25025 1 . ALA 13 13 25025 1 . ALA 14 14 25025 1 . LEU 15 15 25025 1 . LYS 16 16 25025 1 . ARG 17 17 25025 1 . ARG 18 18 25025 1 . SER 19 19 25025 1 . ILE 20 20 25025 1 . ARG 21 21 25025 1 . ARG 22 22 25025 1 . TYR 23 23 25025 1 . ARG 24 24 25025 1 . LYS 25 25 25025 1 . ASP 26 26 25025 1 . PRO 27 27 25025 1 . VAL 28 28 25025 1 . PRO 29 29 25025 1 . GLU 30 30 25025 1 . GLY 31 31 25025 1 . LEU 32 32 25025 1 . LEU 33 33 25025 1 . ARG 34 34 25025 1 . GLU 35 35 25025 1 . ILE 36 36 25025 1 . LEU 37 37 25025 1 . GLU 38 38 25025 1 . ALA 39 39 25025 1 . ALA 40 40 25025 1 . LEU 41 41 25025 1 . ARG 42 42 25025 1 . ALA 43 43 25025 1 . PRO 44 44 25025 1 . SER 45 45 25025 1 . ALA 46 46 25025 1 . TRP 47 47 25025 1 . ASN 48 48 25025 1 . LEU 49 49 25025 1 . GLN 50 50 25025 1 . PRO 51 51 25025 1 . TRP 52 52 25025 1 . ARG 53 53 25025 1 . ILE 54 54 25025 1 . VAL 55 55 25025 1 . VAL 56 56 25025 1 . VAL 57 57 25025 1 . ARG 58 58 25025 1 . ASP 59 59 25025 1 . PRO 60 60 25025 1 . ALA 61 61 25025 1 . THR 62 62 25025 1 . LYS 63 63 25025 1 . ARG 64 64 25025 1 . ALA 65 65 25025 1 . LEU 66 66 25025 1 . ARG 67 67 25025 1 . GLU 68 68 25025 1 . ALA 69 69 25025 1 . ALA 70 70 25025 1 . PHE 71 71 25025 1 . GLY 72 72 25025 1 . GLN 73 73 25025 1 . ALA 74 74 25025 1 . HIS 75 75 25025 1 . VAL 76 76 25025 1 . GLU 77 77 25025 1 . GLU 78 78 25025 1 . ALA 79 79 25025 1 . PRO 80 80 25025 1 . VAL 81 81 25025 1 . VAL 82 82 25025 1 . LEU 83 83 25025 1 . VAL 84 84 25025 1 . LEU 85 85 25025 1 . TYR 86 86 25025 1 . ALA 87 87 25025 1 . ASP 88 88 25025 1 . LEU 89 89 25025 1 . GLU 90 90 25025 1 . ASP 91 91 25025 1 . ALA 92 92 25025 1 . LEU 93 93 25025 1 . ALA 94 94 25025 1 . HIS 95 95 25025 1 . LEU 96 96 25025 1 . ASP 97 97 25025 1 . GLU 98 98 25025 1 . VAL 99 99 25025 1 . ILE 100 100 25025 1 . HIS 101 101 25025 1 . PRO 102 102 25025 1 . GLY 103 103 25025 1 . VAL 104 104 25025 1 . GLN 105 105 25025 1 . GLY 106 106 25025 1 . GLU 107 107 25025 1 . ARG 108 108 25025 1 . ARG 109 109 25025 1 . GLU 110 110 25025 1 . ALA 111 111 25025 1 . GLN 112 112 25025 1 . LYS 113 113 25025 1 . GLN 114 114 25025 1 . ALA 115 115 25025 1 . ILE 116 116 25025 1 . GLN 117 117 25025 1 . ARG 118 118 25025 1 . ALA 119 119 25025 1 . PHE 120 120 25025 1 . ALA 121 121 25025 1 . ALA 122 122 25025 1 . MET 123 123 25025 1 . GLY 124 124 25025 1 . GLN 125 125 25025 1 . GLU 126 126 25025 1 . ALA 127 127 25025 1 . ARG 128 128 25025 1 . LYS 129 129 25025 1 . ALA 130 130 25025 1 . TRP 131 131 25025 1 . ALA 132 132 25025 1 . SER 133 133 25025 1 . GLY 134 134 25025 1 . GLN 135 135 25025 1 . SER 136 136 25025 1 . TYR 137 137 25025 1 . ILE 138 138 25025 1 . LEU 139 139 25025 1 . LEU 140 140 25025 1 . GLY 141 141 25025 1 . TYR 142 142 25025 1 . LEU 143 143 25025 1 . LEU 144 144 25025 1 . LEU 145 145 25025 1 . LEU 146 146 25025 1 . LEU 147 147 25025 1 . GLU 148 148 25025 1 . ALA 149 149 25025 1 . TYR 150 150 25025 1 . GLY 151 151 25025 1 . LEU 152 152 25025 1 . GLY 153 153 25025 1 . SER 154 154 25025 1 . VAL 155 155 25025 1 . PRO 156 156 25025 1 . MET 157 157 25025 1 . LEU 158 158 25025 1 . GLY 159 159 25025 1 . PHE 160 160 25025 1 . ASP 161 161 25025 1 . PRO 162 162 25025 1 . GLU 163 163 25025 1 . ARG 164 164 25025 1 . VAL 165 165 25025 1 . ARG 166 166 25025 1 . ALA 167 167 25025 1 . ILE 168 168 25025 1 . LEU 169 169 25025 1 . GLY 170 170 25025 1 . LEU 171 171 25025 1 . PRO 172 172 25025 1 . SER 173 173 25025 1 . ARG 174 174 25025 1 . ALA 175 175 25025 1 . ALA 176 176 25025 1 . ILE 177 177 25025 1 . PRO 178 178 25025 1 . ALA 179 179 25025 1 . LEU 180 180 25025 1 . VAL 181 181 25025 1 . ALA 182 182 25025 1 . LEU 183 183 25025 1 . GLY 184 184 25025 1 . TYR 185 185 25025 1 . PRO 186 186 25025 1 . ALA 187 187 25025 1 . GLU 188 188 25025 1 . GLU 189 189 25025 1 . GLY 190 190 25025 1 . TYR 191 191 25025 1 . PRO 192 192 25025 1 . SER 193 193 25025 1 . HIS 194 194 25025 1 . ARG 195 195 25025 1 . LEU 196 196 25025 1 . PRO 197 197 25025 1 . LEU 198 198 25025 1 . GLU 199 199 25025 1 . ARG 200 200 25025 1 . VAL 201 201 25025 1 . VAL 202 202 25025 1 . LEU 203 203 25025 1 . TRP 204 204 25025 1 . ARG 205 205 25025 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 25025 _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 $NOX . 274 organism . 'Thermus thermophilus' Bacteria . . Bacteria . Thermus thermophilus . . . . . . . . . . . . . 25025 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 25025 _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 $NOX . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli DH5alpha . . . . . pTNADOX . . . 25025 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_no_urea _Sample.Sf_category sample _Sample.Sf_framecode 15N_no_urea _Sample.Entry_ID 25025 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NOX '[U-100% 15N]' . . 1 $NOX . . 1 . . mM . . . . 25025 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25025 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25025 1 stop_ save_ save_15N13C_no_urea _Sample.Sf_category sample _Sample.Sf_framecode 15N13C_no_urea _Sample.Entry_ID 25025 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NOX '[U-100% 13C; U-100% 15N]' . . 1 $NOX . . 1 . . mM . . . . 25025 2 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25025 2 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25025 2 stop_ save_ save_15N_urea _Sample.Sf_category sample _Sample.Sf_framecode 15N_urea _Sample.Entry_ID 25025 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.2 M urea' _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 NOX '[U-100% 15N]' . . 1 $NOX . . 1 . . mM . . . . 25025 3 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25025 3 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25025 3 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 25025 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . M 25025 1 pH 7.2 . pH 25025 1 pressure 1 . atm 25025 1 temperature 323 . K 25025 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25025 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25025 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25025 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25025 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25025 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25025 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 500 . . . 25025 1 2 spectrometer_2 Varian INOVA . 800 . . . 25025 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 25025 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCACB' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 2 '3D HNCO' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 3 '3D HNCA' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 4 '3D HN(CO)CA' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 5 '3D HCACO' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $15N13C_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 8 {1H}NOE no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25025 1 9 R1rho no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25025 1 10 R1 no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25025 1 11 {1H}NOE no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 12 R1rho no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 13 R1 no . . . . . . . . . . 1 $15N_no_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 14 R1rho no . . . . . . . . . . 3 $15N_urea isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25025 1 15 R1 no . . . . . . . . . . 3 $15N_urea isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25025 1 16 {1H}NOE no . . . . . . . . . . 3 $15N_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 17 R1rho no . . . . . . . . . . 3 $15N_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 18 R1 no . . . . . . . . . . 3 $15N_urea isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25025 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25025 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.2514 . . . . . 25025 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0000 . . . . . 25025 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.1013 . . . . . 25025 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25025 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 25025 1 2 '3D HNCO' . . . 25025 1 3 '3D HNCA' . . . 25025 1 4 '3D HN(CO)CA' . . . 25025 1 5 '3D HCACO' . . . 25025 1 6 '3D CBCA(CO)NH' . . . 25025 1 7 '3D 1H-15N NOESY' . . . 25025 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 $NMRPipe . . 25025 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 ALA H H 1 8.50 . . . . . . . . 3 ALA H . 25025 1 2 . 1 1 3 3 ALA CA C 13 56.70 . . . . . . . . 3 ALA CA . 25025 1 3 . 1 1 3 3 ALA CB C 13 19.50 . . . . . . . . 3 ALA CB . 25025 1 4 . 1 1 3 3 ALA N N 15 125.05 . . . . . . . . 3 ALA N . 25025 1 5 . 1 1 4 4 THR H H 1 8.23 . . . . . . . . 4 THR H . 25025 1 6 . 1 1 4 4 THR C C 13 174.09 . . . . . . . . 4 THR C . 25025 1 7 . 1 1 4 4 THR CA C 13 61.90 . . . . . . . . 4 THR CA . 25025 1 8 . 1 1 4 4 THR CB C 13 70.20 . . . . . . . . 4 THR CB . 25025 1 9 . 1 1 4 4 THR N N 15 114.25 . . . . . . . . 4 THR N . 25025 1 10 . 1 1 5 5 LEU H H 1 8.37 . . . . . . . . 5 LEU H . 25025 1 11 . 1 1 5 5 LEU C C 13 174.91 . . . . . . . . 5 LEU C . 25025 1 12 . 1 1 5 5 LEU CA C 13 53.30 . . . . . . . . 5 LEU CA . 25025 1 13 . 1 1 5 5 LEU CB C 13 42.50 . . . . . . . . 5 LEU CB . 25025 1 14 . 1 1 5 5 LEU N N 15 126.30 . . . . . . . . 5 LEU N . 25025 1 15 . 1 1 7 7 VAL H H 1 7.87 . . . . . . . . 7 VAL H . 25025 1 16 . 1 1 7 7 VAL CA C 13 61.70 . . . . . . . . 7 VAL CA . 25025 1 17 . 1 1 7 7 VAL CB C 13 33.30 . . . . . . . . 7 VAL CB . 25025 1 18 . 1 1 7 7 VAL N N 15 121.70 . . . . . . . . 7 VAL N . 25025 1 19 . 1 1 8 8 LEU H H 1 8.35 . . . . . . . . 8 LEU H . 25025 1 20 . 1 1 8 8 LEU C C 13 176.98 . . . . . . . . 8 LEU C . 25025 1 21 . 1 1 8 8 LEU CA C 13 55.60 . . . . . . . . 8 LEU CA . 25025 1 22 . 1 1 8 8 LEU CB C 13 44.30 . . . . . . . . 8 LEU CB . 25025 1 23 . 1 1 8 8 LEU N N 15 124.11 . . . . . . . . 8 LEU N . 25025 1 24 . 1 1 9 9 ASP H H 1 8.13 . . . . . . . . 9 ASP H . 25025 1 25 . 1 1 9 9 ASP C C 13 175.70 . . . . . . . . 9 ASP C . 25025 1 26 . 1 1 9 9 ASP CA C 13 54.30 . . . . . . . . 9 ASP CA . 25025 1 27 . 1 1 9 9 ASP CB C 13 41.60 . . . . . . . . 9 ASP CB . 25025 1 28 . 1 1 9 9 ASP N N 15 117.43 . . . . . . . . 9 ASP N . 25025 1 29 . 1 1 10 10 ALA H H 1 8.10 . . . . . . . . 10 ALA H . 25025 1 30 . 1 1 10 10 ALA C C 13 177.06 . . . . . . . . 10 ALA C . 25025 1 31 . 1 1 10 10 ALA CA C 13 55.80 . . . . . . . . 10 ALA CA . 25025 1 32 . 1 1 10 10 ALA CB C 13 19.50 . . . . . . . . 10 ALA CB . 25025 1 33 . 1 1 10 10 ALA N N 15 119.77 . . . . . . . . 10 ALA N . 25025 1 34 . 1 1 11 11 LYS H H 1 7.56 . . . . . . . . 11 LYS H . 25025 1 35 . 1 1 11 11 LYS C C 13 177.21 . . . . . . . . 11 LYS C . 25025 1 36 . 1 1 11 11 LYS CA C 13 60.50 . . . . . . . . 11 LYS CA . 25025 1 37 . 1 1 11 11 LYS CB C 13 32.20 . . . . . . . . 11 LYS CB . 25025 1 38 . 1 1 11 11 LYS N N 15 116.14 . . . . . . . . 11 LYS N . 25025 1 39 . 1 1 12 12 THR H H 1 9.15 . . . . . . . . 12 THR H . 25025 1 40 . 1 1 12 12 THR C C 13 176.37 . . . . . . . . 12 THR C . 25025 1 41 . 1 1 12 12 THR CA C 13 67.50 . . . . . . . . 12 THR CA . 25025 1 42 . 1 1 12 12 THR N N 15 119.00 . . . . . . . . 12 THR N . 25025 1 43 . 1 1 13 13 ALA H H 1 8.05 . . . . . . . . 13 ALA H . 25025 1 44 . 1 1 13 13 ALA C C 13 177.42 . . . . . . . . 13 ALA C . 25025 1 45 . 1 1 13 13 ALA CA C 13 55.60 . . . . . . . . 13 ALA CA . 25025 1 46 . 1 1 13 13 ALA CB C 13 18.20 . . . . . . . . 13 ALA CB . 25025 1 47 . 1 1 13 13 ALA N N 15 120.13 . . . . . . . . 13 ALA N . 25025 1 48 . 1 1 14 14 ALA H H 1 7.72 . . . . . . . . 14 ALA H . 25025 1 49 . 1 1 14 14 ALA C C 13 180.31 . . . . . . . . 14 ALA C . 25025 1 50 . 1 1 14 14 ALA CA C 13 55.50 . . . . . . . . 14 ALA CA . 25025 1 51 . 1 1 14 14 ALA CB C 13 18.40 . . . . . . . . 14 ALA CB . 25025 1 52 . 1 1 14 14 ALA N N 15 118.66 . . . . . . . . 14 ALA N . 25025 1 53 . 1 1 15 15 LEU H H 1 8.48 . . . . . . . . 15 LEU H . 25025 1 54 . 1 1 15 15 LEU C C 13 178.74 . . . . . . . . 15 LEU C . 25025 1 55 . 1 1 15 15 LEU CA C 13 58.00 . . . . . . . . 15 LEU CA . 25025 1 56 . 1 1 15 15 LEU CB C 13 42.50 . . . . . . . . 15 LEU CB . 25025 1 57 . 1 1 15 15 LEU N N 15 115.56 . . . . . . . . 15 LEU N . 25025 1 58 . 1 1 16 16 LYS H H 1 8.53 . . . . . . . . 16 LYS H . 25025 1 59 . 1 1 16 16 LYS C C 13 177.61 . . . . . . . . 16 LYS C . 25025 1 60 . 1 1 16 16 LYS CA C 13 57.90 . . . . . . . . 16 LYS CA . 25025 1 61 . 1 1 16 16 LYS CB C 13 34.00 . . . . . . . . 16 LYS CB . 25025 1 62 . 1 1 16 16 LYS N N 15 118.05 . . . . . . . . 16 LYS N . 25025 1 63 . 1 1 17 17 ARG H H 1 7.38 . . . . . . . . 17 ARG H . 25025 1 64 . 1 1 17 17 ARG C C 13 176.47 . . . . . . . . 17 ARG C . 25025 1 65 . 1 1 17 17 ARG CA C 13 59.50 . . . . . . . . 17 ARG CA . 25025 1 66 . 1 1 17 17 ARG CB C 13 28.60 . . . . . . . . 17 ARG CB . 25025 1 67 . 1 1 17 17 ARG N N 15 119.09 . . . . . . . . 17 ARG N . 25025 1 68 . 1 1 18 18 ARG H H 1 8.38 . . . . . . . . 18 ARG H . 25025 1 69 . 1 1 18 18 ARG C C 13 175.99 . . . . . . . . 18 ARG C . 25025 1 70 . 1 1 18 18 ARG CA C 13 55.40 . . . . . . . . 18 ARG CA . 25025 1 71 . 1 1 18 18 ARG CB C 13 32.30 . . . . . . . . 18 ARG CB . 25025 1 72 . 1 1 18 18 ARG N N 15 126.84 . . . . . . . . 18 ARG N . 25025 1 73 . 1 1 19 19 SER H H 1 12.04 . . . . . . . . 19 SER H . 25025 1 74 . 1 1 19 19 SER C C 13 172.92 . . . . . . . . 19 SER C . 25025 1 75 . 1 1 19 19 SER CA C 13 64.70 . . . . . . . . 19 SER CA . 25025 1 76 . 1 1 19 19 SER CB C 13 62.40 . . . . . . . . 19 SER CB . 25025 1 77 . 1 1 19 19 SER N N 15 124.27 . . . . . . . . 19 SER N . 25025 1 78 . 1 1 20 20 ILE H H 1 8.23 . . . . . . . . 20 ILE H . 25025 1 79 . 1 1 20 20 ILE C C 13 175.66 . . . . . . . . 20 ILE C . 25025 1 80 . 1 1 20 20 ILE CA C 13 57.60 . . . . . . . . 20 ILE CA . 25025 1 81 . 1 1 20 20 ILE CB C 13 39.20 . . . . . . . . 20 ILE CB . 25025 1 82 . 1 1 20 20 ILE N N 15 124.43 . . . . . . . . 20 ILE N . 25025 1 83 . 1 1 21 21 ARG H H 1 9.44 . . . . . . . . 21 ARG H . 25025 1 84 . 1 1 21 21 ARG C C 13 173.41 . . . . . . . . 21 ARG C . 25025 1 85 . 1 1 21 21 ARG CA C 13 55.30 . . . . . . . . 21 ARG CA . 25025 1 86 . 1 1 21 21 ARG CB C 13 31.50 . . . . . . . . 21 ARG CB . 25025 1 87 . 1 1 21 21 ARG N N 15 125.26 . . . . . . . . 21 ARG N . 25025 1 88 . 1 1 22 22 ARG H H 1 6.63 . . . . . . . . 22 ARG H . 25025 1 89 . 1 1 22 22 ARG C C 13 174.46 . . . . . . . . 22 ARG C . 25025 1 90 . 1 1 22 22 ARG CA C 13 56.10 . . . . . . . . 22 ARG CA . 25025 1 91 . 1 1 22 22 ARG CB C 13 33.10 . . . . . . . . 22 ARG CB . 25025 1 92 . 1 1 22 22 ARG N N 15 117.55 . . . . . . . . 22 ARG N . 25025 1 93 . 1 1 23 23 TYR H H 1 9.06 . . . . . . . . 23 TYR H . 25025 1 94 . 1 1 23 23 TYR C C 13 176.73 . . . . . . . . 23 TYR C . 25025 1 95 . 1 1 23 23 TYR CA C 13 54.90 . . . . . . . . 23 TYR CA . 25025 1 96 . 1 1 23 23 TYR CB C 13 32.90 . . . . . . . . 23 TYR CB . 25025 1 97 . 1 1 23 23 TYR N N 15 122.49 . . . . . . . . 23 TYR N . 25025 1 98 . 1 1 24 24 ARG H H 1 8.82 . . . . . . . . 24 ARG H . 25025 1 99 . 1 1 24 24 ARG C C 13 177.77 . . . . . . . . 24 ARG C . 25025 1 100 . 1 1 24 24 ARG CA C 13 56.40 . . . . . . . . 24 ARG CA . 25025 1 101 . 1 1 24 24 ARG CB C 13 32.20 . . . . . . . . 24 ARG CB . 25025 1 102 . 1 1 24 24 ARG N N 15 120.17 . . . . . . . . 24 ARG N . 25025 1 103 . 1 1 26 26 ASP CA C 13 50.70 . . . . . . . . 26 ASP CA . 25025 1 104 . 1 1 26 26 ASP CB C 13 39.00 . . . . . . . . 26 ASP CB . 25025 1 105 . 1 1 28 28 VAL H H 1 8.21 . . . . . . . . 28 VAL H . 25025 1 106 . 1 1 28 28 VAL CA C 13 59.70 . . . . . . . . 28 VAL CA . 25025 1 107 . 1 1 28 28 VAL CB C 13 33.30 . . . . . . . . 28 VAL CB . 25025 1 108 . 1 1 28 28 VAL N N 15 121.21 . . . . . . . . 28 VAL N . 25025 1 109 . 1 1 32 32 LEU H H 1 7.06 . . . . . . . . 32 LEU H . 25025 1 110 . 1 1 32 32 LEU C C 13 177.75 . . . . . . . . 32 LEU C . 25025 1 111 . 1 1 32 32 LEU CA C 13 57.40 . . . . . . . . 32 LEU CA . 25025 1 112 . 1 1 32 32 LEU CB C 13 42.80 . . . . . . . . 32 LEU CB . 25025 1 113 . 1 1 32 32 LEU N N 15 123.14 . . . . . . . . 32 LEU N . 25025 1 114 . 1 1 33 33 LEU H H 1 7.83 . . . . . . . . 33 LEU H . 25025 1 115 . 1 1 33 33 LEU C C 13 178.41 . . . . . . . . 33 LEU C . 25025 1 116 . 1 1 33 33 LEU CA C 13 58.10 . . . . . . . . 33 LEU CA . 25025 1 117 . 1 1 33 33 LEU CB C 13 42.50 . . . . . . . . 33 LEU CB . 25025 1 118 . 1 1 33 33 LEU N N 15 117.52 . . . . . . . . 33 LEU N . 25025 1 119 . 1 1 34 34 ARG H H 1 8.90 . . . . . . . . 34 ARG H . 25025 1 120 . 1 1 34 34 ARG C C 13 177.00 . . . . . . . . 34 ARG C . 25025 1 121 . 1 1 34 34 ARG CA C 13 61.40 . . . . . . . . 34 ARG CA . 25025 1 122 . 1 1 34 34 ARG CB C 13 30.40 . . . . . . . . 34 ARG CB . 25025 1 123 . 1 1 34 34 ARG N N 15 116.96 . . . . . . . . 34 ARG N . 25025 1 124 . 1 1 35 35 GLU H H 1 7.61 . . . . . . . . 35 GLU H . 25025 1 125 . 1 1 35 35 GLU C C 13 178.74 . . . . . . . . 35 GLU C . 25025 1 126 . 1 1 35 35 GLU CA C 13 60.00 . . . . . . . . 35 GLU CA . 25025 1 127 . 1 1 35 35 GLU CB C 13 30.20 . . . . . . . . 35 GLU CB . 25025 1 128 . 1 1 35 35 GLU N N 15 119.61 . . . . . . . . 35 GLU N . 25025 1 129 . 1 1 36 36 ILE H H 1 8.00 . . . . . . . . 36 ILE H . 25025 1 130 . 1 1 36 36 ILE C C 13 177.77 . . . . . . . . 36 ILE C . 25025 1 131 . 1 1 36 36 ILE CA C 13 66.00 . . . . . . . . 36 ILE CA . 25025 1 132 . 1 1 36 36 ILE CB C 13 38.70 . . . . . . . . 36 ILE CB . 25025 1 133 . 1 1 36 36 ILE N N 15 119.41 . . . . . . . . 36 ILE N . 25025 1 134 . 1 1 37 37 LEU H H 1 8.66 . . . . . . . . 37 LEU H . 25025 1 135 . 1 1 37 37 LEU C C 13 177.79 . . . . . . . . 37 LEU C . 25025 1 136 . 1 1 37 37 LEU CA C 13 58.20 . . . . . . . . 37 LEU CA . 25025 1 137 . 1 1 37 37 LEU CB C 13 41.60 . . . . . . . . 37 LEU CB . 25025 1 138 . 1 1 37 37 LEU N N 15 117.72 . . . . . . . . 37 LEU N . 25025 1 139 . 1 1 38 38 GLU H H 1 8.69 . . . . . . . . 38 GLU H . 25025 1 140 . 1 1 38 38 GLU C C 13 178.44 . . . . . . . . 38 GLU C . 25025 1 141 . 1 1 38 38 GLU CA C 13 60.70 . . . . . . . . 38 GLU CA . 25025 1 142 . 1 1 38 38 GLU CB C 13 30.20 . . . . . . . . 38 GLU CB . 25025 1 143 . 1 1 38 38 GLU N N 15 117.72 . . . . . . . . 38 GLU N . 25025 1 144 . 1 1 39 39 ALA H H 1 7.52 . . . . . . . . 39 ALA H . 25025 1 145 . 1 1 39 39 ALA C C 13 178.58 . . . . . . . . 39 ALA C . 25025 1 146 . 1 1 39 39 ALA CA C 13 54.90 . . . . . . . . 39 ALA CA . 25025 1 147 . 1 1 39 39 ALA CB C 13 18.30 . . . . . . . . 39 ALA CB . 25025 1 148 . 1 1 39 39 ALA N N 15 119.06 . . . . . . . . 39 ALA N . 25025 1 149 . 1 1 40 40 ALA H H 1 8.64 . . . . . . . . 40 ALA H . 25025 1 150 . 1 1 40 40 ALA C C 13 177.61 . . . . . . . . 40 ALA C . 25025 1 151 . 1 1 40 40 ALA CA C 13 55.30 . . . . . . . . 40 ALA CA . 25025 1 152 . 1 1 40 40 ALA CB C 13 17.90 . . . . . . . . 40 ALA CB . 25025 1 153 . 1 1 40 40 ALA N N 15 121.12 . . . . . . . . 40 ALA N . 25025 1 154 . 1 1 41 41 LEU H H 1 8.26 . . . . . . . . 41 LEU H . 25025 1 155 . 1 1 41 41 LEU C C 13 177.30 . . . . . . . . 41 LEU C . 25025 1 156 . 1 1 41 41 LEU CA C 13 56.40 . . . . . . . . 41 LEU CA . 25025 1 157 . 1 1 41 41 LEU CB C 13 41.10 . . . . . . . . 41 LEU CB . 25025 1 158 . 1 1 41 41 LEU N N 15 114.25 . . . . . . . . 41 LEU N . 25025 1 159 . 1 1 42 42 ARG H H 1 7.47 . . . . . . . . 42 ARG H . 25025 1 160 . 1 1 42 42 ARG C C 13 176.81 . . . . . . . . 42 ARG C . 25025 1 161 . 1 1 42 42 ARG CA C 13 55.00 . . . . . . . . 42 ARG CA . 25025 1 162 . 1 1 42 42 ARG CB C 13 28.00 . . . . . . . . 42 ARG CB . 25025 1 163 . 1 1 42 42 ARG N N 15 113.46 . . . . . . . . 42 ARG N . 25025 1 164 . 1 1 43 43 ALA H H 1 8.28 . . . . . . . . 43 ALA H . 25025 1 165 . 1 1 43 43 ALA C C 13 175.15 . . . . . . . . 43 ALA C . 25025 1 166 . 1 1 43 43 ALA CA C 13 51.80 . . . . . . . . 43 ALA CA . 25025 1 167 . 1 1 43 43 ALA CB C 13 15.80 . . . . . . . . 43 ALA CB . 25025 1 168 . 1 1 43 43 ALA N N 15 129.86 . . . . . . . . 43 ALA N . 25025 1 169 . 1 1 45 45 SER H H 1 7.21 . . . . . . . . 45 SER H . 25025 1 170 . 1 1 45 45 SER C C 13 174.24 . . . . . . . . 45 SER C . 25025 1 171 . 1 1 45 45 SER CA C 13 56.40 . . . . . . . . 45 SER CA . 25025 1 172 . 1 1 45 45 SER CB C 13 66.60 . . . . . . . . 45 SER CB . 25025 1 173 . 1 1 45 45 SER N N 15 105.49 . . . . . . . . 45 SER N . 25025 1 174 . 1 1 46 46 ALA H H 1 8.45 . . . . . . . . 46 ALA H . 25025 1 175 . 1 1 46 46 ALA CA C 13 53.80 . . . . . . . . 46 ALA CA . 25025 1 176 . 1 1 46 46 ALA CB C 13 19.30 . . . . . . . . 46 ALA CB . 25025 1 177 . 1 1 46 46 ALA N N 15 125.98 . . . . . . . . 46 ALA N . 25025 1 178 . 1 1 47 47 TRP HE1 H 1 9.74 . . . . . . . . 47 TRP HE1 . 25025 1 179 . 1 1 47 47 TRP NE1 N 15 127.05 . . . . . . . . 47 TRP NE1 . 25025 1 180 . 1 1 48 48 ASN H H 1 8.94 . . . . . . . . 48 asn H . 25025 1 181 . 1 1 48 48 ASN C C 13 176.85 . . . . . . . . 48 asn C . 25025 1 182 . 1 1 48 48 ASN CA C 13 54.10 . . . . . . . . 48 asn CA . 25025 1 183 . 1 1 48 48 ASN CB C 13 40.50 . . . . . . . . 48 asn CB . 25025 1 184 . 1 1 48 48 ASN N N 15 116.13 . . . . . . . . 48 asn N . 25025 1 185 . 1 1 49 49 LEU H H 1 7.74 . . . . . . . . 49 LEU H . 25025 1 186 . 1 1 49 49 LEU C C 13 175.85 . . . . . . . . 49 LEU C . 25025 1 187 . 1 1 49 49 LEU CA C 13 58.00 . . . . . . . . 49 LEU CA . 25025 1 188 . 1 1 49 49 LEU CB C 13 43.90 . . . . . . . . 49 LEU CB . 25025 1 189 . 1 1 49 49 LEU N N 15 117.00 . . . . . . . . 49 LEU N . 25025 1 190 . 1 1 50 50 GLN H H 1 8.24 . . . . . . . . 50 GLN H . 25025 1 191 . 1 1 50 50 GLN C C 13 171.50 . . . . . . . . 50 GLN C . 25025 1 192 . 1 1 50 50 GLN CA C 13 54.60 . . . . . . . . 50 GLN CA . 25025 1 193 . 1 1 50 50 GLN CB C 13 30.60 . . . . . . . . 50 GLN CB . 25025 1 194 . 1 1 50 50 GLN N N 15 105.66 . . . . . . . . 50 GLN N . 25025 1 195 . 1 1 52 52 TRP H H 1 6.47 . . . . . . . . 52 TRP H . 25025 1 196 . 1 1 52 52 TRP C C 13 175.30 . . . . . . . . 52 TRP C . 25025 1 197 . 1 1 52 52 TRP CA C 13 53.00 . . . . . . . . 52 TRP CA . 25025 1 198 . 1 1 52 52 TRP CB C 13 29.70 . . . . . . . . 52 TRP CB . 25025 1 199 . 1 1 52 52 TRP N N 15 117.77 . . . . . . . . 52 TRP N . 25025 1 200 . 1 1 53 53 ARG H H 1 9.02 . . . . . . . . 53 ARG H . 25025 1 201 . 1 1 53 53 ARG C C 13 174.20 . . . . . . . . 53 ARG C . 25025 1 202 . 1 1 53 53 ARG CA C 13 53.70 . . . . . . . . 53 ARG CA . 25025 1 203 . 1 1 53 53 ARG CB C 13 32.40 . . . . . . . . 53 ARG CB . 25025 1 204 . 1 1 53 53 ARG N N 15 122.00 . . . . . . . . 53 ARG N . 25025 1 205 . 1 1 54 54 ILE H H 1 8.65 . . . . . . . . 54 ILE H . 25025 1 206 . 1 1 54 54 ILE C C 13 175.34 . . . . . . . . 54 ILE C . 25025 1 207 . 1 1 54 54 ILE CA C 13 59.40 . . . . . . . . 54 ILE CA . 25025 1 208 . 1 1 54 54 ILE CB C 13 43.30 . . . . . . . . 54 ILE CB . 25025 1 209 . 1 1 54 54 ILE N N 15 118.92 . . . . . . . . 54 ILE N . 25025 1 210 . 1 1 55 55 VAL H H 1 9.22 . . . . . . . . 55 VAL H . 25025 1 211 . 1 1 55 55 VAL C C 13 175.43 . . . . . . . . 55 VAL C . 25025 1 212 . 1 1 55 55 VAL CA C 13 60.70 . . . . . . . . 55 VAL CA . 25025 1 213 . 1 1 55 55 VAL CB C 13 33.70 . . . . . . . . 55 VAL CB . 25025 1 214 . 1 1 55 55 VAL N N 15 125.69 . . . . . . . . 55 VAL N . 25025 1 215 . 1 1 56 56 VAL H H 1 9.14 . . . . . . . . 56 VAL H . 25025 1 216 . 1 1 56 56 VAL C C 13 174.12 . . . . . . . . 56 VAL C . 25025 1 217 . 1 1 56 56 VAL CA C 13 61.90 . . . . . . . . 56 VAL CA . 25025 1 218 . 1 1 56 56 VAL CB C 13 31.70 . . . . . . . . 56 VAL CB . 25025 1 219 . 1 1 56 56 VAL N N 15 129.21 . . . . . . . . 56 VAL N . 25025 1 220 . 1 1 57 57 VAL H H 1 9.29 . . . . . . . . 57 VAL H . 25025 1 221 . 1 1 57 57 VAL C C 13 175.08 . . . . . . . . 57 VAL C . 25025 1 222 . 1 1 57 57 VAL CA C 13 62.50 . . . . . . . . 57 VAL CA . 25025 1 223 . 1 1 57 57 VAL CB C 13 31.80 . . . . . . . . 57 VAL CB . 25025 1 224 . 1 1 57 57 VAL N N 15 128.50 . . . . . . . . 57 VAL N . 25025 1 225 . 1 1 58 58 ARG H H 1 9.51 . . . . . . . . 58 ARG H . 25025 1 226 . 1 1 58 58 ARG C C 13 176.52 . . . . . . . . 58 ARG C . 25025 1 227 . 1 1 58 58 ARG CA C 13 56.00 . . . . . . . . 58 ARG CA . 25025 1 228 . 1 1 58 58 ARG CB C 13 33.20 . . . . . . . . 58 ARG CB . 25025 1 229 . 1 1 58 58 ARG N N 15 125.27 . . . . . . . . 58 ARG N . 25025 1 230 . 1 1 59 59 ASP H H 1 8.48 . . . . . . . . 59 ASP H . 25025 1 231 . 1 1 59 59 ASP CA C 13 53.10 . . . . . . . . 59 ASP CA . 25025 1 232 . 1 1 59 59 ASP CB C 13 43.40 . . . . . . . . 59 ASP CB . 25025 1 233 . 1 1 59 59 ASP N N 15 123.74 . . . . . . . . 59 ASP N . 25025 1 234 . 1 1 62 62 THR H H 1 8.28 . . . . . . . . 62 THR H . 25025 1 235 . 1 1 62 62 THR C C 13 176.67 . . . . . . . . 62 THR C . 25025 1 236 . 1 1 62 62 THR CA C 13 66.50 . . . . . . . . 62 THR CA . 25025 1 237 . 1 1 62 62 THR N N 15 118.32 . . . . . . . . 62 THR N . 25025 1 238 . 1 1 63 63 LYS H H 1 8.46 . . . . . . . . 63 LYS H . 25025 1 239 . 1 1 63 63 LYS C C 13 178.05 . . . . . . . . 63 LYS C . 25025 1 240 . 1 1 63 63 LYS CA C 13 62.10 . . . . . . . . 63 LYS CA . 25025 1 241 . 1 1 63 63 LYS CB C 13 31.80 . . . . . . . . 63 LYS CB . 25025 1 242 . 1 1 63 63 LYS N N 15 121.54 . . . . . . . . 63 LYS N . 25025 1 243 . 1 1 64 64 ARG H H 1 8.17 . . . . . . . . 64 ARG H . 25025 1 244 . 1 1 64 64 ARG C C 13 176.56 . . . . . . . . 64 ARG C . 25025 1 245 . 1 1 64 64 ARG CA C 13 60.40 . . . . . . . . 64 ARG CA . 25025 1 246 . 1 1 64 64 ARG CB C 13 30.00 . . . . . . . . 64 ARG CB . 25025 1 247 . 1 1 64 64 ARG N N 15 119.22 . . . . . . . . 64 ARG N . 25025 1 248 . 1 1 65 65 ALA H H 1 7.69 . . . . . . . . 65 ALA H . 25025 1 249 . 1 1 65 65 ALA C C 13 181.14 . . . . . . . . 65 ALA C . 25025 1 250 . 1 1 65 65 ALA CA C 13 55.30 . . . . . . . . 65 ALA CA . 25025 1 251 . 1 1 65 65 ALA CB C 13 18.20 . . . . . . . . 65 ALA CB . 25025 1 252 . 1 1 65 65 ALA N N 15 122.61 . . . . . . . . 65 ALA N . 25025 1 253 . 1 1 66 66 LEU H H 1 8.70 . . . . . . . . 66 LEU H . 25025 1 254 . 1 1 66 66 LEU C C 13 177.56 . . . . . . . . 66 LEU C . 25025 1 255 . 1 1 66 66 LEU CA C 13 57.40 . . . . . . . . 66 LEU CA . 25025 1 256 . 1 1 66 66 LEU CB C 13 41.80 . . . . . . . . 66 LEU CB . 25025 1 257 . 1 1 66 66 LEU N N 15 118.94 . . . . . . . . 66 LEU N . 25025 1 258 . 1 1 67 67 ARG H H 1 8.43 . . . . . . . . 67 ARG H . 25025 1 259 . 1 1 67 67 ARG C C 13 178.50 . . . . . . . . 67 ARG C . 25025 1 260 . 1 1 67 67 ARG CA C 13 60.10 . . . . . . . . 67 ARG CA . 25025 1 261 . 1 1 67 67 ARG CB C 13 29.20 . . . . . . . . 67 ARG CB . 25025 1 262 . 1 1 67 67 ARG N N 15 121.95 . . . . . . . . 67 ARG N . 25025 1 263 . 1 1 68 68 GLU H H 1 7.54 . . . . . . . . 68 GLU H . 25025 1 264 . 1 1 68 68 GLU C C 13 179.45 . . . . . . . . 68 GLU C . 25025 1 265 . 1 1 68 68 GLU CA C 13 59.40 . . . . . . . . 68 GLU CA . 25025 1 266 . 1 1 68 68 GLU CB C 13 29.40 . . . . . . . . 68 GLU CB . 25025 1 267 . 1 1 68 68 GLU N N 15 119.06 . . . . . . . . 68 GLU N . 25025 1 268 . 1 1 69 69 ALA H H 1 7.81 . . . . . . . . 69 ALA H . 25025 1 269 . 1 1 69 69 ALA C C 13 176.19 . . . . . . . . 69 ALA C . 25025 1 270 . 1 1 69 69 ALA CA C 13 54.20 . . . . . . . . 69 ALA CA . 25025 1 271 . 1 1 69 69 ALA CB C 13 18.80 . . . . . . . . 69 ALA CB . 25025 1 272 . 1 1 69 69 ALA N N 15 121.38 . . . . . . . . 69 ALA N . 25025 1 273 . 1 1 70 70 ALA H H 1 7.98 . . . . . . . . 70 ALA H . 25025 1 274 . 1 1 70 70 ALA C C 13 176.71 . . . . . . . . 70 ALA C . 25025 1 275 . 1 1 70 70 ALA CA C 13 51.10 . . . . . . . . 70 ALA CA . 25025 1 276 . 1 1 70 70 ALA CB C 13 18.20 . . . . . . . . 70 ALA CB . 25025 1 277 . 1 1 70 70 ALA N N 15 121.56 . . . . . . . . 70 ALA N . 25025 1 278 . 1 1 71 71 PHE H H 1 7.56 . . . . . . . . 71 PHE H . 25025 1 279 . 1 1 71 71 PHE C C 13 176.10 . . . . . . . . 71 PHE C . 25025 1 280 . 1 1 71 71 PHE CA C 13 58.60 . . . . . . . . 71 PHE CA . 25025 1 281 . 1 1 71 71 PHE CB C 13 35.90 . . . . . . . . 71 PHE CB . 25025 1 282 . 1 1 71 71 PHE N N 15 112.62 . . . . . . . . 71 PHE N . 25025 1 283 . 1 1 72 72 GLY H H 1 8.72 . . . . . . . . 72 GLY H . 25025 1 284 . 1 1 72 72 GLY C C 13 175.82 . . . . . . . . 72 GLY C . 25025 1 285 . 1 1 72 72 GLY CA C 13 46.20 . . . . . . . . 72 GLY CA . 25025 1 286 . 1 1 72 72 GLY N N 15 104.48 . . . . . . . . 72 GLY N . 25025 1 287 . 1 1 73 73 GLN H H 1 7.31 . . . . . . . . 73 GLN H . 25025 1 288 . 1 1 73 73 GLN C C 13 177.27 . . . . . . . . 73 GLN C . 25025 1 289 . 1 1 73 73 GLN CA C 13 58.00 . . . . . . . . 73 GLN CA . 25025 1 290 . 1 1 73 73 GLN CB C 13 29.90 . . . . . . . . 73 GLN CB . 25025 1 291 . 1 1 73 73 GLN N N 15 120.03 . . . . . . . . 73 GLN N . 25025 1 292 . 1 1 74 74 ALA H H 1 8.84 . . . . . . . . 74 ALA H . 25025 1 293 . 1 1 74 74 ALA C C 13 179.27 . . . . . . . . 74 ALA C . 25025 1 294 . 1 1 74 74 ALA CA C 13 56.10 . . . . . . . . 74 ALA CA . 25025 1 295 . 1 1 74 74 ALA CB C 13 19.00 . . . . . . . . 74 ALA CB . 25025 1 296 . 1 1 74 74 ALA N N 15 129.11 . . . . . . . . 74 ALA N . 25025 1 297 . 1 1 75 75 HIS H H 1 7.80 . . . . . . . . 75 HIS H . 25025 1 298 . 1 1 75 75 HIS C C 13 175.66 . . . . . . . . 75 HIS C . 25025 1 299 . 1 1 75 75 HIS CA C 13 57.70 . . . . . . . . 75 HIS CA . 25025 1 300 . 1 1 75 75 HIS CB C 13 29.80 . . . . . . . . 75 HIS CB . 25025 1 301 . 1 1 75 75 HIS N N 15 112.66 . . . . . . . . 75 HIS N . 25025 1 302 . 1 1 76 76 VAL H H 1 6.98 . . . . . . . . 76 VAL H . 25025 1 303 . 1 1 76 76 VAL C C 13 173.15 . . . . . . . . 76 VAL C . 25025 1 304 . 1 1 76 76 VAL CA C 13 65.80 . . . . . . . . 76 VAL CA . 25025 1 305 . 1 1 76 76 VAL CB C 13 32.40 . . . . . . . . 76 VAL CB . 25025 1 306 . 1 1 76 76 VAL N N 15 117.11 . . . . . . . . 76 VAL N . 25025 1 307 . 1 1 77 77 GLU H H 1 6.86 . . . . . . . . 77 GLU H . 25025 1 308 . 1 1 77 77 GLU C C 13 176.98 . . . . . . . . 77 GLU C . 25025 1 309 . 1 1 77 77 GLU CA C 13 57.80 . . . . . . . . 77 GLU CA . 25025 1 310 . 1 1 77 77 GLU CB C 13 32.50 . . . . . . . . 77 GLU CB . 25025 1 311 . 1 1 77 77 GLU N N 15 112.50 . . . . . . . . 77 GLU N . 25025 1 312 . 1 1 78 78 GLU H H 1 7.93 . . . . . . . . 78 GLU H . 25025 1 313 . 1 1 78 78 GLU C C 13 177.30 . . . . . . . . 78 GLU C . 25025 1 314 . 1 1 78 78 GLU CA C 13 58.10 . . . . . . . . 78 GLU CA . 25025 1 315 . 1 1 78 78 GLU CB C 13 31.90 . . . . . . . . 78 GLU CB . 25025 1 316 . 1 1 78 78 GLU N N 15 116.13 . . . . . . . . 78 GLU N . 25025 1 317 . 1 1 79 79 ALA H H 1 7.59 . . . . . . . . 79 ALA H . 25025 1 318 . 1 1 79 79 ALA C C 13 175.92 . . . . . . . . 79 ALA C . 25025 1 319 . 1 1 79 79 ALA CA C 13 50.80 . . . . . . . . 79 ALA CA . 25025 1 320 . 1 1 79 79 ALA CB C 13 18.10 . . . . . . . . 79 ALA CB . 25025 1 321 . 1 1 79 79 ALA N N 15 121.54 . . . . . . . . 79 ALA N . 25025 1 322 . 1 1 81 81 VAL H H 1 7.20 . . . . . . . . 81 VAL H . 25025 1 323 . 1 1 81 81 VAL C C 13 172.98 . . . . . . . . 81 VAL C . 25025 1 324 . 1 1 81 81 VAL CA C 13 60.10 . . . . . . . . 81 VAL CA . 25025 1 325 . 1 1 81 81 VAL CB C 13 36.30 . . . . . . . . 81 VAL CB . 25025 1 326 . 1 1 81 81 VAL N N 15 115.79 . . . . . . . . 81 VAL N . 25025 1 327 . 1 1 82 82 VAL H H 1 8.67 . . . . . . . . 82 VAL H . 25025 1 328 . 1 1 82 82 VAL C C 13 174.71 . . . . . . . . 82 VAL C . 25025 1 329 . 1 1 82 82 VAL CA C 13 60.60 . . . . . . . . 82 VAL CA . 25025 1 330 . 1 1 82 82 VAL CB C 13 35.50 . . . . . . . . 82 VAL CB . 25025 1 331 . 1 1 82 82 VAL N N 15 124.41 . . . . . . . . 82 VAL N . 25025 1 332 . 1 1 83 83 LEU CA C 13 52.60 . . . . . . . . 83 LEU CA . 25025 1 333 . 1 1 83 83 LEU CB C 13 43.30 . . . . . . . . 83 LEU CB . 25025 1 334 . 1 1 84 84 VAL H H 1 9.49 . . . . . . . . 84 VAL H . 25025 1 335 . 1 1 84 84 VAL C C 13 173.59 . . . . . . . . 84 VAL C . 25025 1 336 . 1 1 84 84 VAL CA C 13 62.40 . . . . . . . . 84 VAL CA . 25025 1 337 . 1 1 84 84 VAL CB C 13 32.40 . . . . . . . . 84 VAL CB . 25025 1 338 . 1 1 84 84 VAL N N 15 124.75 . . . . . . . . 84 VAL N . 25025 1 339 . 1 1 85 85 LEU H H 1 8.43 . . . . . . . . 85 LEU H . 25025 1 340 . 1 1 85 85 LEU CA C 13 54.10 . . . . . . . . 85 LEU CA . 25025 1 341 . 1 1 85 85 LEU CB C 13 43.60 . . . . . . . . 85 LEU CB . 25025 1 342 . 1 1 85 85 LEU N N 15 131.02 . . . . . . . . 85 LEU N . 25025 1 343 . 1 1 86 86 TYR H H 1 9.50 . . . . . . . . 86 TYR H . 25025 1 344 . 1 1 86 86 TYR C C 13 171.43 . . . . . . . . 86 TYR C . 25025 1 345 . 1 1 86 86 TYR CA C 13 54.90 . . . . . . . . 86 TYR CA . 25025 1 346 . 1 1 86 86 TYR CB C 13 41.90 . . . . . . . . 86 TYR CB . 25025 1 347 . 1 1 86 86 TYR N N 15 121.51 . . . . . . . . 86 TYR N . 25025 1 348 . 1 1 87 87 ALA H H 1 9.17 . . . . . . . . 87 ALA H . 25025 1 349 . 1 1 87 87 ALA C C 13 176.32 . . . . . . . . 87 ALA C . 25025 1 350 . 1 1 87 87 ALA CA C 13 50.70 . . . . . . . . 87 ALA CA . 25025 1 351 . 1 1 87 87 ALA CB C 13 22.20 . . . . . . . . 87 ALA CB . 25025 1 352 . 1 1 87 87 ALA N N 15 121.68 . . . . . . . . 87 ALA N . 25025 1 353 . 1 1 88 88 ASP H H 1 8.74 . . . . . . . . 88 ASP H . 25025 1 354 . 1 1 88 88 ASP C C 13 174.69 . . . . . . . . 88 ASP C . 25025 1 355 . 1 1 88 88 ASP CA C 13 51.90 . . . . . . . . 88 ASP CA . 25025 1 356 . 1 1 88 88 ASP CB C 13 42.40 . . . . . . . . 88 ASP CB . 25025 1 357 . 1 1 88 88 ASP N N 15 124.01 . . . . . . . . 88 ASP N . 25025 1 358 . 1 1 89 89 LEU H H 1 9.31 . . . . . . . . 89 LEU H . 25025 1 359 . 1 1 89 89 LEU C C 13 177.07 . . . . . . . . 89 LEU C . 25025 1 360 . 1 1 89 89 LEU CA C 13 56.80 . . . . . . . . 89 LEU CA . 25025 1 361 . 1 1 89 89 LEU CB C 13 42.80 . . . . . . . . 89 LEU CB . 25025 1 362 . 1 1 89 89 LEU N N 15 123.71 . . . . . . . . 89 LEU N . 25025 1 363 . 1 1 90 90 GLU H H 1 7.92 . . . . . . . . 90 GLU H . 25025 1 364 . 1 1 90 90 GLU C C 13 179.95 . . . . . . . . 90 GLU C . 25025 1 365 . 1 1 90 90 GLU CA C 13 59.10 . . . . . . . . 90 GLU CA . 25025 1 366 . 1 1 90 90 GLU CB C 13 28.40 . . . . . . . . 90 GLU CB . 25025 1 367 . 1 1 90 90 GLU N N 15 115.52 . . . . . . . . 90 GLU N . 25025 1 368 . 1 1 91 91 ASP H H 1 8.34 . . . . . . . . 91 ASP H . 25025 1 369 . 1 1 91 91 ASP C C 13 178.10 . . . . . . . . 91 ASP C . 25025 1 370 . 1 1 91 91 ASP CA C 13 57.70 . . . . . . . . 91 ASP CA . 25025 1 371 . 1 1 91 91 ASP CB C 13 43.40 . . . . . . . . 91 ASP CB . 25025 1 372 . 1 1 91 91 ASP N N 15 121.04 . . . . . . . . 91 ASP N . 25025 1 373 . 1 1 92 92 ALA H H 1 7.51 . . . . . . . . 92 ALA H . 25025 1 374 . 1 1 92 92 ALA C C 13 180.24 . . . . . . . . 92 ALA C . 25025 1 375 . 1 1 92 92 ALA CA C 13 55.10 . . . . . . . . 92 ALA CA . 25025 1 376 . 1 1 92 92 ALA CB C 13 18.70 . . . . . . . . 92 ALA CB . 25025 1 377 . 1 1 92 92 ALA N N 15 121.32 . . . . . . . . 92 ALA N . 25025 1 378 . 1 1 93 93 LEU H H 1 8.40 . . . . . . . . 93 LEU H . 25025 1 379 . 1 1 93 93 LEU C C 13 178.66 . . . . . . . . 93 LEU C . 25025 1 380 . 1 1 93 93 LEU CA C 13 57.00 . . . . . . . . 93 LEU CA . 25025 1 381 . 1 1 93 93 LEU CB C 13 41.70 . . . . . . . . 93 LEU CB . 25025 1 382 . 1 1 93 93 LEU N N 15 114.91 . . . . . . . . 93 LEU N . 25025 1 383 . 1 1 94 94 ALA H H 1 7.73 . . . . . . . . 94 ALA H . 25025 1 384 . 1 1 94 94 ALA C C 13 177.50 . . . . . . . . 94 ALA C . 25025 1 385 . 1 1 94 94 ALA CA C 13 53.10 . . . . . . . . 94 ALA CA . 25025 1 386 . 1 1 94 94 ALA CB C 13 18.70 . . . . . . . . 94 ALA CB . 25025 1 387 . 1 1 94 94 ALA N N 15 120.07 . . . . . . . . 94 ALA N . 25025 1 388 . 1 1 95 95 HIS H H 1 7.53 . . . . . . . . 95 HIS H . 25025 1 389 . 1 1 95 95 HIS C C 13 176.25 . . . . . . . . 95 HIS C . 25025 1 390 . 1 1 95 95 HIS CA C 13 55.50 . . . . . . . . 95 HIS CA . 25025 1 391 . 1 1 95 95 HIS CB C 13 28.80 . . . . . . . . 95 HIS CB . 25025 1 392 . 1 1 95 95 HIS N N 15 117.53 . . . . . . . . 95 HIS N . 25025 1 393 . 1 1 96 96 LEU H H 1 7.77 . . . . . . . . 96 LEU H . 25025 1 394 . 1 1 96 96 LEU CA C 13 58.10 . . . . . . . . 96 LEU CA . 25025 1 395 . 1 1 96 96 LEU CB C 13 42.90 . . . . . . . . 96 LEU CB . 25025 1 396 . 1 1 96 96 LEU N N 15 120.90 . . . . . . . . 96 LEU N . 25025 1 397 . 1 1 98 98 GLU H H 1 7.91 . . . . . . . . 98 GLU H . 25025 1 398 . 1 1 98 98 GLU C C 13 178.11 . . . . . . . . 98 GLU C . 25025 1 399 . 1 1 98 98 GLU CA C 13 58.10 . . . . . . . . 98 GLU CA . 25025 1 400 . 1 1 98 98 GLU CB C 13 31.50 . . . . . . . . 98 GLU CB . 25025 1 401 . 1 1 98 98 GLU N N 15 114.13 . . . . . . . . 98 GLU N . 25025 1 402 . 1 1 99 99 VAL H H 1 7.60 . . . . . . . . 99 VAL H . 25025 1 403 . 1 1 99 99 VAL C C 13 176.30 . . . . . . . . 99 VAL C . 25025 1 404 . 1 1 99 99 VAL CA C 13 62.00 . . . . . . . . 99 VAL CA . 25025 1 405 . 1 1 99 99 VAL CB C 13 31.90 . . . . . . . . 99 VAL CB . 25025 1 406 . 1 1 99 99 VAL N N 15 109.78 . . . . . . . . 99 VAL N . 25025 1 407 . 1 1 100 100 ILE H H 1 7.20 . . . . . . . . 100 ILE H . 25025 1 408 . 1 1 100 100 ILE C C 13 175.88 . . . . . . . . 100 ILE C . 25025 1 409 . 1 1 100 100 ILE CA C 13 61.40 . . . . . . . . 100 ILE CA . 25025 1 410 . 1 1 100 100 ILE CB C 13 38.00 . . . . . . . . 100 ILE CB . 25025 1 411 . 1 1 100 100 ILE N N 15 123.83 . . . . . . . . 100 ILE N . 25025 1 412 . 1 1 103 103 GLY H H 1 10.97 . . . . . . . . 103 GLY H . 25025 1 413 . 1 1 103 103 GLY CA C 13 45.50 . . . . . . . . 103 GLY CA . 25025 1 414 . 1 1 103 103 GLY N N 15 110.38 . . . . . . . . 103 GLY N . 25025 1 415 . 1 1 104 104 VAL H H 1 8.37 . . . . . . . . 104 VAL H . 25025 1 416 . 1 1 104 104 VAL C C 13 174.86 . . . . . . . . 104 VAL C . 25025 1 417 . 1 1 104 104 VAL CA C 13 62.70 . . . . . . . . 104 VAL CA . 25025 1 418 . 1 1 104 104 VAL CB C 13 31.10 . . . . . . . . 104 VAL CB . 25025 1 419 . 1 1 104 104 VAL N N 15 124.03 . . . . . . . . 104 VAL N . 25025 1 420 . 1 1 105 105 GLN H H 1 8.74 . . . . . . . . 105 GLN H . 25025 1 421 . 1 1 105 105 GLN C C 13 176.43 . . . . . . . . 105 GLN C . 25025 1 422 . 1 1 105 105 GLN CA C 13 54.50 . . . . . . . . 105 GLN CA . 25025 1 423 . 1 1 105 105 GLN CB C 13 33.30 . . . . . . . . 105 GLN CB . 25025 1 424 . 1 1 105 105 GLN N N 15 126.26 . . . . . . . . 105 GLN N . 25025 1 425 . 1 1 109 109 ARG H H 1 7.20 . . . . . . . . 109 ARG H . 25025 1 426 . 1 1 109 109 ARG C C 13 177.23 . . . . . . . . 109 ARG C . 25025 1 427 . 1 1 109 109 ARG CA C 13 59.40 . . . . . . . . 109 ARG CA . 25025 1 428 . 1 1 109 109 ARG CB C 13 30.40 . . . . . . . . 109 ARG CB . 25025 1 429 . 1 1 109 109 ARG N N 15 121.11 . . . . . . . . 109 ARG N . 25025 1 430 . 1 1 110 110 GLU H H 1 7.78 . . . . . . . . 110 GLU H . 25025 1 431 . 1 1 110 110 GLU C C 13 178.74 . . . . . . . . 110 GLU C . 25025 1 432 . 1 1 110 110 GLU CA C 13 59.30 . . . . . . . . 110 GLU CA . 25025 1 433 . 1 1 110 110 GLU CB C 13 29.30 . . . . . . . . 110 GLU CB . 25025 1 434 . 1 1 110 110 GLU N N 15 118.57 . . . . . . . . 110 GLU N . 25025 1 435 . 1 1 111 111 ALA H H 1 8.45 . . . . . . . . 111 ALA H . 25025 1 436 . 1 1 111 111 ALA C C 13 180.89 . . . . . . . . 111 ALA C . 25025 1 437 . 1 1 111 111 ALA CA C 13 55.20 . . . . . . . . 111 ALA CA . 25025 1 438 . 1 1 111 111 ALA CB C 13 18.40 . . . . . . . . 111 ALA CB . 25025 1 439 . 1 1 111 111 ALA N N 15 121.19 . . . . . . . . 111 ALA N . 25025 1 440 . 1 1 112 112 GLN H H 1 7.97 . . . . . . . . 112 GLN H . 25025 1 441 . 1 1 112 112 GLN C C 13 177.97 . . . . . . . . 112 GLN C . 25025 1 442 . 1 1 112 112 GLN CA C 13 59.50 . . . . . . . . 112 GLN CA . 25025 1 443 . 1 1 112 112 GLN CB C 13 28.40 . . . . . . . . 112 GLN CB . 25025 1 444 . 1 1 112 112 GLN N N 15 119.52 . . . . . . . . 112 GLN N . 25025 1 445 . 1 1 113 113 LYS H H 1 8.03 . . . . . . . . 113 LYS H . 25025 1 446 . 1 1 113 113 LYS C C 13 178.20 . . . . . . . . 113 LYS C . 25025 1 447 . 1 1 113 113 LYS CA C 13 61.10 . . . . . . . . 113 LYS CA . 25025 1 448 . 1 1 113 113 LYS CB C 13 32.50 . . . . . . . . 113 LYS CB . 25025 1 449 . 1 1 113 113 LYS N N 15 118.11 . . . . . . . . 113 LYS N . 25025 1 450 . 1 1 114 114 GLN H H 1 8.15 . . . . . . . . 114 GLN H . 25025 1 451 . 1 1 114 114 GLN C C 13 178.15 . . . . . . . . 114 GLN C . 25025 1 452 . 1 1 114 114 GLN CA C 13 58.90 . . . . . . . . 114 GLN CA . 25025 1 453 . 1 1 114 114 GLN CB C 13 28.60 . . . . . . . . 114 GLN CB . 25025 1 454 . 1 1 114 114 GLN N N 15 116.70 . . . . . . . . 114 GLN N . 25025 1 455 . 1 1 115 115 ALA H H 1 7.97 . . . . . . . . 115 ALA H . 25025 1 456 . 1 1 115 115 ALA C C 13 179.99 . . . . . . . . 115 ALA C . 25025 1 457 . 1 1 115 115 ALA CA C 13 55.30 . . . . . . . . 115 ALA CA . 25025 1 458 . 1 1 115 115 ALA CB C 13 18.20 . . . . . . . . 115 ALA CB . 25025 1 459 . 1 1 115 115 ALA N N 15 122.38 . . . . . . . . 115 ALA N . 25025 1 460 . 1 1 116 116 ILE H H 1 7.72 . . . . . . . . 116 ILE H . 25025 1 461 . 1 1 116 116 ILE CA C 13 65.20 . . . . . . . . 116 ILE CA . 25025 1 462 . 1 1 116 116 ILE CB C 13 37.90 . . . . . . . . 116 ILE CB . 25025 1 463 . 1 1 116 116 ILE N N 15 119.43 . . . . . . . . 116 ILE N . 25025 1 464 . 1 1 117 117 GLN H H 1 8.04 . . . . . . . . 117 GLN H . 25025 1 465 . 1 1 117 117 GLN C C 13 180.02 . . . . . . . . 117 GLN C . 25025 1 466 . 1 1 117 117 GLN CA C 13 59.80 . . . . . . . . 117 GLN CA . 25025 1 467 . 1 1 117 117 GLN CB C 13 28.30 . . . . . . . . 117 GLN CB . 25025 1 468 . 1 1 117 117 GLN N N 15 116.28 . . . . . . . . 117 GLN N . 25025 1 469 . 1 1 118 118 ARG H H 1 8.37 . . . . . . . . 118 ARG H . 25025 1 470 . 1 1 118 118 ARG C C 13 178.38 . . . . . . . . 118 ARG C . 25025 1 471 . 1 1 118 118 ARG CA C 13 59.50 . . . . . . . . 118 ARG CA . 25025 1 472 . 1 1 118 118 ARG CB C 13 30.50 . . . . . . . . 118 ARG CB . 25025 1 473 . 1 1 118 118 ARG N N 15 118.33 . . . . . . . . 118 ARG N . 25025 1 474 . 1 1 119 119 ALA H H 1 7.52 . . . . . . . . 119 ALA H . 25025 1 475 . 1 1 119 119 ALA C C 13 179.40 . . . . . . . . 119 ALA C . 25025 1 476 . 1 1 119 119 ALA CA C 13 54.70 . . . . . . . . 119 ALA CA . 25025 1 477 . 1 1 119 119 ALA CB C 13 17.90 . . . . . . . . 119 ALA CB . 25025 1 478 . 1 1 119 119 ALA N N 15 121.58 . . . . . . . . 119 ALA N . 25025 1 479 . 1 1 120 120 PHE H H 1 7.22 . . . . . . . . 120 PHE H . 25025 1 480 . 1 1 120 120 PHE C C 13 177.64 . . . . . . . . 120 PHE C . 25025 1 481 . 1 1 120 120 PHE CA C 13 59.90 . . . . . . . . 120 PHE CA . 25025 1 482 . 1 1 120 120 PHE CB C 13 40.20 . . . . . . . . 120 PHE CB . 25025 1 483 . 1 1 120 120 PHE N N 15 112.29 . . . . . . . . 120 PHE N . 25025 1 484 . 1 1 121 121 ALA H H 1 7.90 . . . . . . . . 121 ALA H . 25025 1 485 . 1 1 121 121 ALA C C 13 178.12 . . . . . . . . 121 ALA C . 25025 1 486 . 1 1 121 121 ALA CA C 13 55.60 . . . . . . . . 121 ALA CA . 25025 1 487 . 1 1 121 121 ALA CB C 13 18.80 . . . . . . . . 121 ALA CB . 25025 1 488 . 1 1 121 121 ALA N N 15 124.95 . . . . . . . . 121 ALA N . 25025 1 489 . 1 1 123 123 MET H H 1 7.65 . . . . . . . . 123 MET H . 25025 1 490 . 1 1 123 123 MET CA C 13 56.40 . . . . . . . . 123 MET CA . 25025 1 491 . 1 1 123 123 MET CB C 13 35.90 . . . . . . . . 123 MET CB . 25025 1 492 . 1 1 123 123 MET N N 15 119.95 . . . . . . . . 123 MET N . 25025 1 493 . 1 1 128 128 ARG H H 1 8.95 . . . . . . . . 128 ARG H . 25025 1 494 . 1 1 128 128 ARG C C 13 178.39 . . . . . . . . 128 ARG C . 25025 1 495 . 1 1 128 128 ARG CA C 13 60.90 . . . . . . . . 128 ARG CA . 25025 1 496 . 1 1 128 128 ARG CB C 13 31.50 . . . . . . . . 128 ARG CB . 25025 1 497 . 1 1 128 128 ARG N N 15 120.81 . . . . . . . . 128 ARG N . 25025 1 498 . 1 1 129 129 LYS H H 1 8.33 . . . . . . . . 129 LYS H . 25025 1 499 . 1 1 129 129 LYS C C 13 180.02 . . . . . . . . 129 LYS C . 25025 1 500 . 1 1 129 129 LYS CA C 13 60.70 . . . . . . . . 129 LYS CA . 25025 1 501 . 1 1 129 129 LYS CB C 13 33.20 . . . . . . . . 129 LYS CB . 25025 1 502 . 1 1 129 129 LYS N N 15 119.32 . . . . . . . . 129 LYS N . 25025 1 503 . 1 1 130 130 ALA H H 1 8.43 . . . . . . . . 130 ALA H . 25025 1 504 . 1 1 130 130 ALA C C 13 180.58 . . . . . . . . 130 ALA C . 25025 1 505 . 1 1 130 130 ALA CA C 13 55.50 . . . . . . . . 130 ALA CA . 25025 1 506 . 1 1 130 130 ALA CB C 13 18.80 . . . . . . . . 130 ALA CB . 25025 1 507 . 1 1 130 130 ALA N N 15 123.26 . . . . . . . . 130 ALA N . 25025 1 508 . 1 1 131 131 TRP H H 1 9.16 . . . . . . . . 131 TRP H . 25025 1 509 . 1 1 131 131 TRP HE1 H 1 10.18 . . . . . . . . 131 TRP HE1 . 25025 1 510 . 1 1 131 131 TRP C C 13 180.21 . . . . . . . . 131 TRP C . 25025 1 511 . 1 1 131 131 TRP CA C 13 62.90 . . . . . . . . 131 TRP CA . 25025 1 512 . 1 1 131 131 TRP CB C 13 30.70 . . . . . . . . 131 TRP CB . 25025 1 513 . 1 1 131 131 TRP N N 15 122.59 . . . . . . . . 131 TRP N . 25025 1 514 . 1 1 131 131 TRP NE1 N 15 129.47 . . . . . . . . 131 TRP NE1 . 25025 1 515 . 1 1 132 132 ALA H H 1 9.34 . . . . . . . . 132 ALA H . 25025 1 516 . 1 1 132 132 ALA C C 13 180.28 . . . . . . . . 132 ALA C . 25025 1 517 . 1 1 132 132 ALA CA C 13 55.80 . . . . . . . . 132 ALA CA . 25025 1 518 . 1 1 132 132 ALA CB C 13 20.00 . . . . . . . . 132 ALA CB . 25025 1 519 . 1 1 132 132 ALA N N 15 121.61 . . . . . . . . 132 ALA N . 25025 1 520 . 1 1 133 133 SER H H 1 8.83 . . . . . . . . 133 SER H . 25025 1 521 . 1 1 133 133 SER CA C 13 63.00 . . . . . . . . 133 SER CA . 25025 1 522 . 1 1 133 133 SER N N 15 116.78 . . . . . . . . 133 SER N . 25025 1 523 . 1 1 134 134 GLY H H 1 8.33 . . . . . . . . 134 GLY H . 25025 1 524 . 1 1 134 134 GLY C C 13 174.76 . . . . . . . . 134 GLY C . 25025 1 525 . 1 1 134 134 GLY CA C 13 49.00 . . . . . . . . 134 GLY CA . 25025 1 526 . 1 1 134 134 GLY N N 15 107.70 . . . . . . . . 134 GLY N . 25025 1 527 . 1 1 135 135 GLN H H 1 7.21 . . . . . . . . 135 GLN H . 25025 1 528 . 1 1 135 135 GLN C C 13 178.56 . . . . . . . . 135 GLN C . 25025 1 529 . 1 1 135 135 GLN CA C 13 57.60 . . . . . . . . 135 GLN CA . 25025 1 530 . 1 1 135 135 GLN CB C 13 28.40 . . . . . . . . 135 GLN CB . 25025 1 531 . 1 1 135 135 GLN N N 15 113.79 . . . . . . . . 135 GLN N . 25025 1 532 . 1 1 136 136 SER H H 1 7.75 . . . . . . . . 136 SER H . 25025 1 533 . 1 1 136 136 SER C C 13 174.86 . . . . . . . . 136 SER C . 25025 1 534 . 1 1 136 136 SER CA C 13 62.80 . . . . . . . . 136 SER CA . 25025 1 535 . 1 1 136 136 SER N N 15 112.65 . . . . . . . . 136 SER N . 25025 1 536 . 1 1 137 137 TYR H H 1 8.13 . . . . . . . . 137 TYR H . 25025 1 537 . 1 1 137 137 TYR C C 13 177.33 . . . . . . . . 137 TYR C . 25025 1 538 . 1 1 137 137 TYR CA C 13 61.90 . . . . . . . . 137 TYR CA . 25025 1 539 . 1 1 137 137 TYR CB C 13 38.40 . . . . . . . . 137 TYR CB . 25025 1 540 . 1 1 137 137 TYR N N 15 121.92 . . . . . . . . 137 TYR N . 25025 1 541 . 1 1 138 138 ILE H H 1 7.80 . . . . . . . . 138 ILE H . 25025 1 542 . 1 1 138 138 ILE C C 13 178.78 . . . . . . . . 138 ILE C . 25025 1 543 . 1 1 138 138 ILE CA C 13 66.00 . . . . . . . . 138 ILE CA . 25025 1 544 . 1 1 138 138 ILE CB C 13 37.90 . . . . . . . . 138 ILE CB . 25025 1 545 . 1 1 138 138 ILE N N 15 121.38 . . . . . . . . 138 ILE N . 25025 1 546 . 1 1 139 139 LEU H H 1 6.16 . . . . . . . . 139 LEU H . 25025 1 547 . 1 1 139 139 LEU C C 13 178.65 . . . . . . . . 139 LEU C . 25025 1 548 . 1 1 139 139 LEU CA C 13 58.50 . . . . . . . . 139 LEU CA . 25025 1 549 . 1 1 139 139 LEU CB C 13 39.70 . . . . . . . . 139 LEU CB . 25025 1 550 . 1 1 139 139 LEU N N 15 118.83 . . . . . . . . 139 LEU N . 25025 1 551 . 1 1 140 140 LEU H H 1 8.27 . . . . . . . . 140 LEU H . 25025 1 552 . 1 1 140 140 LEU C C 13 177.61 . . . . . . . . 140 LEU C . 25025 1 553 . 1 1 140 140 LEU CA C 13 58.60 . . . . . . . . 140 LEU CA . 25025 1 554 . 1 1 140 140 LEU CB C 13 41.30 . . . . . . . . 140 LEU CB . 25025 1 555 . 1 1 140 140 LEU N N 15 118.32 . . . . . . . . 140 LEU N . 25025 1 556 . 1 1 141 141 GLY H H 1 8.68 . . . . . . . . 141 GLY H . 25025 1 557 . 1 1 141 141 GLY C C 13 174.09 . . . . . . . . 141 GLY C . 25025 1 558 . 1 1 141 141 GLY CA C 13 49.30 . . . . . . . . 141 GLY CA . 25025 1 559 . 1 1 141 141 GLY N N 15 106.39 . . . . . . . . 141 GLY N . 25025 1 560 . 1 1 142 142 TYR H H 1 8.13 . . . . . . . . 142 TYR H . 25025 1 561 . 1 1 142 142 TYR C C 13 177.94 . . . . . . . . 142 TYR C . 25025 1 562 . 1 1 142 142 TYR CA C 13 62.90 . . . . . . . . 142 TYR CA . 25025 1 563 . 1 1 142 142 TYR CB C 13 40.30 . . . . . . . . 142 TYR CB . 25025 1 564 . 1 1 142 142 TYR N N 15 121.61 . . . . . . . . 142 TYR N . 25025 1 565 . 1 1 143 143 LEU H H 1 9.15 . . . . . . . . 143 LEU H . 25025 1 566 . 1 1 143 143 LEU C C 13 177.91 . . . . . . . . 143 LEU C . 25025 1 567 . 1 1 143 143 LEU CA C 13 58.40 . . . . . . . . 143 LEU CA . 25025 1 568 . 1 1 143 143 LEU CB C 13 43.20 . . . . . . . . 143 LEU CB . 25025 1 569 . 1 1 143 143 LEU N N 15 116.10 . . . . . . . . 143 LEU N . 25025 1 570 . 1 1 144 144 LEU H H 1 9.05 . . . . . . . . 144 LEU H . 25025 1 571 . 1 1 144 144 LEU C C 13 180.08 . . . . . . . . 144 LEU C . 25025 1 572 . 1 1 144 144 LEU CA C 13 58.20 . . . . . . . . 144 LEU CA . 25025 1 573 . 1 1 144 144 LEU CB C 13 41.50 . . . . . . . . 144 LEU CB . 25025 1 574 . 1 1 144 144 LEU N N 15 116.11 . . . . . . . . 144 LEU N . 25025 1 575 . 1 1 145 145 LEU H H 1 7.72 . . . . . . . . 145 LEU H . 25025 1 576 . 1 1 145 145 LEU C C 13 178.98 . . . . . . . . 145 LEU C . 25025 1 577 . 1 1 145 145 LEU CA C 13 59.20 . . . . . . . . 145 LEU CA . 25025 1 578 . 1 1 145 145 LEU CB C 13 42.00 . . . . . . . . 145 LEU CB . 25025 1 579 . 1 1 145 145 LEU N N 15 122.01 . . . . . . . . 145 LEU N . 25025 1 580 . 1 1 146 146 LEU H H 1 8.63 . . . . . . . . 146 LEU H . 25025 1 581 . 1 1 146 146 LEU C C 13 178.69 . . . . . . . . 146 LEU C . 25025 1 582 . 1 1 146 146 LEU CA C 13 59.00 . . . . . . . . 146 LEU CA . 25025 1 583 . 1 1 146 146 LEU CB C 13 42.80 . . . . . . . . 146 LEU CB . 25025 1 584 . 1 1 146 146 LEU N N 15 119.31 . . . . . . . . 146 LEU N . 25025 1 585 . 1 1 147 147 LEU H H 1 8.90 . . . . . . . . 147 LEU H . 25025 1 586 . 1 1 147 147 LEU C C 13 178.35 . . . . . . . . 147 LEU C . 25025 1 587 . 1 1 147 147 LEU CA C 13 59.20 . . . . . . . . 147 LEU CA . 25025 1 588 . 1 1 147 147 LEU CB C 13 41.70 . . . . . . . . 147 LEU CB . 25025 1 589 . 1 1 147 147 LEU N N 15 117.35 . . . . . . . . 147 LEU N . 25025 1 590 . 1 1 148 148 GLU H H 1 7.17 . . . . . . . . 148 GLU H . 25025 1 591 . 1 1 148 148 GLU C C 13 179.69 . . . . . . . . 148 GLU C . 25025 1 592 . 1 1 148 148 GLU CA C 13 59.40 . . . . . . . . 148 GLU CA . 25025 1 593 . 1 1 148 148 GLU CB C 13 28.90 . . . . . . . . 148 GLU CB . 25025 1 594 . 1 1 148 148 GLU N N 15 117.51 . . . . . . . . 148 GLU N . 25025 1 595 . 1 1 149 149 ALA H H 1 8.58 . . . . . . . . 149 ALA H . 25025 1 596 . 1 1 149 149 ALA C C 13 178.17 . . . . . . . . 149 ALA C . 25025 1 597 . 1 1 149 149 ALA CA C 13 54.90 . . . . . . . . 149 ALA CA . 25025 1 598 . 1 1 149 149 ALA CB C 13 18.70 . . . . . . . . 149 ALA CB . 25025 1 599 . 1 1 149 149 ALA N N 15 122.01 . . . . . . . . 149 ALA N . 25025 1 600 . 1 1 150 150 TYR H H 1 8.13 . . . . . . . . 150 TYR H . 25025 1 601 . 1 1 150 150 TYR C C 13 175.73 . . . . . . . . 150 TYR C . 25025 1 602 . 1 1 150 150 TYR CA C 13 59.20 . . . . . . . . 150 TYR CA . 25025 1 603 . 1 1 150 150 TYR CB C 13 40.30 . . . . . . . . 150 TYR CB . 25025 1 604 . 1 1 150 150 TYR N N 15 116.70 . . . . . . . . 150 TYR N . 25025 1 605 . 1 1 151 151 GLY H H 1 8.30 . . . . . . . . 151 GLY H . 25025 1 606 . 1 1 151 151 GLY C C 13 174.32 . . . . . . . . 151 GLY C . 25025 1 607 . 1 1 151 151 GLY CA C 13 46.50 . . . . . . . . 151 GLY CA . 25025 1 608 . 1 1 151 151 GLY N N 15 108.44 . . . . . . . . 151 GLY N . 25025 1 609 . 1 1 152 152 LEU H H 1 8.22 . . . . . . . . 152 LEU H . 25025 1 610 . 1 1 152 152 LEU C C 13 177.92 . . . . . . . . 152 LEU C . 25025 1 611 . 1 1 152 152 LEU CA C 13 53.70 . . . . . . . . 152 LEU CA . 25025 1 612 . 1 1 152 152 LEU CB C 13 43.80 . . . . . . . . 152 LEU CB . 25025 1 613 . 1 1 152 152 LEU N N 15 119.37 . . . . . . . . 152 LEU N . 25025 1 614 . 1 1 153 153 GLY H H 1 9.18 . . . . . . . . 153 GLY H . 25025 1 615 . 1 1 153 153 GLY C C 13 109.13 . . . . . . . . 153 GLY C . 25025 1 616 . 1 1 153 153 GLY CA C 13 44.70 . . . . . . . . 153 GLY CA . 25025 1 617 . 1 1 153 153 GLY N N 15 109.13 . . . . . . . . 153 GLY N . 25025 1 618 . 1 1 154 154 SER H H 1 10.35 . . . . . . . . 154 SER H . 25025 1 619 . 1 1 154 154 SER C C 13 175.11 . . . . . . . . 154 SER C . 25025 1 620 . 1 1 154 154 SER CA C 13 58.30 . . . . . . . . 154 SER CA . 25025 1 621 . 1 1 154 154 SER CB C 13 69.70 . . . . . . . . 154 SER CB . 25025 1 622 . 1 1 154 154 SER N N 15 116.36 . . . . . . . . 154 SER N . 25025 1 623 . 1 1 155 155 VAL H H 1 8.61 . . . . . . . . 155 VAL H . 25025 1 624 . 1 1 155 155 VAL C C 13 172.56 . . . . . . . . 155 VAL C . 25025 1 625 . 1 1 155 155 VAL CA C 13 57.70 . . . . . . . . 155 VAL CA . 25025 1 626 . 1 1 155 155 VAL CB C 13 34.80 . . . . . . . . 155 VAL CB . 25025 1 627 . 1 1 155 155 VAL N N 15 114.11 . . . . . . . . 155 VAL N . 25025 1 628 . 1 1 158 158 LEU H H 1 7.84 . . . . . . . . 158 LEU H . 25025 1 629 . 1 1 158 158 LEU CA C 13 53.00 . . . . . . . . 158 LEU CA . 25025 1 630 . 1 1 158 158 LEU CB C 13 41.10 . . . . . . . . 158 LEU CB . 25025 1 631 . 1 1 158 158 LEU N N 15 118.30 . . . . . . . . 158 LEU N . 25025 1 632 . 1 1 159 159 GLY H H 1 8.62 . . . . . . . . 159 GLY H . 25025 1 633 . 1 1 159 159 GLY N N 15 109.56 . . . . . . . . 159 GLY N . 25025 1 634 . 1 1 160 160 PHE H H 1 7.72 . . . . . . . . 160 PHE H . 25025 1 635 . 1 1 160 160 PHE C C 13 172.97 . . . . . . . . 160 PHE C . 25025 1 636 . 1 1 160 160 PHE CA C 13 56.20 . . . . . . . . 160 PHE CA . 25025 1 637 . 1 1 160 160 PHE CB C 13 40.50 . . . . . . . . 160 PHE CB . 25025 1 638 . 1 1 160 160 PHE N N 15 116.70 . . . . . . . . 160 PHE N . 25025 1 639 . 1 1 161 161 ASP H H 1 8.45 . . . . . . . . 161 ASP H . 25025 1 640 . 1 1 161 161 ASP CA C 13 50.80 . . . . . . . . 161 ASP CA . 25025 1 641 . 1 1 161 161 ASP CB C 13 42.30 . . . . . . . . 161 ASP CB . 25025 1 642 . 1 1 161 161 ASP N N 15 121.19 . . . . . . . . 161 ASP N . 25025 1 643 . 1 1 166 166 ARG H H 1 8.47 . . . . . . . . 166 ARG H . 25025 1 644 . 1 1 166 166 ARG C C 13 178.29 . . . . . . . . 166 ARG C . 25025 1 645 . 1 1 166 166 ARG CA C 13 60.90 . . . . . . . . 166 ARG CA . 25025 1 646 . 1 1 166 166 ARG CB C 13 30.20 . . . . . . . . 166 ARG CB . 25025 1 647 . 1 1 166 166 ARG N N 15 117.36 . . . . . . . . 166 ARG N . 25025 1 648 . 1 1 167 167 ALA H H 1 7.73 . . . . . . . . 167 ALA H . 25025 1 649 . 1 1 167 167 ALA C C 13 180.51 . . . . . . . . 167 ALA C . 25025 1 650 . 1 1 167 167 ALA CA C 13 54.90 . . . . . . . . 167 ALA CA . 25025 1 651 . 1 1 167 167 ALA CB C 13 18.80 . . . . . . . . 167 ALA CB . 25025 1 652 . 1 1 167 167 ALA N N 15 120.07 . . . . . . . . 167 ALA N . 25025 1 653 . 1 1 168 168 ILE H H 1 8.39 . . . . . . . . 168 ILE H . 25025 1 654 . 1 1 168 168 ILE C C 13 177.50 . . . . . . . . 168 ILE C . 25025 1 655 . 1 1 168 168 ILE CA C 13 64.80 . . . . . . . . 168 ILE CA . 25025 1 656 . 1 1 168 168 ILE CB C 13 39.40 . . . . . . . . 168 ILE CB . 25025 1 657 . 1 1 168 168 ILE N N 15 119.13 . . . . . . . . 168 ILE N . 25025 1 658 . 1 1 169 169 LEU H H 1 7.42 . . . . . . . . 169 LEU H . 25025 1 659 . 1 1 169 169 LEU C C 13 176.28 . . . . . . . . 169 LEU C . 25025 1 660 . 1 1 169 169 LEU CA C 13 54.30 . . . . . . . . 169 LEU CA . 25025 1 661 . 1 1 169 169 LEU CB C 13 43.00 . . . . . . . . 169 LEU CB . 25025 1 662 . 1 1 169 169 LEU N N 15 113.91 . . . . . . . . 169 LEU N . 25025 1 663 . 1 1 170 170 GLY H H 1 7.98 . . . . . . . . 170 GLY H . 25025 1 664 . 1 1 170 170 GLY C C 13 110.83 . . . . . . . . 170 GLY C . 25025 1 665 . 1 1 170 170 GLY CA C 13 47.20 . . . . . . . . 170 GLY CA . 25025 1 666 . 1 1 170 170 GLY N N 15 110.83 . . . . . . . . 170 GLY N . 25025 1 667 . 1 1 171 171 LEU H H 1 7.87 . . . . . . . . 171 LEU H . 25025 1 668 . 1 1 171 171 LEU C C 13 173.56 . . . . . . . . 171 LEU C . 25025 1 669 . 1 1 171 171 LEU CA C 13 52.60 . . . . . . . . 171 LEU CA . 25025 1 670 . 1 1 171 171 LEU CB C 13 40.20 . . . . . . . . 171 LEU CB . 25025 1 671 . 1 1 171 171 LEU N N 15 117.29 . . . . . . . . 171 LEU N . 25025 1 672 . 1 1 175 175 ALA H H 1 7.31 . . . . . . . . 175 ALA H . 25025 1 673 . 1 1 175 175 ALA C C 13 177.66 . . . . . . . . 175 ALA C . 25025 1 674 . 1 1 175 175 ALA CA C 13 52.50 . . . . . . . . 175 ALA CA . 25025 1 675 . 1 1 175 175 ALA CB C 13 19.80 . . . . . . . . 175 ALA CB . 25025 1 676 . 1 1 175 175 ALA N N 15 122.69 . . . . . . . . 175 ALA N . 25025 1 677 . 1 1 176 176 ALA H H 1 8.49 . . . . . . . . 176 ALA H . 25025 1 678 . 1 1 176 176 ALA C C 13 177.06 . . . . . . . . 176 ALA C . 25025 1 679 . 1 1 176 176 ALA CA C 13 50.90 . . . . . . . . 176 ALA CA . 25025 1 680 . 1 1 176 176 ALA CB C 13 21.90 . . . . . . . . 176 ALA CB . 25025 1 681 . 1 1 176 176 ALA N N 15 125.05 . . . . . . . . 176 ALA N . 25025 1 682 . 1 1 179 179 ALA H H 1 7.66 . . . . . . . . 179 ALA H . 25025 1 683 . 1 1 179 179 ALA C C 13 174.88 . . . . . . . . 179 ALA C . 25025 1 684 . 1 1 179 179 ALA CA C 13 53.70 . . . . . . . . 179 ALA CA . 25025 1 685 . 1 1 179 179 ALA CB C 13 22.20 . . . . . . . . 179 ALA CB . 25025 1 686 . 1 1 179 179 ALA N N 15 111.47 . . . . . . . . 179 ALA N . 25025 1 687 . 1 1 180 180 LEU H H 1 8.08 . . . . . . . . 180 LEU H . 25025 1 688 . 1 1 180 180 LEU C C 13 176.84 . . . . . . . . 180 LEU C . 25025 1 689 . 1 1 180 180 LEU CA C 13 55.60 . . . . . . . . 180 LEU CA . 25025 1 690 . 1 1 180 180 LEU CB C 13 44.40 . . . . . . . . 180 LEU CB . 25025 1 691 . 1 1 180 180 LEU N N 15 117.88 . . . . . . . . 180 LEU N . 25025 1 692 . 1 1 181 181 VAL H H 1 9.62 . . . . . . . . 181 VAL H . 25025 1 693 . 1 1 181 181 VAL C C 13 174.77 . . . . . . . . 181 VAL C . 25025 1 694 . 1 1 181 181 VAL CA C 13 61.50 . . . . . . . . 181 VAL CA . 25025 1 695 . 1 1 181 181 VAL CB C 13 35.10 . . . . . . . . 181 VAL CB . 25025 1 696 . 1 1 181 181 VAL N N 15 121.34 . . . . . . . . 181 VAL N . 25025 1 697 . 1 1 182 182 ALA H H 1 7.78 . . . . . . . . 182 ALA H . 25025 1 698 . 1 1 182 182 ALA C C 13 174.66 . . . . . . . . 182 ALA C . 25025 1 699 . 1 1 182 182 ALA CA C 13 51.10 . . . . . . . . 182 ALA CA . 25025 1 700 . 1 1 182 182 ALA CB C 13 19.90 . . . . . . . . 182 ALA CB . 25025 1 701 . 1 1 182 182 ALA N N 15 132.10 . . . . . . . . 182 ALA N . 25025 1 702 . 1 1 183 183 LEU H H 1 8.35 . . . . . . . . 183 LEU H . 25025 1 703 . 1 1 183 183 LEU C C 13 173.39 . . . . . . . . 183 LEU C . 25025 1 704 . 1 1 183 183 LEU CA C 13 54.80 . . . . . . . . 183 LEU CA . 25025 1 705 . 1 1 183 183 LEU CB C 13 45.30 . . . . . . . . 183 LEU CB . 25025 1 706 . 1 1 183 183 LEU N N 15 117.26 . . . . . . . . 183 LEU N . 25025 1 707 . 1 1 184 184 GLY H H 1 8.07 . . . . . . . . 184 GLY H . 25025 1 708 . 1 1 184 184 GLY C C 13 171.92 . . . . . . . . 184 GLY C . 25025 1 709 . 1 1 184 184 GLY CA C 13 44.50 . . . . . . . . 184 GLY CA . 25025 1 710 . 1 1 184 184 GLY N N 15 132.20 . . . . . . . . 184 GLY N . 25025 1 711 . 1 1 185 185 TYR H H 1 9.97 . . . . . . . . 185 TYR H . 25025 1 712 . 1 1 185 185 TYR C C 13 175.06 . . . . . . . . 185 TYR C . 25025 1 713 . 1 1 185 185 TYR CA C 13 58.50 . . . . . . . . 185 TYR CA . 25025 1 714 . 1 1 185 185 TYR CB C 13 36.70 . . . . . . . . 185 TYR CB . 25025 1 715 . 1 1 185 185 TYR N N 15 123.42 . . . . . . . . 185 TYR N . 25025 1 716 . 1 1 187 187 ALA H H 1 8.61 . . . . . . . . 187 ALA H . 25025 1 717 . 1 1 187 187 ALA C C 13 175.13 . . . . . . . . 187 ALA C . 25025 1 718 . 1 1 187 187 ALA CA C 13 50.70 . . . . . . . . 187 ALA CA . 25025 1 719 . 1 1 187 187 ALA CB C 13 19.60 . . . . . . . . 187 ALA CB . 25025 1 720 . 1 1 187 187 ALA N N 15 122.72 . . . . . . . . 187 ALA N . 25025 1 721 . 1 1 188 188 GLU H H 1 7.42 . . . . . . . . 188 GLU H . 25025 1 722 . 1 1 188 188 GLU C C 13 174.23 . . . . . . . . 188 GLU C . 25025 1 723 . 1 1 188 188 GLU CA C 13 54.40 . . . . . . . . 188 GLU CA . 25025 1 724 . 1 1 188 188 GLU CB C 13 31.90 . . . . . . . . 188 GLU CB . 25025 1 725 . 1 1 188 188 GLU N N 15 113.24 . . . . . . . . 188 GLU N . 25025 1 726 . 1 1 190 190 GLY H H 1 7.83 . . . . . . . . 190 GLY H . 25025 1 727 . 1 1 190 190 GLY C C 13 172.09 . . . . . . . . 190 GLY C . 25025 1 728 . 1 1 190 190 GLY CA C 13 44.50 . . . . . . . . 190 GLY CA . 25025 1 729 . 1 1 190 190 GLY N N 15 105.42 . . . . . . . . 190 GLY N . 25025 1 730 . 1 1 191 191 TYR H H 1 8.73 . . . . . . . . 191 TYR H . 25025 1 731 . 1 1 191 191 TYR C C 13 173.35 . . . . . . . . 191 TYR C . 25025 1 732 . 1 1 191 191 TYR CA C 13 55.30 . . . . . . . . 191 TYR CA . 25025 1 733 . 1 1 191 191 TYR CB C 13 39.30 . . . . . . . . 191 TYR CB . 25025 1 734 . 1 1 191 191 TYR N N 15 120.60 . . . . . . . . 191 TYR N . 25025 1 735 . 1 1 193 193 SER H H 1 8.99 . . . . . . . . 193 SER H . 25025 1 736 . 1 1 193 193 SER C C 13 174.43 . . . . . . . . 193 SER C . 25025 1 737 . 1 1 193 193 SER CA C 13 58.80 . . . . . . . . 193 SER CA . 25025 1 738 . 1 1 193 193 SER CB C 13 64.50 . . . . . . . . 193 SER CB . 25025 1 739 . 1 1 193 193 SER N N 15 119.03 . . . . . . . . 193 SER N . 25025 1 740 . 1 1 194 194 HIS H H 1 9.45 . . . . . . . . 194 HIS H . 25025 1 741 . 1 1 194 194 HIS C C 13 175.06 . . . . . . . . 194 HIS C . 25025 1 742 . 1 1 194 194 HIS CA C 13 55.70 . . . . . . . . 194 HIS CA . 25025 1 743 . 1 1 194 194 HIS CB C 13 33.80 . . . . . . . . 194 HIS CB . 25025 1 744 . 1 1 194 194 HIS N N 15 124.23 . . . . . . . . 194 HIS N . 25025 1 745 . 1 1 195 195 ARG C C 13 175.41 . . . . . . . . 195 ARG C . 25025 1 746 . 1 1 195 195 ARG CA C 13 52.70 . . . . . . . . 195 ARG CA . 25025 1 747 . 1 1 195 195 ARG CB C 13 34.60 . . . . . . . . 195 ARG CB . 25025 1 748 . 1 1 196 196 LEU H H 1 9.19 . . . . . . . . 196 LEU H . 25025 1 749 . 1 1 196 196 LEU C C 13 173.76 . . . . . . . . 196 LEU C . 25025 1 750 . 1 1 196 196 LEU CA C 13 53.30 . . . . . . . . 196 LEU CA . 25025 1 751 . 1 1 196 196 LEU CB C 13 42.30 . . . . . . . . 196 LEU CB . 25025 1 752 . 1 1 196 196 LEU N N 15 123.24 . . . . . . . . 196 LEU N . 25025 1 753 . 1 1 198 198 LEU H H 1 8.74 . . . . . . . . 198 LEU H . 25025 1 754 . 1 1 198 198 LEU C C 13 178.87 . . . . . . . . 198 LEU C . 25025 1 755 . 1 1 198 198 LEU CA C 13 59.90 . . . . . . . . 198 LEU CA . 25025 1 756 . 1 1 198 198 LEU CB C 13 42.50 . . . . . . . . 198 LEU CB . 25025 1 757 . 1 1 198 198 LEU N N 15 124.01 . . . . . . . . 198 LEU N . 25025 1 758 . 1 1 199 199 GLU H H 1 9.22 . . . . . . . . 199 GLU H . 25025 1 759 . 1 1 199 199 GLU C C 13 177.16 . . . . . . . . 199 GLU C . 25025 1 760 . 1 1 199 199 GLU CA C 13 59.10 . . . . . . . . 199 GLU CA . 25025 1 761 . 1 1 199 199 GLU CB C 13 29.10 . . . . . . . . 199 GLU CB . 25025 1 762 . 1 1 199 199 GLU N N 15 113.83 . . . . . . . . 199 GLU N . 25025 1 763 . 1 1 200 200 ARG H H 1 7.98 . . . . . . . . 200 ARG H . 25025 1 764 . 1 1 200 200 ARG C C 13 176.46 . . . . . . . . 200 ARG C . 25025 1 765 . 1 1 200 200 ARG CA C 13 56.10 . . . . . . . . 200 ARG CA . 25025 1 766 . 1 1 200 200 ARG CB C 13 30.10 . . . . . . . . 200 ARG CB . 25025 1 767 . 1 1 200 200 ARG N N 15 118.23 . . . . . . . . 200 ARG N . 25025 1 768 . 1 1 201 201 VAL H H 1 7.35 . . . . . . . . 201 VAL H . 25025 1 769 . 1 1 201 201 VAL C C 13 173.97 . . . . . . . . 201 VAL C . 25025 1 770 . 1 1 201 201 VAL CA C 13 62.50 . . . . . . . . 201 VAL CA . 25025 1 771 . 1 1 201 201 VAL CB C 13 34.70 . . . . . . . . 201 VAL CB . 25025 1 772 . 1 1 201 201 VAL N N 15 112.11 . . . . . . . . 201 VAL N . 25025 1 773 . 1 1 202 202 VAL H H 1 8.17 . . . . . . . . 202 VAL H . 25025 1 774 . 1 1 202 202 VAL C C 13 174.34 . . . . . . . . 202 VAL C . 25025 1 775 . 1 1 202 202 VAL CA C 13 61.40 . . . . . . . . 202 VAL CA . 25025 1 776 . 1 1 202 202 VAL CB C 13 33.70 . . . . . . . . 202 VAL CB . 25025 1 777 . 1 1 202 202 VAL N N 15 120.59 . . . . . . . . 202 VAL N . 25025 1 778 . 1 1 203 203 LEU H H 1 8.83 . . . . . . . . 203 LEU H . 25025 1 779 . 1 1 203 203 LEU C C 13 175.13 . . . . . . . . 203 LEU C . 25025 1 780 . 1 1 203 203 LEU CA C 13 53.40 . . . . . . . . 203 LEU CA . 25025 1 781 . 1 1 203 203 LEU CB C 13 45.40 . . . . . . . . 203 LEU CB . 25025 1 782 . 1 1 203 203 LEU N N 15 128.51 . . . . . . . . 203 LEU N . 25025 1 783 . 1 1 204 204 TRP H H 1 8.94 . . . . . . . . 204 TRP H . 25025 1 784 . 1 1 204 204 TRP HE1 H 1 10.04 . . . . . . . . 204 TRP HE1 . 25025 1 785 . 1 1 204 204 TRP C C 13 175.55 . . . . . . . . 204 TRP C . 25025 1 786 . 1 1 204 204 TRP CA C 13 57.60 . . . . . . . . 204 TRP CA . 25025 1 787 . 1 1 204 204 TRP CB C 13 29.40 . . . . . . . . 204 TRP CB . 25025 1 788 . 1 1 204 204 TRP N N 15 125.07 . . . . . . . . 204 TRP N . 25025 1 789 . 1 1 204 204 TRP NE1 N 15 130.22 . . . . . . . . 204 TRP NE1 . 25025 1 790 . 1 1 205 205 ARG H H 1 9.23 . . . . . . . . 205 ARG H . 25025 1 791 . 1 1 205 205 ARG C C 13 180.34 . . . . . . . . 205 ARG C . 25025 1 792 . 1 1 205 205 ARG CA C 13 56.80 . . . . . . . . 205 ARG CA . 25025 1 793 . 1 1 205 205 ARG CB C 13 32.80 . . . . . . . . 205 ARG CB . 25025 1 794 . 1 1 205 205 ARG N N 15 133.30 . . . . . . . . 205 ARG N . 25025 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 25025 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 500 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 8 {1H}NOE . . . 25025 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 9 9 ASP N N 15 . 1 1 9 9 ASP H H 1 0.68196 0.0786 . . . . . . . 9 ASP . 25025 1 2 . 1 1 11 11 LYS N N 15 . 1 1 11 11 LYS H H 1 0.909238 0.17528 . . . . . . . 11 LYS . 25025 1 3 . 1 1 12 12 THR N N 15 . 1 1 12 12 THR H H 1 0.716323 0.10073 . . . . . . . 12 THR . 25025 1 4 . 1 1 13 13 ALA N N 15 . 1 1 13 13 ALA H H 1 1.001866 0.16991 . . . . . . . 13 ALA . 25025 1 5 . 1 1 14 14 ALA N N 15 . 1 1 14 14 ALA H H 1 1.01846 0.20261 . . . . . . . 14 ALA . 25025 1 6 . 1 1 15 15 LEU N N 15 . 1 1 15 15 LEU H H 1 0.71484 0.1235 . . . . . . . 15 LEU . 25025 1 7 . 1 1 16 16 LYS N N 15 . 1 1 16 16 LYS H H 1 0.683507 0.09922 . . . . . . . 16 LYS . 25025 1 8 . 1 1 17 17 ARG N N 15 . 1 1 17 17 ARG H H 1 0.703809 0.17227 . . . . . . . 17 ARG . 25025 1 9 . 1 1 19 19 SER N N 15 . 1 1 19 19 SER H H 1 0.750933 0.19487 . . . . . . . 19 SER . 25025 1 10 . 1 1 20 20 ILE N N 15 . 1 1 20 20 ILE H H 1 0.839754 0.25153 . . . . . . . 20 ILE . 25025 1 11 . 1 1 21 21 ARG N N 15 . 1 1 21 21 ARG H H 1 0.575275 0.05031 . . . . . . . 21 ARG . 25025 1 12 . 1 1 22 22 ARG N N 15 . 1 1 22 22 ARG H H 1 0.612193 0.10604 . . . . . . . 22 ARG . 25025 1 13 . 1 1 23 23 TYR N N 15 . 1 1 23 23 TYR H H 1 0.739745 0.11664 . . . . . . . 23 TYR . 25025 1 14 . 1 1 24 24 ARG N N 15 . 1 1 24 24 ARG H H 1 0.730379 0.12731 . . . . . . . 24 ARG . 25025 1 15 . 1 1 26 26 ASP N N 15 . 1 1 26 26 ASP H H 1 0.716427 0.14322 . . . . . . . 26 ASP . 25025 1 16 . 1 1 28 28 VAL N N 15 . 1 1 28 28 VAL H H 1 0.655603 0.11609 . . . . . . . 28 VAL . 25025 1 17 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.836218 0.1358 . . . . . . . 32 LEU . 25025 1 18 . 1 1 34 34 ARG N N 15 . 1 1 34 34 ARG H H 1 1.047873 0.13772 . . . . . . . 34 ARG . 25025 1 19 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.815391 0.09026 . . . . . . . 40 ALA . 25025 1 20 . 1 1 42 42 ARG N N 15 . 1 1 42 42 ARG H H 1 0.699975 0.1021 . . . . . . . 42 ARG . 25025 1 21 . 1 1 43 43 ALA N N 15 . 1 1 43 43 ALA H H 1 0.798467 0.12067 . . . . . . . 43 ALA . 25025 1 22 . 1 1 45 45 SER N N 15 . 1 1 45 45 SER H H 1 0.80758 0.15237 . . . . . . . 45 SER . 25025 1 23 . 1 1 48 48 ASN N N 15 . 1 1 48 48 ASN H H 1 0.832019 0.15524 . . . . . . . 48 ASN . 25025 1 24 . 1 1 50 50 GLN N N 15 . 1 1 50 50 GLN H H 1 0.846808 0.15762 . . . . . . . 50 GLN . 25025 1 25 . 1 1 52 52 TRP N N 15 . 1 1 52 52 TRP H H 1 0.811539 0.09191 . . . . . . . 52 TRP . 25025 1 26 . 1 1 54 54 ILE N N 15 . 1 1 54 54 ILE H H 1 0.857247 0.06616 . . . . . . . 54 ILE . 25025 1 27 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.797629 0.13938 . . . . . . . 55 VAL . 25025 1 28 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.746686 0.14553 . . . . . . . 56 VAL . 25025 1 29 . 1 1 57 57 VAL N N 15 . 1 1 57 57 VAL H H 1 0.672511 0.12609 . . . . . . . 57 VAL . 25025 1 30 . 1 1 58 58 ARG N N 15 . 1 1 58 58 ARG H H 1 0.67059 0.08529 . . . . . . . 58 ARG . 25025 1 31 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.784138 0.06279 . . . . . . . 62 THR . 25025 1 32 . 1 1 63 63 LYS N N 15 . 1 1 63 63 LYS H H 1 1.048383 0.11341 . . . . . . . 63 LYS . 25025 1 33 . 1 1 64 64 ARG N N 15 . 1 1 64 64 ARG H H 1 0.808622 0.06029 . . . . . . . 64 ARG . 25025 1 34 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.818907 0.10812 . . . . . . . 65 ALA . 25025 1 35 . 1 1 66 66 LEU N N 15 . 1 1 66 66 LEU H H 1 0.852352 0.06414 . . . . . . . 66 LEU . 25025 1 36 . 1 1 67 67 ARG N N 15 . 1 1 67 67 ARG H H 1 0.757301 0.18864 . . . . . . . 67 ARG . 25025 1 37 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.760156 0.09408 . . . . . . . 70 ALA . 25025 1 38 . 1 1 71 71 PHE N N 15 . 1 1 71 71 PHE H H 1 0.727946 0.09988 . . . . . . . 71 PHE . 25025 1 39 . 1 1 72 72 GLY N N 15 . 1 1 72 72 GLY H H 1 0.825261 0.15231 . . . . . . . 72 GLY . 25025 1 40 . 1 1 73 73 GLN N N 15 . 1 1 73 73 GLN H H 1 0.929337 0.14273 . . . . . . . 73 GLN . 25025 1 41 . 1 1 74 74 ALA N N 15 . 1 1 74 74 ALA H H 1 0.890372 0.18149 . . . . . . . 74 ALA . 25025 1 42 . 1 1 75 75 HIS N N 15 . 1 1 75 75 HIS H H 1 0.732053 0.06164 . . . . . . . 75 HIS . 25025 1 43 . 1 1 76 76 VAL N N 15 . 1 1 76 76 VAL H H 1 0.795584 0.15301 . . . . . . . 76 VAL . 25025 1 44 . 1 1 78 78 GLU N N 15 . 1 1 78 78 GLU H H 1 0.806643 0.1311 . . . . . . . 78 GLU . 25025 1 45 . 1 1 79 79 ALA N N 15 . 1 1 79 79 ALA H H 1 0.836175 0.07545 . . . . . . . 79 ALA . 25025 1 46 . 1 1 81 81 VAL N N 15 . 1 1 81 81 VAL H H 1 0.778831 0.09692 . . . . . . . 81 VAL . 25025 1 47 . 1 1 82 82 VAL N N 15 . 1 1 82 82 VAL H H 1 0.780244 0.09763 . . . . . . . 82 VAL . 25025 1 48 . 1 1 85 85 LEU N N 15 . 1 1 85 85 LEU H H 1 0.896826 0.14737 . . . . . . . 85 LEU . 25025 1 49 . 1 1 86 86 TYR N N 15 . 1 1 86 86 TYR H H 1 0.837845 0.11948 . . . . . . . 86 TYR . 25025 1 50 . 1 1 87 87 ALA N N 15 . 1 1 87 87 ALA H H 1 0.711955 0.12923 . . . . . . . 87 ALA . 25025 1 51 . 1 1 89 89 LEU N N 15 . 1 1 89 89 LEU H H 1 0.732727 0.13237 . . . . . . . 89 LEU . 25025 1 52 . 1 1 90 90 GLU N N 15 . 1 1 90 90 GLU H H 1 0.681457 0.09989 . . . . . . . 90 GLU . 25025 1 53 . 1 1 91 91 ASP N N 15 . 1 1 91 91 ASP H H 1 0.641608 0.0966 . . . . . . . 91 ASP . 25025 1 54 . 1 1 93 93 LEU N N 15 . 1 1 93 93 LEU H H 1 0.769815 0.14343 . . . . . . . 93 LEU . 25025 1 55 . 1 1 95 95 HIS N N 15 . 1 1 95 95 HIS H H 1 0.831267 0.08871 . . . . . . . 95 HIS . 25025 1 56 . 1 1 96 96 LEU N N 15 . 1 1 96 96 LEU H H 1 0.608698 0.07454 . . . . . . . 96 LEU . 25025 1 57 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.685918 0.09919 . . . . . . . 98 GLU . 25025 1 58 . 1 1 99 99 VAL N N 15 . 1 1 99 99 VAL H H 1 0.812278 0.13807 . . . . . . . 99 VAL . 25025 1 59 . 1 1 100 100 ILE N N 15 . 1 1 100 100 ILE H H 1 0.880414 0.16602 . . . . . . . 100 ILE . 25025 1 60 . 1 1 105 105 GLN N N 15 . 1 1 105 105 GLN H H 1 0.61786 0.14553 . . . . . . . 105 GLN . 25025 1 61 . 1 1 109 109 ARG N N 15 . 1 1 109 109 ARG H H 1 0.72641 0.14584 . . . . . . . 109 ARG . 25025 1 62 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.715685 0.09092 . . . . . . . 110 GLU . 25025 1 63 . 1 1 113 113 LYS N N 15 . 1 1 113 113 LYS H H 1 0.711322 0.0803 . . . . . . . 113 LYS . 25025 1 64 . 1 1 115 115 ALA N N 15 . 1 1 115 115 ALA H H 1 0.796561 0.1196 . . . . . . . 115 ALA . 25025 1 65 . 1 1 117 117 GLN N N 15 . 1 1 117 117 GLN H H 1 0.76968 0.09632 . . . . . . . 117 GLN . 25025 1 66 . 1 1 118 118 ARG N N 15 . 1 1 118 118 ARG H H 1 0.74623 0.0754 . . . . . . . 118 ARG . 25025 1 67 . 1 1 120 120 PHE N N 15 . 1 1 120 120 PHE H H 1 0.683175 0.09575 . . . . . . . 120 PHE . 25025 1 68 . 1 1 121 121 ALA N N 15 . 1 1 121 121 ALA H H 1 0.753824 0.12648 . . . . . . . 121 ALA . 25025 1 69 . 1 1 128 128 ARG N N 15 . 1 1 128 128 ARG H H 1 0.723991 0.10936 . . . . . . . 128 ARG . 25025 1 70 . 1 1 129 129 LYS N N 15 . 1 1 129 129 LYS H H 1 0.707949 0.11964 . . . . . . . 129 LYS . 25025 1 71 . 1 1 130 130 ALA N N 15 . 1 1 130 130 ALA H H 1 0.813879 0.11059 . . . . . . . 130 ALA . 25025 1 72 . 1 1 131 131 TRP N N 15 . 1 1 131 131 TRP H H 1 0.753753 0.10285 . . . . . . . 131 TRP . 25025 1 73 . 1 1 132 132 ALA N N 15 . 1 1 132 132 ALA H H 1 0.802604 0.14497 . . . . . . . 132 ALA . 25025 1 74 . 1 1 133 133 SER N N 15 . 1 1 133 133 SER H H 1 0.838802 0.08303 . . . . . . . 133 SER . 25025 1 75 . 1 1 134 134 GLY N N 15 . 1 1 134 134 GLY H H 1 0.77371 0.11825 . . . . . . . 134 GLY . 25025 1 76 . 1 1 135 135 GLN N N 15 . 1 1 135 135 GLN H H 1 0.849646 0.12855 . . . . . . . 135 GLN . 25025 1 77 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.744277 0.06651 . . . . . . . 136 SER . 25025 1 78 . 1 1 139 139 LEU N N 15 . 1 1 139 139 LEU H H 1 0.87979 0.142 . . . . . . . 139 LEU . 25025 1 79 . 1 1 141 141 GLY N N 15 . 1 1 141 141 GLY H H 1 0.847021 0.12892 . . . . . . . 141 GLY . 25025 1 80 . 1 1 143 143 LEU N N 15 . 1 1 143 143 LEU H H 1 0.802059 0.10781 . . . . . . . 143 LEU . 25025 1 81 . 1 1 144 144 LEU N N 15 . 1 1 144 144 LEU H H 1 0.746487 0.11754 . . . . . . . 144 LEU . 25025 1 82 . 1 1 145 145 LEU N N 15 . 1 1 145 145 LEU H H 1 0.803323 0.14544 . . . . . . . 145 LEU . 25025 1 83 . 1 1 146 146 LEU N N 15 . 1 1 146 146 LEU H H 1 0.756604 0.12401 . . . . . . . 146 LEU . 25025 1 84 . 1 1 147 147 LEU N N 15 . 1 1 147 147 LEU H H 1 0.528603 0.06364 . . . . . . . 147 LEU . 25025 1 85 . 1 1 148 148 GLU N N 15 . 1 1 148 148 GLU H H 1 0.809583 0.12042 . . . . . . . 148 GLU . 25025 1 86 . 1 1 149 149 ALA N N 15 . 1 1 149 149 ALA H H 1 0.815669 0.11767 . . . . . . . 149 ALA . 25025 1 87 . 1 1 151 151 GLY N N 15 . 1 1 151 151 GLY H H 1 0.778736 0.11689 . . . . . . . 151 GLY . 25025 1 88 . 1 1 152 152 LEU N N 15 . 1 1 152 152 LEU H H 1 0.672538 0.04841 . . . . . . . 152 LEU . 25025 1 89 . 1 1 153 153 GLY N N 15 . 1 1 153 153 GLY H H 1 0.816327 0.13999 . . . . . . . 153 GLY . 25025 1 90 . 1 1 154 154 SER N N 15 . 1 1 154 154 SER H H 1 0.738336 0.13798 . . . . . . . 154 SER . 25025 1 91 . 1 1 155 155 VAL N N 15 . 1 1 155 155 VAL H H 1 0.748065 0.14275 . . . . . . . 155 VAL . 25025 1 92 . 1 1 166 166 ARG N N 15 . 1 1 166 166 ARG H H 1 0.785816 0.10957 . . . . . . . 166 ARG . 25025 1 93 . 1 1 168 168 ILE N N 15 . 1 1 168 168 ILE H H 1 0.675887 0.09408 . . . . . . . 168 ILE . 25025 1 94 . 1 1 169 169 LEU N N 15 . 1 1 169 169 LEU H H 1 0.874288 0.13102 . . . . . . . 169 LEU . 25025 1 95 . 1 1 170 170 GLY N N 15 . 1 1 170 170 GLY H H 1 0.757763 0.1028 . . . . . . . 170 GLY . 25025 1 96 . 1 1 175 175 ALA N N 15 . 1 1 175 175 ALA H H 1 0.719453 0.09792 . . . . . . . 175 ALA . 25025 1 97 . 1 1 180 180 LEU N N 15 . 1 1 180 180 LEU H H 1 0.70328 0.04646 . . . . . . . 180 LEU . 25025 1 98 . 1 1 181 181 VAL N N 15 . 1 1 181 181 VAL H H 1 0.762579 0.1199 . . . . . . . 181 VAL . 25025 1 99 . 1 1 182 182 ALA N N 15 . 1 1 182 182 ALA H H 1 0.79518 0.13141 . . . . . . . 182 ALA . 25025 1 100 . 1 1 183 183 LEU N N 15 . 1 1 183 183 LEU H H 1 0.73282 0.09642 . . . . . . . 183 LEU . 25025 1 101 . 1 1 184 184 GLY N N 15 . 1 1 184 184 GLY H H 1 0.783694 0.13535 . . . . . . . 184 GLY . 25025 1 102 . 1 1 185 185 TYR N N 15 . 1 1 185 185 TYR H H 1 0.89495 0.14508 . . . . . . . 185 TYR . 25025 1 103 . 1 1 187 187 ALA N N 15 . 1 1 187 187 ALA H H 1 0.850402 0.17876 . . . . . . . 187 ALA . 25025 1 104 . 1 1 188 188 GLU N N 15 . 1 1 188 188 GLU H H 1 0.727047 0.09013 . . . . . . . 188 GLU . 25025 1 105 . 1 1 190 190 GLY N N 15 . 1 1 190 190 GLY H H 1 0.733552 0.11211 . . . . . . . 190 GLY . 25025 1 106 . 1 1 191 191 TYR N N 15 . 1 1 191 191 TYR H H 1 0.687804 0.08449 . . . . . . . 191 TYR . 25025 1 107 . 1 1 193 193 SER N N 15 . 1 1 193 193 SER H H 1 0.530087 0.08906 . . . . . . . 193 SER . 25025 1 108 . 1 1 196 196 LEU N N 15 . 1 1 196 196 LEU H H 1 0.856239 0.18618 . . . . . . . 196 LEU . 25025 1 109 . 1 1 199 199 GLU N N 15 . 1 1 199 199 GLU H H 1 0.775084 0.10071 . . . . . . . 199 GLU . 25025 1 110 . 1 1 200 200 ARG N N 15 . 1 1 200 200 ARG H H 1 0.683358 0.06873 . . . . . . . 200 ARG . 25025 1 111 . 1 1 201 201 VAL N N 15 . 1 1 201 201 VAL H H 1 0.802412 0.13403 . . . . . . . 201 VAL . 25025 1 112 . 1 1 202 202 VAL N N 15 . 1 1 202 202 VAL H H 1 0.732701 0.09442 . . . . . . . 202 VAL . 25025 1 113 . 1 1 203 203 LEU N N 15 . 1 1 203 203 LEU H H 1 0.834641 0.14348 . . . . . . . 203 LEU . 25025 1 114 . 1 1 204 204 TRP N N 15 . 1 1 204 204 TRP H H 1 0.776831 0.11963 . . . . . . . 204 TRP . 25025 1 115 . 1 1 205 205 ARG N N 15 . 1 1 205 205 ARG H H 1 0.644821 0.11801 . . . . . . . 205 ARG . 25025 1 stop_ save_ save_heteronuclear_noe_list_2 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_2 _Heteronucl_NOE_list.Entry_ID 25025 _Heteronucl_NOE_list.ID 2 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 800 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 8 {1H}NOE . . . 25025 2 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 9 9 ASP N N 15 . 1 1 9 9 ASP H H 1 0.835513 0.03979 . . . . . . . 9 ASP . 25025 2 2 . 1 1 11 11 LYS N N 15 . 1 1 11 11 LYS H H 1 0.894946 0.05899 . . . . . . . 11 LYS . 25025 2 3 . 1 1 12 12 THR N N 15 . 1 1 12 12 THR H H 1 0.886556 0.05327 . . . . . . . 12 THR . 25025 2 4 . 1 1 13 13 ALA N N 15 . 1 1 13 13 ALA H H 1 0.876751 0.04543 . . . . . . . 13 ALA . 25025 2 5 . 1 1 14 14 ALA N N 15 . 1 1 14 14 ALA H H 1 0.834763 0.03917 . . . . . . . 14 ALA . 25025 2 6 . 1 1 15 15 LEU N N 15 . 1 1 15 15 LEU H H 1 0.825678 0.04634 . . . . . . . 15 LEU . 25025 2 7 . 1 1 16 16 LYS N N 15 . 1 1 16 16 LYS H H 1 0.811645 0.05264 . . . . . . . 16 LYS . 25025 2 8 . 1 1 17 17 ARG N N 15 . 1 1 17 17 ARG H H 1 0.825671 0.01743 . . . . . . . 17 ARG . 25025 2 9 . 1 1 19 19 SER N N 15 . 1 1 19 19 SER H H 1 0.778228 0.08371 . . . . . . . 19 SER . 25025 2 10 . 1 1 20 20 ILE N N 15 . 1 1 20 20 ILE H H 1 0.934062 0.08096 . . . . . . . 20 ILE . 25025 2 11 . 1 1 21 21 ARG N N 15 . 1 1 21 21 ARG H H 1 0.816965 0.07027 . . . . . . . 21 ARG . 25025 2 12 . 1 1 22 22 ARG N N 15 . 1 1 22 22 ARG H H 1 0.786924 0.04726 . . . . . . . 22 ARG . 25025 2 13 . 1 1 23 23 TYR N N 15 . 1 1 23 23 TYR H H 1 0.774774 0.04057 . . . . . . . 23 TYR . 25025 2 14 . 1 1 24 24 ARG N N 15 . 1 1 24 24 ARG H H 1 0.871285 0.05957 . . . . . . . 24 ARG . 25025 2 15 . 1 1 26 26 ASP N N 15 . 1 1 26 26 ASP H H 1 0.882974 0.05994 . . . . . . . 26 ASP . 25025 2 16 . 1 1 28 28 VAL N N 15 . 1 1 28 28 VAL H H 1 0.710722 0.03145 . . . . . . . 28 VAL . 25025 2 17 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.833581 0.04594 . . . . . . . 32 LEU . 25025 2 18 . 1 1 34 34 ARG N N 15 . 1 1 34 34 ARG H H 1 0.837569 0.0484 . . . . . . . 34 ARG . 25025 2 19 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.824994 0.0373 . . . . . . . 40 ALA . 25025 2 20 . 1 1 42 42 ARG N N 15 . 1 1 42 42 ARG H H 1 0.782817 0.04029 . . . . . . . 42 ARG . 25025 2 21 . 1 1 43 43 ALA N N 15 . 1 1 43 43 ALA H H 1 0.845577 0.04547 . . . . . . . 43 ALA . 25025 2 22 . 1 1 45 45 SER N N 15 . 1 1 45 45 SER H H 1 0.893379 0.06016 . . . . . . . 45 SER . 25025 2 23 . 1 1 48 48 ASN N N 15 . 1 1 48 48 ASN H H 1 0.888362 0.05235 . . . . . . . 48 ASN . 25025 2 24 . 1 1 50 50 GLN N N 15 . 1 1 50 50 GLN H H 1 0.833647 0.05177 . . . . . . . 50 GLN . 25025 2 25 . 1 1 52 52 TRP N N 15 . 1 1 52 52 TRP H H 1 0.864168 0.03463 . . . . . . . 52 TRP . 25025 2 26 . 1 1 54 54 ILE N N 15 . 1 1 54 54 ILE H H 1 0.873515 0.04429 . . . . . . . 54 ILE . 25025 2 27 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.808848 0.05162 . . . . . . . 55 VAL . 25025 2 28 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.980947 0.06764 . . . . . . . 56 VAL . 25025 2 29 . 1 1 57 57 VAL N N 15 . 1 1 57 57 VAL H H 1 0.804773 0.04494 . . . . . . . 57 VAL . 25025 2 30 . 1 1 58 58 ARG N N 15 . 1 1 58 58 ARG H H 1 0.966914 0.08126 . . . . . . . 58 ARG . 25025 2 31 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.850682 0.02301 . . . . . . . 62 THR . 25025 2 32 . 1 1 63 63 LYS N N 15 . 1 1 63 63 LYS H H 1 0.720787 0.02933 . . . . . . . 63 LYS . 25025 2 33 . 1 1 64 64 ARG N N 15 . 1 1 64 64 ARG H H 1 0.863154 0.03536 . . . . . . . 64 ARG . 25025 2 34 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.837743 0.04054 . . . . . . . 65 ALA . 25025 2 35 . 1 1 66 66 LEU N N 15 . 1 1 66 66 LEU H H 1 0.855847 0.04136 . . . . . . . 66 LEU . 25025 2 36 . 1 1 67 67 ARG N N 15 . 1 1 67 67 ARG H H 1 0.839616 0.05355 . . . . . . . 67 ARG . 25025 2 37 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.794308 0.03521 . . . . . . . 70 ALA . 25025 2 38 . 1 1 71 71 PHE N N 15 . 1 1 71 71 PHE H H 1 0.818604 0.03995 . . . . . . . 71 PHE . 25025 2 39 . 1 1 72 72 GLY N N 15 . 1 1 72 72 GLY H H 1 0.883468 0.0602 . . . . . . . 72 GLY . 25025 2 40 . 1 1 73 73 GLN N N 15 . 1 1 73 73 GLN H H 1 0.92259 0.05111 . . . . . . . 73 GLN . 25025 2 41 . 1 1 74 74 ALA N N 15 . 1 1 74 74 ALA H H 1 0.773482 0.06171 . . . . . . . 74 ALA . 25025 2 42 . 1 1 75 75 HIS N N 15 . 1 1 75 75 HIS H H 1 0.764659 0.04194 . . . . . . . 75 HIS . 25025 2 43 . 1 1 76 76 VAL N N 15 . 1 1 76 76 VAL H H 1 0.926934 0.06358 . . . . . . . 76 VAL . 25025 2 44 . 1 1 78 78 GLU N N 15 . 1 1 78 78 GLU H H 1 0.793493 0.03694 . . . . . . . 78 GLU . 25025 2 45 . 1 1 79 79 ALA N N 15 . 1 1 79 79 ALA H H 1 0.834486 0.02328 . . . . . . . 79 ALA . 25025 2 46 . 1 1 81 81 VAL N N 15 . 1 1 81 81 VAL H H 1 0.844732 0.03714 . . . . . . . 81 VAL . 25025 2 47 . 1 1 82 82 VAL N N 15 . 1 1 82 82 VAL H H 1 0.843103 0.05234 . . . . . . . 82 VAL . 25025 2 48 . 1 1 85 85 LEU N N 15 . 1 1 85 85 LEU H H 1 0.83026 0.04874 . . . . . . . 85 LEU . 25025 2 49 . 1 1 86 86 TYR N N 15 . 1 1 86 86 TYR H H 1 0.822963 0.04246 . . . . . . . 86 TYR . 25025 2 50 . 1 1 87 87 ALA N N 15 . 1 1 87 87 ALA H H 1 0.817902 0.04992 . . . . . . . 87 ALA . 25025 2 51 . 1 1 89 89 LEU N N 15 . 1 1 89 89 LEU H H 1 0.745822 0.05089 . . . . . . . 89 LEU . 25025 2 52 . 1 1 90 90 GLU N N 15 . 1 1 90 90 GLU H H 1 0.760005 0.03423 . . . . . . . 90 GLU . 25025 2 53 . 1 1 91 91 ASP N N 15 . 1 1 91 91 ASP H H 1 0.88363 0.03842 . . . . . . . 91 ASP . 25025 2 54 . 1 1 93 93 LEU N N 15 . 1 1 93 93 LEU H H 1 0.876477 0.05433 . . . . . . . 93 LEU . 25025 2 55 . 1 1 95 95 HIS N N 15 . 1 1 95 95 HIS H H 1 0.757819 0.03764 . . . . . . . 95 HIS . 25025 2 56 . 1 1 96 96 LEU N N 15 . 1 1 96 96 LEU H H 1 0.725902 0.04725 . . . . . . . 96 LEU . 25025 2 57 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.783823 0.03595 . . . . . . . 98 GLU . 25025 2 58 . 1 1 99 99 VAL N N 15 . 1 1 99 99 VAL H H 1 0.844209 0.05058 . . . . . . . 99 VAL . 25025 2 59 . 1 1 100 100 ILE N N 15 . 1 1 100 100 ILE H H 1 0.702421 0.04825 . . . . . . . 100 ILE . 25025 2 60 . 1 1 105 105 GLN N N 15 . 1 1 105 105 GLN H H 1 0.698106 0.05377 . . . . . . . 105 GLN . 25025 2 61 . 1 1 109 109 ARG N N 15 . 1 1 109 109 ARG H H 1 0.758685 0.04719 . . . . . . . 109 ARG . 25025 2 62 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.762585 0.03511 . . . . . . . 110 GLU . 25025 2 63 . 1 1 113 113 LYS N N 15 . 1 1 113 113 LYS H H 1 0.885986 0.04276 . . . . . . . 113 LYS . 25025 2 64 . 1 1 115 115 ALA N N 15 . 1 1 115 115 ALA H H 1 0.785558 0.03995 . . . . . . . 115 ALA . 25025 2 65 . 1 1 117 117 GLN N N 15 . 1 1 117 117 GLN H H 1 0.856712 0.04185 . . . . . . . 117 GLN . 25025 2 66 . 1 1 118 118 ARG N N 15 . 1 1 118 118 ARG H H 1 0.771738 0.03818 . . . . . . . 118 ARG . 25025 2 67 . 1 1 120 120 PHE N N 15 . 1 1 120 120 PHE H H 1 0.716384 0.0348 . . . . . . . 120 PHE . 25025 2 68 . 1 1 121 121 ALA N N 15 . 1 1 121 121 ALA H H 1 0.781179 0.03918 . . . . . . . 121 ALA . 25025 2 69 . 1 1 128 128 ARG N N 15 . 1 1 128 128 ARG H H 1 0.884509 0.05265 . . . . . . . 128 ARG . 25025 2 70 . 1 1 129 129 LYS N N 15 . 1 1 129 129 LYS H H 1 0.8097 0.04054 . . . . . . . 129 LYS . 25025 2 71 . 1 1 130 130 ALA N N 15 . 1 1 130 130 ALA H H 1 0.83983 0.0399 . . . . . . . 130 ALA . 25025 2 72 . 1 1 131 131 TRP N N 15 . 1 1 131 131 TRP H H 1 0.817806 0.04507 . . . . . . . 131 TRP . 25025 2 73 . 1 1 132 132 ALA N N 15 . 1 1 132 132 ALA H H 1 0.882192 0.0561 . . . . . . . 132 ALA . 25025 2 74 . 1 1 133 133 SER N N 15 . 1 1 133 133 SER H H 1 0.827814 0.04286 . . . . . . . 133 SER . 25025 2 75 . 1 1 134 134 GLY N N 15 . 1 1 134 134 GLY H H 1 0.850448 0.04656 . . . . . . . 134 GLY . 25025 2 76 . 1 1 135 135 GLN N N 15 . 1 1 135 135 GLN H H 1 0.962538 0.05435 . . . . . . . 135 GLN . 25025 2 77 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.831854 0.04182 . . . . . . . 136 SER . 25025 2 78 . 1 1 139 139 LEU N N 15 . 1 1 139 139 LEU H H 1 0.892853 0.04891 . . . . . . . 139 LEU . 25025 2 79 . 1 1 141 141 GLY N N 15 . 1 1 141 141 GLY H H 1 0.835933 0.04306 . . . . . . . 141 GLY . 25025 2 80 . 1 1 143 143 LEU N N 15 . 1 1 143 143 LEU H H 1 0.840863 0.04778 . . . . . . . 143 LEU . 25025 2 81 . 1 1 144 144 LEU N N 15 . 1 1 144 144 LEU H H 1 0.862348 0.05733 . . . . . . . 144 LEU . 25025 2 82 . 1 1 145 145 LEU N N 15 . 1 1 145 145 LEU H H 1 0.839847 0.05302 . . . . . . . 145 LEU . 25025 2 83 . 1 1 146 146 LEU N N 15 . 1 1 146 146 LEU H H 1 0.830626 0.05134 . . . . . . . 146 LEU . 25025 2 84 . 1 1 147 147 LEU N N 15 . 1 1 147 147 LEU H H 1 0.845154 0.0526 . . . . . . . 147 LEU . 25025 2 85 . 1 1 148 148 GLU N N 15 . 1 1 148 148 GLU H H 1 0.925511 0.04539 . . . . . . . 148 GLU . 25025 2 86 . 1 1 149 149 ALA N N 15 . 1 1 149 149 ALA H H 1 0.788928 0.04616 . . . . . . . 149 ALA . 25025 2 87 . 1 1 151 151 GLY N N 15 . 1 1 151 151 GLY H H 1 0.861918 0.04792 . . . . . . . 151 GLY . 25025 2 88 . 1 1 152 152 LEU N N 15 . 1 1 152 152 LEU H H 1 0.785396 0.03392 . . . . . . . 152 LEU . 25025 2 89 . 1 1 153 153 GLY N N 15 . 1 1 153 153 GLY H H 1 0.771728 0.04557 . . . . . . . 153 GLY . 25025 2 90 . 1 1 154 154 SER N N 15 . 1 1 154 154 SER H H 1 0.825421 0.05714 . . . . . . . 154 SER . 25025 2 91 . 1 1 155 155 VAL N N 15 . 1 1 155 155 VAL H H 1 0.837094 0.0491 . . . . . . . 155 VAL . 25025 2 92 . 1 1 166 166 ARG N N 15 . 1 1 166 166 ARG H H 1 0.798724 0.04131 . . . . . . . 166 ARG . 25025 2 93 . 1 1 168 168 ILE N N 15 . 1 1 168 168 ILE H H 1 0.908521 0.05319 . . . . . . . 168 ILE . 25025 2 94 . 1 1 169 169 LEU N N 15 . 1 1 169 169 LEU H H 1 0.855535 0.05095 . . . . . . . 169 LEU . 25025 2 95 . 1 1 170 170 GLY N N 15 . 1 1 170 170 GLY H H 1 0.838892 0.03841 . . . . . . . 170 GLY . 25025 2 96 . 1 1 175 175 ALA N N 15 . 1 1 175 175 ALA H H 1 0.807739 0.03819 . . . . . . . 175 ALA . 25025 2 97 . 1 1 180 180 LEU N N 15 . 1 1 180 180 LEU H H 1 0.783601 0.03736 . . . . . . . 180 LEU . 25025 2 98 . 1 1 181 181 VAL N N 15 . 1 1 181 181 VAL H H 1 0.750448 0.04468 . . . . . . . 181 VAL . 25025 2 99 . 1 1 182 182 ALA N N 15 . 1 1 182 182 ALA H H 1 0.887933 0.0513 . . . . . . . 182 ALA . 25025 2 100 . 1 1 183 183 LEU N N 15 . 1 1 183 183 LEU H H 1 0.859291 0.04465 . . . . . . . 183 LEU . 25025 2 101 . 1 1 184 184 GLY N N 15 . 1 1 184 184 GLY H H 1 0.855202 0.04935 . . . . . . . 184 GLY . 25025 2 102 . 1 1 185 185 TYR N N 15 . 1 1 185 185 TYR H H 1 0.874915 0.05445 . . . . . . . 185 TYR . 25025 2 103 . 1 1 187 187 ALA N N 15 . 1 1 187 187 ALA H H 1 0.87931 0.06232 . . . . . . . 187 ALA . 25025 2 104 . 1 1 188 188 GLU N N 15 . 1 1 188 188 GLU H H 1 0.7825 0.03025 . . . . . . . 188 GLU . 25025 2 105 . 1 1 190 190 GLY N N 15 . 1 1 190 190 GLY H H 1 0.737456 0.03771 . . . . . . . 190 GLY . 25025 2 106 . 1 1 191 191 TYR N N 15 . 1 1 191 191 TYR H H 1 0.691924 0.0298 . . . . . . . 191 TYR . 25025 2 107 . 1 1 193 193 SER N N 15 . 1 1 193 193 SER H H 1 0.658108 0.03636 . . . . . . . 193 SER . 25025 2 108 . 1 1 196 196 LEU N N 15 . 1 1 196 196 LEU H H 1 0.766099 0.0632 . . . . . . . 196 LEU . 25025 2 109 . 1 1 199 199 GLU N N 15 . 1 1 199 199 GLU H H 1 0.822565 0.03807 . . . . . . . 199 GLU . 25025 2 110 . 1 1 200 200 ARG N N 15 . 1 1 200 200 ARG H H 1 0.826287 0.04204 . . . . . . . 200 ARG . 25025 2 111 . 1 1 201 201 VAL N N 15 . 1 1 201 201 VAL H H 1 0.777054 0.05128 . . . . . . . 201 VAL . 25025 2 112 . 1 1 202 202 VAL N N 15 . 1 1 202 202 VAL H H 1 0.788235 0.03644 . . . . . . . 202 VAL . 25025 2 113 . 1 1 203 203 LEU N N 15 . 1 1 203 203 LEU H H 1 0.852802 0.05157 . . . . . . . 203 LEU . 25025 2 114 . 1 1 204 204 TRP N N 15 . 1 1 204 204 TRP H H 1 0.805427 0.04209 . . . . . . . 204 TRP . 25025 2 115 . 1 1 205 205 ARG N N 15 . 1 1 205 205 ARG H H 1 0.796204 0.05077 . . . . . . . 205 ARG . 25025 2 stop_ save_ save_heteronuclear_noe_list_3 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_3 _Heteronucl_NOE_list.Entry_ID 25025 _Heteronucl_NOE_list.ID 3 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 800 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 16 {1H}NOE . . . 25025 3 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 9 9 ASP N N 15 . 1 1 9 9 ASP H H 1 0.885425 0.08025 . . . . . . . 9 ASP . 25025 3 2 . 1 1 13 13 ALA N N 15 . 1 1 13 13 ALA H H 1 0.782832 0.06223 . . . . . . . 13 ALA . 25025 3 3 . 1 1 14 14 ALA N N 15 . 1 1 14 14 ALA H H 1 1.018188 0.09628 . . . . . . . 14 ALA . 25025 3 4 . 1 1 15 15 LEU N N 15 . 1 1 15 15 LEU H H 1 1.009094 0.10644 . . . . . . . 15 LEU . 25025 3 5 . 1 1 16 16 LYS N N 15 . 1 1 16 16 LYS H H 1 0.753019 0.10508 . . . . . . . 16 LYS . 25025 3 6 . 1 1 17 17 ARG N N 15 . 1 1 17 17 ARG H H 1 0.874147 0.09739 . . . . . . . 17 ARG . 25025 3 7 . 1 1 20 20 ILE N N 15 . 1 1 20 20 ILE H H 1 0.784512 0.11758 . . . . . . . 20 ILE . 25025 3 8 . 1 1 23 23 TYR N N 15 . 1 1 23 23 TYR H H 1 0.910675 0.05268 . . . . . . . 23 TYR . 25025 3 9 . 1 1 24 24 ARG N N 15 . 1 1 24 24 ARG H H 1 1.110861 0.18171 . . . . . . . 24 ARG . 25025 3 10 . 1 1 26 26 ASP N N 15 . 1 1 26 26 ASP H H 1 0.881682 0.13575 . . . . . . . 26 ASP . 25025 3 11 . 1 1 28 28 VAL N N 15 . 1 1 28 28 VAL H H 1 0.680595 0.07923 . . . . . . . 28 VAL . 25025 3 12 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.765612 0.08345 . . . . . . . 32 LEU . 25025 3 13 . 1 1 34 34 ARG N N 15 . 1 1 34 34 ARG H H 1 0.817578 0.09183 . . . . . . . 34 ARG . 25025 3 14 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.527391 0.06577 . . . . . . . 40 ALA . 25025 3 15 . 1 1 42 42 ARG N N 15 . 1 1 42 42 ARG H H 1 0.831929 0.09518 . . . . . . . 42 ARG . 25025 3 16 . 1 1 43 43 ALA N N 15 . 1 1 43 43 ALA H H 1 0.712939 0.06337 . . . . . . . 43 ALA . 25025 3 17 . 1 1 45 45 SER N N 15 . 1 1 45 45 SER H H 1 0.739783 0.08352 . . . . . . . 45 SER . 25025 3 18 . 1 1 48 48 ASN N N 15 . 1 1 48 48 ASN H H 1 0.858278 0.09507 . . . . . . . 48 ASN . 25025 3 19 . 1 1 50 50 GLN N N 15 . 1 1 50 50 GLN H H 1 1.054095 0.16361 . . . . . . . 50 GLN . 25025 3 20 . 1 1 52 52 TRP N N 15 . 1 1 52 52 TRP H H 1 0.878715 0.06742 . . . . . . . 52 TRP . 25025 3 21 . 1 1 54 54 ILE N N 15 . 1 1 54 54 ILE H H 1 0.822385 0.08442 . . . . . . . 54 ILE . 25025 3 22 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.962051 0.10568 . . . . . . . 55 VAL . 25025 3 23 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.918418 0.12206 . . . . . . . 56 VAL . 25025 3 24 . 1 1 57 57 VAL N N 15 . 1 1 57 57 VAL H H 1 0.787783 0.10771 . . . . . . . 57 VAL . 25025 3 25 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.898497 0.04717 . . . . . . . 62 THR . 25025 3 26 . 1 1 63 63 LYS N N 15 . 1 1 63 63 LYS H H 1 0.951721 0.07248 . . . . . . . 63 LYS . 25025 3 27 . 1 1 64 64 ARG N N 15 . 1 1 64 64 ARG H H 1 0.84163 0.06749 . . . . . . . 64 ARG . 25025 3 28 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.864733 0.08646 . . . . . . . 65 ALA . 25025 3 29 . 1 1 66 66 LEU N N 15 . 1 1 66 66 LEU H H 1 0.841621 0.12207 . . . . . . . 66 LEU . 25025 3 30 . 1 1 67 67 ARG N N 15 . 1 1 67 67 ARG H H 1 0.843055 0.0751 . . . . . . . 67 ARG . 25025 3 31 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.818341 0.09956 . . . . . . . 70 ALA . 25025 3 32 . 1 1 76 76 VAL N N 15 . 1 1 76 76 VAL H H 1 0.661684 0.09982 . . . . . . . 76 VAL . 25025 3 33 . 1 1 79 79 ALA N N 15 . 1 1 79 79 ALA H H 1 0.682575 0.06826 . . . . . . . 79 ALA . 25025 3 34 . 1 1 81 81 VAL N N 15 . 1 1 81 81 VAL H H 1 0.746405 0.08171 . . . . . . . 81 VAL . 25025 3 35 . 1 1 82 82 VAL N N 15 . 1 1 82 82 VAL H H 1 0.887345 0.13309 . . . . . . . 82 VAL . 25025 3 36 . 1 1 85 85 LEU N N 15 . 1 1 85 85 LEU H H 1 0.751752 0.09564 . . . . . . . 85 LEU . 25025 3 37 . 1 1 86 86 TYR N N 15 . 1 1 86 86 TYR H H 1 0.870434 0.10116 . . . . . . . 86 TYR . 25025 3 38 . 1 1 87 87 ALA N N 15 . 1 1 87 87 ALA H H 1 0.964447 0.0939 . . . . . . . 87 ALA . 25025 3 39 . 1 1 89 89 LEU N N 15 . 1 1 89 89 LEU H H 1 0.906127 0.13928 . . . . . . . 89 LEU . 25025 3 40 . 1 1 90 90 GLU N N 15 . 1 1 90 90 GLU H H 1 0.963784 0.10929 . . . . . . . 90 GLU . 25025 3 41 . 1 1 91 91 ASP N N 15 . 1 1 91 91 ASP H H 1 0.926081 0.07673 . . . . . . . 91 ASP . 25025 3 42 . 1 1 93 93 LEU N N 15 . 1 1 93 93 LEU H H 1 0.709822 0.07422 . . . . . . . 93 LEU . 25025 3 43 . 1 1 95 95 HIS N N 15 . 1 1 95 95 HIS H H 1 0.757573 0.06892 . . . . . . . 95 HIS . 25025 3 44 . 1 1 96 96 LEU N N 15 . 1 1 96 96 LEU H H 1 0.892704 0.21925 . . . . . . . 96 LEU . 25025 3 45 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.721644 0.12234 . . . . . . . 98 GLU . 25025 3 46 . 1 1 99 99 VAL N N 15 . 1 1 99 99 VAL H H 1 1.117228 0.16018 . . . . . . . 99 VAL . 25025 3 47 . 1 1 100 100 ILE N N 15 . 1 1 100 100 ILE H H 1 0.717694 0.16148 . . . . . . . 100 ILE . 25025 3 48 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.948345 0.12706 . . . . . . . 110 GLU . 25025 3 49 . 1 1 113 113 LYS N N 15 . 1 1 113 113 LYS H H 1 0.980709 0.11299 . . . . . . . 113 LYS . 25025 3 50 . 1 1 115 115 ALA N N 15 . 1 1 115 115 ALA H H 1 0.77391 0.05892 . . . . . . . 115 ALA . 25025 3 51 . 1 1 117 117 GLN N N 15 . 1 1 117 117 GLN H H 1 0.913206 0.14019 . . . . . . . 117 GLN . 25025 3 52 . 1 1 118 118 ARG N N 15 . 1 1 118 118 ARG H H 1 0.724937 0.06324 . . . . . . . 118 ARG . 25025 3 53 . 1 1 120 120 PHE N N 15 . 1 1 120 120 PHE H H 1 0.687183 0.0763 . . . . . . . 120 PHE . 25025 3 54 . 1 1 121 121 ALA N N 15 . 1 1 121 121 ALA H H 1 0.819494 0.08178 . . . . . . . 121 ALA . 25025 3 55 . 1 1 128 128 ARG N N 15 . 1 1 128 128 ARG H H 1 0.718141 0.08955 . . . . . . . 128 ARG . 25025 3 56 . 1 1 129 129 LYS N N 15 . 1 1 129 129 LYS H H 1 0.838711 0.12798 . . . . . . . 129 LYS . 25025 3 57 . 1 1 130 130 ALA N N 15 . 1 1 130 130 ALA H H 1 0.772807 0.06586 . . . . . . . 130 ALA . 25025 3 58 . 1 1 131 131 TRP N N 15 . 1 1 131 131 TRP H H 1 0.601111 0.05852 . . . . . . . 131 TRP . 25025 3 59 . 1 1 132 132 ALA N N 15 . 1 1 132 132 ALA H H 1 0.757643 0.0987 . . . . . . . 132 ALA . 25025 3 60 . 1 1 133 133 SER N N 15 . 1 1 133 133 SER H H 1 0.702029 0.08297 . . . . . . . 133 SER . 25025 3 61 . 1 1 134 134 GLY N N 15 . 1 1 134 134 GLY H H 1 0.848253 0.08539 . . . . . . . 134 GLY . 25025 3 62 . 1 1 135 135 GLN N N 15 . 1 1 135 135 GLN H H 1 0.975253 0.1184 . . . . . . . 135 GLN . 25025 3 63 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.896037 0.09293 . . . . . . . 136 SER . 25025 3 64 . 1 1 141 141 GLY N N 15 . 1 1 141 141 GLY H H 1 1.004688 0.09852 . . . . . . . 141 GLY . 25025 3 65 . 1 1 143 143 LEU N N 15 . 1 1 143 143 LEU H H 1 1.420381 0.15643 . . . . . . . 143 LEU . 25025 3 66 . 1 1 144 144 LEU N N 15 . 1 1 144 144 LEU H H 1 1.005088 0.11082 . . . . . . . 144 LEU . 25025 3 67 . 1 1 145 145 LEU N N 15 . 1 1 145 145 LEU H H 1 0.987267 0.09791 . . . . . . . 145 LEU . 25025 3 68 . 1 1 146 146 LEU N N 15 . 1 1 146 146 LEU H H 1 0.802338 0.10858 . . . . . . . 146 LEU . 25025 3 69 . 1 1 147 147 LEU N N 15 . 1 1 147 147 LEU H H 1 0.754562 0.08063 . . . . . . . 147 LEU . 25025 3 70 . 1 1 148 148 GLU N N 15 . 1 1 148 148 GLU H H 1 0.844576 0.09507 . . . . . . . 148 GLU . 25025 3 71 . 1 1 149 149 ALA N N 15 . 1 1 149 149 ALA H H 1 0.976853 0.12256 . . . . . . . 149 ALA . 25025 3 72 . 1 1 151 151 GLY N N 15 . 1 1 151 151 GLY H H 1 0.905992 0.10715 . . . . . . . 151 GLY . 25025 3 73 . 1 1 152 152 LEU N N 15 . 1 1 152 152 LEU H H 1 0.978215 0.07728 . . . . . . . 152 LEU . 25025 3 74 . 1 1 153 153 GLY N N 15 . 1 1 153 153 GLY H H 1 0.86896 0.09758 . . . . . . . 153 GLY . 25025 3 75 . 1 1 154 154 SER N N 15 . 1 1 154 154 SER H H 1 1.569805 0.21909 . . . . . . . 154 SER . 25025 3 76 . 1 1 155 155 VAL N N 15 . 1 1 155 155 VAL H H 1 1.041063 0.15041 . . . . . . . 155 VAL . 25025 3 77 . 1 1 166 166 ARG N N 15 . 1 1 166 166 ARG H H 1 0.944766 0.14327 . . . . . . . 166 ARG . 25025 3 78 . 1 1 168 168 ILE N N 15 . 1 1 168 168 ILE H H 1 0.838637 0.11059 . . . . . . . 168 ILE . 25025 3 79 . 1 1 169 169 LEU N N 15 . 1 1 169 169 LEU H H 1 0.835158 0.10197 . . . . . . . 169 LEU . 25025 3 80 . 1 1 170 170 GLY N N 15 . 1 1 170 170 GLY H H 1 0.920828 0.07638 . . . . . . . 170 GLY . 25025 3 81 . 1 1 175 175 ALA N N 15 . 1 1 175 175 ALA H H 1 0.831043 0.08699 . . . . . . . 175 ALA . 25025 3 82 . 1 1 180 180 LEU N N 15 . 1 1 180 180 LEU H H 1 0.97129 0.07761 . . . . . . . 180 LEU . 25025 3 83 . 1 1 181 181 VAL N N 15 . 1 1 181 181 VAL H H 1 0.987539 0.12434 . . . . . . . 181 VAL . 25025 3 84 . 1 1 182 182 ALA N N 15 . 1 1 182 182 ALA H H 1 0.75059 0.09105 . . . . . . . 182 ALA . 25025 3 85 . 1 1 183 183 LEU N N 15 . 1 1 183 183 LEU H H 1 0.88051 0.11235 . . . . . . . 183 LEU . 25025 3 86 . 1 1 184 184 GLY N N 15 . 1 1 184 184 GLY H H 1 0.808608 0.11551 . . . . . . . 184 GLY . 25025 3 87 . 1 1 185 185 TYR N N 15 . 1 1 185 185 TYR H H 1 1.004466 0.11712 . . . . . . . 185 TYR . 25025 3 88 . 1 1 187 187 ALA N N 15 . 1 1 187 187 ALA H H 1 0.810122 0.10773 . . . . . . . 187 ALA . 25025 3 89 . 1 1 188 188 GLU N N 15 . 1 1 188 188 GLU H H 1 0.74005 0.0632 . . . . . . . 188 GLU . 25025 3 90 . 1 1 190 190 GLY N N 15 . 1 1 190 190 GLY H H 1 0.69688 0.07118 . . . . . . . 190 GLY . 25025 3 91 . 1 1 191 191 TYR N N 15 . 1 1 191 191 TYR H H 1 0.675407 0.06641 . . . . . . . 191 TYR . 25025 3 92 . 1 1 199 199 GLU N N 15 . 1 1 199 199 GLU H H 1 0.826405 0.08174 . . . . . . . 199 GLU . 25025 3 93 . 1 1 200 200 ARG N N 15 . 1 1 200 200 ARG H H 1 0.733144 0.06454 . . . . . . . 200 ARG . 25025 3 94 . 1 1 201 201 VAL N N 15 . 1 1 201 201 VAL H H 1 0.936913 0.11724 . . . . . . . 201 VAL . 25025 3 95 . 1 1 202 202 VAL N N 15 . 1 1 202 202 VAL H H 1 0.790281 0.06059 . . . . . . . 202 VAL . 25025 3 96 . 1 1 203 203 LEU N N 15 . 1 1 203 203 LEU H H 1 0.723385 0.09423 . . . . . . . 203 LEU . 25025 3 97 . 1 1 204 204 TRP N N 15 . 1 1 204 204 TRP H H 1 0.691917 0.07687 . . . . . . . 204 TRP . 25025 3 98 . 1 1 205 205 ARG N N 15 . 1 1 205 205 ARG H H 1 0.838632 0.09301 . . . . . . . 205 ARG . 25025 3 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 25025 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 500 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 R1 . . . 25025 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 9 9 ASP N N 15 1.0648696 0.040285992 . . 9 ASP . 25025 1 2 . 1 1 11 11 LYS N N 15 1.0580524 0.053893525 . . 11 LYS . 25025 1 3 . 1 1 12 12 THR N N 15 1.3055245 0.11723149 . . 12 THR . 25025 1 4 . 1 1 13 13 ALA N N 15 1.1093414 0.040895054 . . 13 ALA . 25025 1 5 . 1 1 14 14 ALA N N 15 1.0807717 0.056889539 . . 14 ALA . 25025 1 6 . 1 1 15 15 LEU N N 15 1.1074821 0.058450642 . . 15 LEU . 25025 1 7 . 1 1 16 16 LYS N N 15 1.0962342 0.056081358 . . 16 LYS . 25025 1 8 . 1 1 17 17 ARG N N 15 1.0913903 0.08485608 . . 17 ARG . 25025 1 9 . 1 1 19 19 SER N N 15 0.94589135 0.24768151 . . 19 SER . 25025 1 10 . 1 1 20 20 ILE N N 15 1.0967202 0.085204049 . . 20 ILE . 25025 1 11 . 1 1 21 21 ARG N N 15 1.2418848 0.056391238 . . 21 ARG . 25025 1 12 . 1 1 22 22 ARG N N 15 0.95981634 0.080131695 . . 22 ARG . 25025 1 13 . 1 1 23 23 TYR N N 15 1.1617294 0.076223229 . . 23 TYR . 25025 1 14 . 1 1 24 24 ARG N N 15 1.1413731 0.098818523 . . 24 ARG . 25025 1 15 . 1 1 26 26 ASP N N 15 0.98478276 0.12140813 . . 26 ASP . 25025 1 16 . 1 1 28 28 VAL N N 15 1.0444725 0.039407683 . . 28 VAL . 25025 1 17 . 1 1 32 32 LEU N N 15 1.0488796 0.064857624 . . 32 LEU . 25025 1 18 . 1 1 34 34 ARG N N 15 0.999163 0.051998572 . . 34 ARG . 25025 1 19 . 1 1 40 40 ALA N N 15 1.0664956 0.067814829 . . 40 ALA . 25025 1 20 . 1 1 42 42 ARG N N 15 0.99784847 0.050503321 . . 42 ARG . 25025 1 21 . 1 1 43 43 ALA N N 15 1.0460438 0.095659533 . . 43 ALA . 25025 1 22 . 1 1 45 45 SER N N 15 1.0328579 0.15485794 . . 45 SER . 25025 1 23 . 1 1 48 48 ASN N N 15 1.120999 0.16059532 . . 48 ASN . 25025 1 24 . 1 1 50 50 GLN N N 15 1.1728667 0.11480862 . . 50 GLN . 25025 1 25 . 1 1 52 52 TRP N N 15 1.0268017 0.073554752 . . 52 TRP . 25025 1 26 . 1 1 54 54 ILE N N 15 1.1743643 0.05708737 . . 54 ILE . 25025 1 27 . 1 1 55 55 VAL N N 15 1.0111484 0.054937516 . . 55 VAL . 25025 1 28 . 1 1 56 56 VAL N N 15 1.1038591 0.059458174 . . 56 VAL . 25025 1 29 . 1 1 57 57 VAL N N 15 1.0143959 0.065293098 . . 57 VAL . 25025 1 30 . 1 1 58 58 ARG N N 15 1.0692384 0.10808288 . . 58 ARG . 25025 1 31 . 1 1 62 62 THR N N 15 1.1172939 0.079292733 . . 62 THR . 25025 1 32 . 1 1 63 63 LYS N N 15 1.0656595 0.065909957 . . 63 LYS . 25025 1 33 . 1 1 64 64 ARG N N 15 1.0544855 0.065271383 . . 64 ARG . 25025 1 34 . 1 1 65 65 ALA N N 15 1.0648306 0.0309406 . . 65 ALA . 25025 1 35 . 1 1 66 66 LEU N N 15 1.1175886 0.057032978 . . 66 LEU . 25025 1 36 . 1 1 67 67 ARG N N 15 1.0856484 0.047653641 . . 67 ARG . 25025 1 37 . 1 1 70 70 ALA N N 15 1.0700377 0.039100173 . . 70 ALA . 25025 1 38 . 1 1 71 71 PHE N N 15 0.97145417 0.095782506 . . 71 PHE . 25025 1 39 . 1 1 72 72 GLY N N 15 1.1735923 0.19747638 . . 72 GLY . 25025 1 40 . 1 1 73 73 GLN N N 15 1.0542328 0.11083315 . . 73 GLN . 25025 1 41 . 1 1 74 74 ALA N N 15 0.88948499 0.23286777 . . 74 ALA . 25025 1 42 . 1 1 75 75 HIS N N 15 1.0834155 0.1271492 . . 75 HIS . 25025 1 43 . 1 1 76 76 VAL N N 15 1.1961286 0.071330972 . . 76 VAL . 25025 1 44 . 1 1 78 78 GLU N N 15 1.0596746 0.050292436 . . 78 GLU . 25025 1 45 . 1 1 79 79 ALA N N 15 1.1161623 0.069344748 . . 79 ALA . 25025 1 46 . 1 1 81 81 VAL N N 15 1.0542576 0.032786192 . . 81 VAL . 25025 1 47 . 1 1 82 82 VAL N N 15 0.97270849 0.036767388 . . 82 VAL . 25025 1 48 . 1 1 85 85 LEU N N 15 1.1099129 0.089773598 . . 85 LEU . 25025 1 49 . 1 1 86 86 TYR N N 15 1.0852176 0.056276844 . . 86 TYR . 25025 1 50 . 1 1 87 87 ALA N N 15 0.89707404 0.055313073 . . 87 ALA . 25025 1 51 . 1 1 89 89 LEU N N 15 1.0966922 0.082807412 . . 89 LEU . 25025 1 52 . 1 1 90 90 GLU N N 15 1.0100572 0.091552368 . . 90 GLU . 25025 1 53 . 1 1 91 91 ASP N N 15 1.1519563 0.048582526 . . 91 ASP . 25025 1 54 . 1 1 93 93 LEU N N 15 1.0089055 0.061651726 . . 93 LEU . 25025 1 55 . 1 1 95 95 HIS N N 15 1.0135067 0.071569827 . . 95 HIS . 25025 1 56 . 1 1 96 96 LEU N N 15 1.1813711 0.11934845 . . 96 LEU . 25025 1 57 . 1 1 98 98 GLU N N 15 1.0711111 0.10383829 . . 98 GLU . 25025 1 58 . 1 1 99 99 VAL N N 15 1.1242862 0.083309195 . . 99 VAL . 25025 1 59 . 1 1 100 100 ILE N N 15 1.0757163 0.080065338 . . 100 ILE . 25025 1 60 . 1 1 105 105 GLN N N 15 1.3696773 0.52581523 . . 105 GLN . 25025 1 61 . 1 1 109 109 ARG N N 15 1.3032977 0.062324708 . . 109 ARG . 25025 1 62 . 1 1 110 110 GLU N N 15 1.0469367 0.059551417 . . 110 GLU . 25025 1 63 . 1 1 113 113 LYS N N 15 1.0906787 0.053564102 . . 113 LYS . 25025 1 64 . 1 1 115 115 ALA N N 15 1.1094608 0.039361051 . . 115 ALA . 25025 1 65 . 1 1 117 117 GLN N N 15 1.1341544 0.048800056 . . 117 GLN . 25025 1 66 . 1 1 118 118 ARG N N 15 1.1573203 0.055493775 . . 118 ARG . 25025 1 67 . 1 1 120 120 PHE N N 15 1.1006041 0.060536447 . . 120 PHE . 25025 1 68 . 1 1 121 121 ALA N N 15 0.9705888 0.056286277 . . 121 ALA . 25025 1 69 . 1 1 128 128 ARG N N 15 1.2093862 0.099960951 . . 128 ARG . 25025 1 70 . 1 1 129 129 LYS N N 15 1.1995702 0.069839276 . . 129 LYS . 25025 1 71 . 1 1 130 130 ALA N N 15 1.1141944 0.060174807 . . 130 ALA . 25025 1 72 . 1 1 131 131 TRP N N 15 1.1708066 0.080065636 . . 131 TRP . 25025 1 73 . 1 1 132 132 ALA N N 15 1.1123879 0.081972943 . . 132 ALA . 25025 1 74 . 1 1 133 133 SER N N 15 1.1813555 0.076535865 . . 133 SER . 25025 1 75 . 1 1 134 134 GLY N N 15 1.1336823 0.065821417 . . 134 GLY . 25025 1 76 . 1 1 135 135 GLN N N 15 1.1485002 0.077311961 . . 135 GLN . 25025 1 77 . 1 1 136 136 SER N N 15 1.0880176 0.070932182 . . 136 SER . 25025 1 78 . 1 1 139 139 LEU N N 15 1.0915566 0.096542739 . . 139 LEU . 25025 1 79 . 1 1 141 141 GLY N N 15 1.1119825 0.053063907 . . 141 GLY . 25025 1 80 . 1 1 143 143 LEU N N 15 1.1251004 0.044804422 . . 143 LEU . 25025 1 81 . 1 1 144 144 LEU N N 15 1.1224922 0.1069621 . . 144 LEU . 25025 1 82 . 1 1 145 145 LEU N N 15 1.0101042 0.069091226 . . 145 LEU . 25025 1 83 . 1 1 146 146 LEU N N 15 1.0967993 0.12871578 . . 146 LEU . 25025 1 84 . 1 1 147 147 LEU N N 15 1.1717004 0.083056491 . . 147 LEU . 25025 1 85 . 1 1 148 148 GLU N N 15 1.1652299 0.037809891 . . 148 GLU . 25025 1 86 . 1 1 149 149 ALA N N 15 1.0449648 0.05746879 . . 149 ALA . 25025 1 87 . 1 1 151 151 GLY N N 15 1.0147395 0.065689909 . . 151 GLY . 25025 1 88 . 1 1 152 152 LEU N N 15 1.0104993 0.060101043 . . 152 LEU . 25025 1 89 . 1 1 153 153 GLY N N 15 1.0003348 0.043426003 . . 153 GLY . 25025 1 90 . 1 1 154 154 SER N N 15 1.0672224 0.070431202 . . 154 SER . 25025 1 91 . 1 1 155 155 VAL N N 15 1.0982129 0.090721027 . . 155 VAL . 25025 1 92 . 1 1 166 166 ARG N N 15 1.1188582 0.038239068 . . 166 ARG . 25025 1 93 . 1 1 168 168 ILE N N 15 1.3133541 0.052755901 . . 168 ILE . 25025 1 94 . 1 1 169 169 LEU N N 15 1.1057444 0.042243745 . . 169 LEU . 25025 1 95 . 1 1 170 170 GLY N N 15 1.0742022 0.05170777 . . 170 GLY . 25025 1 96 . 1 1 175 175 ALA N N 15 1.0326243 0.065740276 . . 175 ALA . 25025 1 97 . 1 1 180 180 LEU N N 15 1.0715303 0.042870826 . . 180 LEU . 25025 1 98 . 1 1 181 181 VAL N N 15 1.1266611 0.058596743 . . 181 VAL . 25025 1 99 . 1 1 182 182 ALA N N 15 1.1578091 0.089364813 . . 182 ALA . 25025 1 100 . 1 1 183 183 LEU N N 15 1.1267301 0.049594881 . . 183 LEU . 25025 1 101 . 1 1 184 184 GLY N N 15 1.0354604 0.069222771 . . 184 GLY . 25025 1 102 . 1 1 185 185 TYR N N 15 0.95112307 0.12975604 . . 185 TYR . 25025 1 103 . 1 1 187 187 ALA N N 15 0.98207398 0.096231341 . . 187 ALA . 25025 1 104 . 1 1 188 188 GLU N N 15 0.93314636 0.067521028 . . 188 GLU . 25025 1 105 . 1 1 190 190 GLY N N 15 0.95263995 0.082888203 . . 190 GLY . 25025 1 106 . 1 1 191 191 TYR N N 15 1.1217214 0.060370897 . . 191 TYR . 25025 1 107 . 1 1 193 193 SER N N 15 1.3343684 0.23492929 . . 193 SER . 25025 1 108 . 1 1 196 196 LEU N N 15 1.0829779 0.22324719 . . 196 LEU . 25025 1 109 . 1 1 199 199 GLU N N 15 1.0203408 0.056944164 . . 199 GLU . 25025 1 110 . 1 1 200 200 ARG N N 15 1.0356429 0.040103267 . . 200 ARG . 25025 1 111 . 1 1 201 201 VAL N N 15 0.99089946 0.068387621 . . 201 VAL . 25025 1 112 . 1 1 202 202 VAL N N 15 1.1592785 0.039966926 . . 202 VAL . 25025 1 113 . 1 1 203 203 LEU N N 15 1.1779399 0.052450959 . . 203 LEU . 25025 1 114 . 1 1 204 204 TRP N N 15 1.046253 0.05203966 . . 204 TRP . 25025 1 115 . 1 1 205 205 ARG N N 15 1.0668407 0.077008363 . . 205 ARG . 25025 1 stop_ save_ save_heteronuclear_T1_list_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_2 _Heteronucl_T1_list.Entry_ID 25025 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 500 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 R1 . . . 25025 2 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 9 9 ASP N N 15 1.31247 0.04757 . . 9 ASP . 25025 2 2 . 1 1 13 13 ALA N N 15 1.23136 0.03412 . . 13 ALA . 25025 2 3 . 1 1 14 14 ALA N N 15 1.1525 0.03431 . . 14 ALA . 25025 2 4 . 1 1 15 15 LEU N N 15 1.18369 0.04685 . . 15 LEU . 25025 2 5 . 1 1 16 16 LYS N N 15 1.38761 0.04873 . . 16 LYS . 25025 2 6 . 1 1 17 17 ARG N N 15 1.34464 0.05031 . . 17 ARG . 25025 2 7 . 1 1 20 20 ILE N N 15 1.59503 0.05134 . . 20 ILE . 25025 2 8 . 1 1 23 23 TYR N N 15 1.23451 0.02948 . . 23 TYR . 25025 2 9 . 1 1 24 24 ARG N N 15 1.31823 0.07338 . . 24 ARG . 25025 2 10 . 1 1 26 26 ASP N N 15 1.18543 0.07665 . . 26 ASP . 25025 2 11 . 1 1 28 28 VAL N N 15 1.56589 0.06757 . . 28 VAL . 25025 2 12 . 1 1 32 32 LEU N N 15 1.11748 0.05466 . . 32 LEU . 25025 2 13 . 1 1 34 34 ARG N N 15 1.24563 0.03776 . . 34 ARG . 25025 2 14 . 1 1 40 40 ALA N N 15 1.58571 0.08428 . . 40 ALA . 25025 2 15 . 1 1 42 42 ARG N N 15 1.20266 0.03477 . . 42 ARG . 25025 2 16 . 1 1 43 43 ALA N N 15 1.20979 0.03034 . . 43 ALA . 25025 2 17 . 1 1 45 45 SER N N 15 1.34298 0.09952 . . 45 SER . 25025 2 18 . 1 1 48 48 ASN N N 15 1.38886 0.03027 . . 48 ASN . 25025 2 19 . 1 1 50 50 GLN N N 15 1.33642 0.1319 . . 50 GLN . 25025 2 20 . 1 1 52 52 TRP N N 15 1.18923 0.05665 . . 52 TRP . 25025 2 21 . 1 1 54 54 ILE N N 15 1.21517 0.03912 . . 54 ILE . 25025 2 22 . 1 1 55 55 VAL N N 15 1.06849 0.0426 . . 55 VAL . 25025 2 23 . 1 1 56 56 VAL N N 15 1.15311 0.0272 . . 56 VAL . 25025 2 24 . 1 1 57 57 VAL N N 15 1.33668 0.09804 . . 57 VAL . 25025 2 25 . 1 1 62 62 THR N N 15 1.29898 0.02421 . . 62 THR . 25025 2 26 . 1 1 63 63 LYS N N 15 1.56156 0.07704 . . 63 LYS . 25025 2 27 . 1 1 64 64 ARG N N 15 1.20413 0.03229 . . 64 ARG . 25025 2 28 . 1 1 65 65 ALA N N 15 1.28083 0.03754 . . 65 ALA . 25025 2 29 . 1 1 66 66 LEU N N 15 1.27916 0.03238 . . 66 LEU . 25025 2 30 . 1 1 67 67 ARG N N 15 1.44498 0.03235 . . 67 ARG . 25025 2 31 . 1 1 70 70 ALA N N 15 1.33007 0.02642 . . 70 ALA . 25025 2 32 . 1 1 76 76 VAL N N 15 1.59788 0.18378 . . 76 VAL . 25025 2 33 . 1 1 79 79 ALA N N 15 1.3467 0.05078 . . 79 ALA . 25025 2 34 . 1 1 81 81 VAL N N 15 1.26044 0.08551 . . 81 VAL . 25025 2 35 . 1 1 82 82 VAL N N 15 1.27649 0.05 . . 82 VAL . 25025 2 36 . 1 1 85 85 LEU N N 15 1.19469 0.04313 . . 85 LEU . 25025 2 37 . 1 1 86 86 TYR N N 15 1.31355 0.05491 . . 86 TYR . 25025 2 38 . 1 1 87 87 ALA N N 15 1.29202 0.04129 . . 87 ALA . 25025 2 39 . 1 1 89 89 LEU N N 15 1.24317 0.05407 . . 89 LEU . 25025 2 40 . 1 1 90 90 GLU N N 15 1.28641 0.04116 . . 90 GLU . 25025 2 41 . 1 1 91 91 ASP N N 15 1.38997 0.06367 . . 91 ASP . 25025 2 42 . 1 1 93 93 LEU N N 15 1.13407 0.02675 . . 93 LEU . 25025 2 43 . 1 1 95 95 HIS N N 15 1.3321 0.05639 . . 95 HIS . 25025 2 44 . 1 1 96 96 LEU N N 15 1.9238 0.1206 . . 96 LEU . 25025 2 45 . 1 1 98 98 GLU N N 15 1.45609 0.03105 . . 98 GLU . 25025 2 46 . 1 1 99 99 VAL N N 15 1.31394 0.04871 . . 99 VAL . 25025 2 47 . 1 1 100 100 ILE N N 15 1.22977 0.05029 . . 100 ILE . 25025 2 48 . 1 1 110 110 GLU N N 15 1.55463 0.04951 . . 110 GLU . 25025 2 49 . 1 1 113 113 LYS N N 15 1.05445 0.04978 . . 113 LYS . 25025 2 50 . 1 1 115 115 ALA N N 15 1.20272 0.04005 . . 115 ALA . 25025 2 51 . 1 1 117 117 GLN N N 15 1.25418 0.03519 . . 117 GLN . 25025 2 52 . 1 1 118 118 ARG N N 15 1.36149 0.02541 . . 118 ARG . 25025 2 53 . 1 1 120 120 PHE N N 15 1.26267 0.0379 . . 120 PHE . 25025 2 54 . 1 1 121 121 ALA N N 15 1.27452 0.03763 . . 121 ALA . 25025 2 55 . 1 1 128 128 ARG N N 15 1.39848 0.04792 . . 128 ARG . 25025 2 56 . 1 1 129 129 LYS N N 15 1.27197 0.02458 . . 129 LYS . 25025 2 57 . 1 1 130 130 ALA N N 15 1.36096 0.04983 . . 130 ALA . 25025 2 58 . 1 1 131 131 TRP N N 15 1.2024 0.03425 . . 131 TRP . 25025 2 59 . 1 1 132 132 ALA N N 15 1.63055 0.08247 . . 132 ALA . 25025 2 60 . 1 1 133 133 SER N N 15 1.38264 0.05896 . . 133 SER . 25025 2 61 . 1 1 134 134 GLY N N 15 1.17848 0.03131 . . 134 GLY . 25025 2 62 . 1 1 135 135 GLN N N 15 1.33419 0.07811 . . 135 GLN . 25025 2 63 . 1 1 136 136 SER N N 15 1.28553 0.0461 . . 136 SER . 25025 2 64 . 1 1 141 141 GLY N N 15 1.11487 0.03143 . . 141 GLY . 25025 2 65 . 1 1 143 143 LEU N N 15 1.27939 0.0275 . . 143 LEU . 25025 2 66 . 1 1 144 144 LEU N N 15 1.23605 0.03152 . . 144 LEU . 25025 2 67 . 1 1 145 145 LEU N N 15 1.3382 0.03175 . . 145 LEU . 25025 2 68 . 1 1 146 146 LEU N N 15 1.28928 0.0433 . . 146 LEU . 25025 2 69 . 1 1 147 147 LEU N N 15 1.23441 0.02128 . . 147 LEU . 25025 2 70 . 1 1 148 148 GLU N N 15 1.35144 0.05993 . . 148 GLU . 25025 2 71 . 1 1 149 149 ALA N N 15 1.36282 0.06215 . . 149 ALA . 25025 2 72 . 1 1 151 151 GLY N N 15 1.18956 0.04292 . . 151 GLY . 25025 2 73 . 1 1 152 152 LEU N N 15 1.22622 0.10549 . . 152 LEU . 25025 2 74 . 1 1 153 153 GLY N N 15 1.10306 0.05132 . . 153 GLY . 25025 2 75 . 1 1 154 154 SER N N 15 1.48218 0.06631 . . 154 SER . 25025 2 76 . 1 1 155 155 VAL N N 15 1.29415 0.02761 . . 155 VAL . 25025 2 77 . 1 1 166 166 ARG N N 15 1.22969 0.03682 . . 166 ARG . 25025 2 78 . 1 1 168 168 ILE N N 15 0.32456 0.7335 . . 168 ILE . 25025 2 79 . 1 1 169 169 LEU N N 15 1.20849 0.03335 . . 169 LEU . 25025 2 80 . 1 1 170 170 GLY N N 15 1.14718 0.03045 . . 170 GLY . 25025 2 81 . 1 1 175 175 ALA N N 15 1.23592 0.03407 . . 175 ALA . 25025 2 82 . 1 1 180 180 LEU N N 15 1.36901 0.04486 . . 180 LEU . 25025 2 83 . 1 1 181 181 VAL N N 15 1.21702 0.04284 . . 181 VAL . 25025 2 84 . 1 1 182 182 ALA N N 15 1.20178 0.02968 . . 182 ALA . 25025 2 85 . 1 1 183 183 LEU N N 15 1.4324 0.08698 . . 183 LEU . 25025 2 86 . 1 1 184 184 GLY N N 15 1.24875 0.11091 . . 184 GLY . 25025 2 87 . 1 1 185 185 TYR N N 15 1.36458 0.05784 . . 185 TYR . 25025 2 88 . 1 1 187 187 ALA N N 15 1.35031 0.03967 . . 187 ALA . 25025 2 89 . 1 1 188 188 GLU N N 15 1.15906 0.02216 . . 188 GLU . 25025 2 90 . 1 1 190 190 GLY N N 15 1.31318 0.09833 . . 190 GLY . 25025 2 91 . 1 1 191 191 TYR N N 15 1.46087 0.07785 . . 191 TYR . 25025 2 92 . 1 1 199 199 GLU N N 15 1.3906 0.08916 . . 199 GLU . 25025 2 93 . 1 1 200 200 ARG N N 15 1.36608 0.03399 . . 200 ARG . 25025 2 94 . 1 1 201 201 VAL N N 15 1.19518 0.06237 . . 201 VAL . 25025 2 95 . 1 1 202 202 VAL N N 15 1.29114 0.03636 . . 202 VAL . 25025 2 96 . 1 1 203 203 LEU N N 15 1.1512 0.06671 . . 203 LEU . 25025 2 97 . 1 1 204 204 TRP N N 15 1.15699 0.03151 . . 204 TRP . 25025 2 98 . 1 1 205 205 ARG N N 15 1.18636 0.04639 . . 205 ARG . 25025 2 stop_ save_ save_heteronuclear_T1_list_3 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_3 _Heteronucl_T1_list.Entry_ID 25025 _Heteronucl_T1_list.ID 3 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 R1 . . . 25025 3 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 9 9 ASP N N 15 0.5948337 0.030909172 . . 9 ASP . 25025 3 2 . 1 1 11 11 LYS N N 15 0.58383896 0.042726391 . . 11 LYS . 25025 3 3 . 1 1 12 12 THR N N 15 0.63231177 0.046309845 . . 12 THR . 25025 3 4 . 1 1 13 13 ALA N N 15 0.63781844 0.035301954 . . 13 ALA . 25025 3 5 . 1 1 14 14 ALA N N 15 0.5832391 0.027951429 . . 14 ALA . 25025 3 6 . 1 1 15 15 LEU N N 15 0.58455989 0.043313683 . . 15 LEU . 25025 3 7 . 1 1 16 16 LYS N N 15 0.60587969 0.039242574 . . 16 LYS . 25025 3 8 . 1 1 17 17 ARG N N 15 0.59105583 0.0311951 . . 17 ARG . 25025 3 9 . 1 1 19 19 SER N N 15 0.76366864 0.10250604 . . 19 SER . 25025 3 10 . 1 1 20 20 ILE N N 15 0.70574049 0.069820894 . . 20 ILE . 25025 3 11 . 1 1 21 21 ARG N N 15 0.65049392 0.092448228 . . 21 ARG . 25025 3 12 . 1 1 22 22 ARG N N 15 0.58736277 0.055062098 . . 22 ARG . 25025 3 13 . 1 1 23 23 TYR N N 15 0.60789567 0.04773817 . . 23 TYR . 25025 3 14 . 1 1 24 24 ARG N N 15 0.63937971 0.056235282 . . 24 ARG . 25025 3 15 . 1 1 26 26 ASP N N 15 0.57743478 0.032678358 . . 26 ASP . 25025 3 16 . 1 1 28 28 VAL N N 15 0.54336305 0.037104597 . . 28 VAL . 25025 3 17 . 1 1 32 32 LEU N N 15 0.61575859 0.056044085 . . 32 LEU . 25025 3 18 . 1 1 34 34 ARG N N 15 0.58915747 0.041794467 . . 34 ARG . 25025 3 19 . 1 1 40 40 ALA N N 15 0.56820609 0.025228399 . . 40 ALA . 25025 3 20 . 1 1 42 42 ARG N N 15 0.64205291 0.049392901 . . 42 ARG . 25025 3 21 . 1 1 43 43 ALA N N 15 0.67969585 0.045907041 . . 43 ALA . 25025 3 22 . 1 1 45 45 SER N N 15 0.68115702 0.06780152 . . 45 SER . 25025 3 23 . 1 1 48 48 ASN N N 15 0.75623911 0.067431619 . . 48 ASN . 25025 3 24 . 1 1 50 50 GLN N N 15 0.688083 0.064126592 . . 50 GLN . 25025 3 25 . 1 1 52 52 TRP N N 15 0.61496678 0.047034594 . . 52 TRP . 25025 3 26 . 1 1 54 54 ILE N N 15 0.54327424 0.025937137 . . 54 ILE . 25025 3 27 . 1 1 55 55 VAL N N 15 0.57262873 0.032376145 . . 55 VAL . 25025 3 28 . 1 1 56 56 VAL N N 15 0.56953546 0.032954661 . . 56 VAL . 25025 3 29 . 1 1 57 57 VAL N N 15 0.57124066 0.037066174 . . 57 VAL . 25025 3 30 . 1 1 58 58 ARG N N 15 0.67945973 0.066079109 . . 58 ARG . 25025 3 31 . 1 1 62 62 THR N N 15 0.67180755 0.048933073 . . 62 THR . 25025 3 32 . 1 1 63 63 LYS N N 15 0.69224466 0.054999356 . . 63 LYS . 25025 3 33 . 1 1 64 64 ARG N N 15 0.61709933 0.032453651 . . 64 ARG . 25025 3 34 . 1 1 65 65 ALA N N 15 0.59875658 0.032793276 . . 65 ALA . 25025 3 35 . 1 1 66 66 LEU N N 15 0.60149018 0.029836411 . . 66 LEU . 25025 3 36 . 1 1 67 67 ARG N N 15 0.60377762 0.040084412 . . 67 ARG . 25025 3 37 . 1 1 70 70 ALA N N 15 0.57138797 0.03223706 . . 70 ALA . 25025 3 38 . 1 1 71 71 PHE N N 15 0.6680234 0.055697343 . . 71 PHE . 25025 3 39 . 1 1 72 72 GLY N N 15 0.77662936 0.088249423 . . 72 GLY . 25025 3 40 . 1 1 73 73 GLN N N 15 0.734561 0.072110585 . . 73 GLN . 25025 3 41 . 1 1 74 74 ALA N N 15 0.77752598 0.091795512 . . 74 ALA . 25025 3 42 . 1 1 75 75 HIS N N 15 0.8122156 0.088929506 . . 75 HIS . 25025 3 43 . 1 1 76 76 VAL N N 15 0.67540889 0.046094596 . . 76 VAL . 25025 3 44 . 1 1 78 78 GLU N N 15 0.63164521 0.039632551 . . 78 GLU . 25025 3 45 . 1 1 79 79 ALA N N 15 0.66811859 0.058000834 . . 79 ALA . 25025 3 46 . 1 1 81 81 VAL N N 15 0.60222243 0.034841198 . . 81 VAL . 25025 3 47 . 1 1 82 82 VAL N N 15 0.59645791 0.032964898 . . 82 VAL . 25025 3 48 . 1 1 85 85 LEU N N 15 0.56949227 0.035674339 . . 85 LEU . 25025 3 49 . 1 1 86 86 TYR N N 15 0.59480472 0.031276624 . . 86 TYR . 25025 3 50 . 1 1 87 87 ALA N N 15 0.58615028 0.04473843 . . 87 ALA . 25025 3 51 . 1 1 89 89 LEU N N 15 0.6534548 0.060776037 . . 89 LEU . 25025 3 52 . 1 1 90 90 GLU N N 15 0.66331847 0.050207813 . . 90 GLU . 25025 3 53 . 1 1 91 91 ASP N N 15 0.63518098 0.052177239 . . 91 ASP . 25025 3 54 . 1 1 93 93 LEU N N 15 0.60206806 0.040024117 . . 93 LEU . 25025 3 55 . 1 1 95 95 HIS N N 15 0.64190464 0.055392405 . . 95 HIS . 25025 3 56 . 1 1 96 96 LEU N N 15 0.78093357 0.08584377 . . 96 LEU . 25025 3 57 . 1 1 98 98 GLU N N 15 0.77096212 0.076621422 . . 98 GLU . 25025 3 58 . 1 1 99 99 VAL N N 15 0.68604376 0.051935295 . . 99 VAL . 25025 3 59 . 1 1 100 100 ILE N N 15 0.71040354 0.056414615 . . 100 ILE . 25025 3 60 . 1 1 105 105 GLN N N 15 0.83603211 0.12918553 . . 105 GLN . 25025 3 61 . 1 1 109 109 ARG N N 15 0.79989054 0.097556732 . . 109 ARG . 25025 3 62 . 1 1 110 110 GLU N N 15 0.71639646 0.064582057 . . 110 GLU . 25025 3 63 . 1 1 113 113 LYS N N 15 0.6320478 0.049174049 . . 113 LYS . 25025 3 64 . 1 1 115 115 ALA N N 15 0.61826801 0.026640436 . . 115 ALA . 25025 3 65 . 1 1 117 117 GLN N N 15 0.58675069 0.028685767 . . 117 GLN . 25025 3 66 . 1 1 118 118 ARG N N 15 0.60932531 0.029982052 . . 118 ARG . 25025 3 67 . 1 1 120 120 PHE N N 15 0.58405398 0.039492955 . . 120 PHE . 25025 3 68 . 1 1 121 121 ALA N N 15 0.64312678 0.043935833 . . 121 ALA . 25025 3 69 . 1 1 128 128 ARG N N 15 0.7006705 0.069753337 . . 128 ARG . 25025 3 70 . 1 1 129 129 LYS N N 15 0.70041425 0.057833684 . . 129 LYS . 25025 3 71 . 1 1 130 130 ALA N N 15 0.70414052 0.048698802 . . 130 ALA . 25025 3 72 . 1 1 131 131 TRP N N 15 0.65771557 0.047944279 . . 131 TRP . 25025 3 73 . 1 1 132 132 ALA N N 15 0.70196478 0.050084121 . . 132 ALA . 25025 3 74 . 1 1 133 133 SER N N 15 0.68287686 0.059297283 . . 133 SER . 25025 3 75 . 1 1 134 134 GLY N N 15 0.65364733 0.046354063 . . 134 GLY . 25025 3 76 . 1 1 135 135 GLN N N 15 0.65528778 0.042410296 . . 135 GLN . 25025 3 77 . 1 1 136 136 SER N N 15 0.6370307 0.043973444 . . 136 SER . 25025 3 78 . 1 1 139 139 LEU N N 15 0.6102443 0.041503956 . . 139 LEU . 25025 3 79 . 1 1 141 141 GLY N N 15 0.60942615 0.036712798 . . 141 GLY . 25025 3 80 . 1 1 143 143 LEU N N 15 0.57067003 0.034913328 . . 143 LEU . 25025 3 81 . 1 1 144 144 LEU N N 15 0.60975847 0.041162223 . . 144 LEU . 25025 3 82 . 1 1 145 145 LEU N N 15 0.58628526 0.041085481 . . 145 LEU . 25025 3 83 . 1 1 146 146 LEU N N 15 0.6082024 0.032522891 . . 146 LEU . 25025 3 84 . 1 1 147 147 LEU N N 15 0.60065126 0.037632417 . . 147 LEU . 25025 3 85 . 1 1 148 148 GLU N N 15 0.65297784 0.04481054 . . 148 GLU . 25025 3 86 . 1 1 149 149 ALA N N 15 0.63844544 0.040735531 . . 149 ALA . 25025 3 87 . 1 1 151 151 GLY N N 15 0.60125729 0.03354291 . . 151 GLY . 25025 3 88 . 1 1 152 152 LEU N N 15 0.58910149 0.032216328 . . 152 LEU . 25025 3 89 . 1 1 153 153 GLY N N 15 0.62168335 0.040866481 . . 153 GLY . 25025 3 90 . 1 1 154 154 SER N N 15 0.6869312 0.062157033 . . 154 SER . 25025 3 91 . 1 1 155 155 VAL N N 15 0.63937659 0.052558051 . . 155 VAL . 25025 3 92 . 1 1 166 166 ARG N N 15 0.60081348 0.04055944 . . 166 ARG . 25025 3 93 . 1 1 168 168 ILE N N 15 0.58959956 0.024071601 . . 168 ILE . 25025 3 94 . 1 1 169 169 LEU N N 15 0.58612073 0.027266247 . . 169 LEU . 25025 3 95 . 1 1 170 170 GLY N N 15 0.56845061 0.030412726 . . 170 GLY . 25025 3 96 . 1 1 175 175 ALA N N 15 0.73044298 0.066692674 . . 175 ALA . 25025 3 97 . 1 1 180 180 LEU N N 15 0.58295935 0.037440893 . . 180 LEU . 25025 3 98 . 1 1 181 181 VAL N N 15 0.52315346 0.025141716 . . 181 VAL . 25025 3 99 . 1 1 182 182 ALA N N 15 0.58531363 0.040683508 . . 182 ALA . 25025 3 100 . 1 1 183 183 LEU N N 15 0.62078398 0.037581084 . . 183 LEU . 25025 3 101 . 1 1 184 184 GLY N N 15 0.61280579 0.045163701 . . 184 GLY . 25025 3 102 . 1 1 185 185 TYR N N 15 0.6754025 0.066984786 . . 185 TYR . 25025 3 103 . 1 1 187 187 ALA N N 15 0.62998335 0.049009804 . . 187 ALA . 25025 3 104 . 1 1 188 188 GLU N N 15 0.66314225 0.053399398 . . 188 GLU . 25025 3 105 . 1 1 190 190 GLY N N 15 0.72861118 0.067697603 . . 190 GLY . 25025 3 106 . 1 1 191 191 TYR N N 15 0.78688197 0.082803016 . . 191 TYR . 25025 3 107 . 1 1 193 193 SER N N 15 1.0440701 0.12454144 . . 193 SER . 25025 3 108 . 1 1 196 196 LEU N N 15 0.70131203 0.066432597 . . 196 LEU . 25025 3 109 . 1 1 199 199 GLU N N 15 0.67203181 0.05598165 . . 199 GLU . 25025 3 110 . 1 1 200 200 ARG N N 15 0.66957393 0.037428072 . . 200 ARG . 25025 3 111 . 1 1 201 201 VAL N N 15 0.63183948 0.035902578 . . 201 VAL . 25025 3 112 . 1 1 202 202 VAL N N 15 0.62908014 0.036491382 . . 202 VAL . 25025 3 113 . 1 1 203 203 LEU N N 15 0.57923753 0.028053036 . . 203 LEU . 25025 3 114 . 1 1 204 204 TRP N N 15 0.55075093 0.03029206 . . 204 TRP . 25025 3 115 . 1 1 205 205 ARG N N 15 0.59472039 0.042269957 . . 205 ARG . 25025 3 stop_ save_ save_heteronuclear_T1_list_4 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_4 _Heteronucl_T1_list.Entry_ID 25025 _Heteronucl_T1_list.ID 4 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 10 R1 . . . 25025 4 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 9 9 ASP N N 15 0.679579 0.013609 . . 9 ASP . 25025 4 2 . 1 1 13 13 ALA N N 15 0.68498 0.018098 . . 13 ALA . 25025 4 3 . 1 1 14 14 ALA N N 15 0.624379 0.010283 . . 14 ALA . 25025 4 4 . 1 1 15 15 LEU N N 15 0.633057 0.02202 . . 15 LEU . 25025 4 5 . 1 1 16 16 LYS N N 15 0.672508 0.014897 . . 16 LYS . 25025 4 6 . 1 1 17 17 ARG N N 15 0.680539 0.023288 . . 17 ARG . 25025 4 7 . 1 1 20 20 ILE N N 15 0.734569 0.020687 . . 20 ILE . 25025 4 8 . 1 1 23 23 TYR N N 15 0.652474 0.014909 . . 23 TYR . 25025 4 9 . 1 1 24 24 ARG N N 15 0.65979 0.0234 . . 24 ARG . 25025 4 10 . 1 1 26 26 ASP N N 15 0.604488 0.02569 . . 26 ASP . 25025 4 11 . 1 1 28 28 VAL N N 15 0.637438 0.011901 . . 28 VAL . 25025 4 12 . 1 1 32 32 LEU N N 15 0.670182 0.017943 . . 32 LEU . 25025 4 13 . 1 1 34 34 ARG N N 15 0.631699 0.023881 . . 34 ARG . 25025 4 14 . 1 1 40 40 ALA N N 15 0.679041 0.012012 . . 40 ALA . 25025 4 15 . 1 1 42 42 ARG N N 15 0.631404 0.023177 . . 42 ARG . 25025 4 16 . 1 1 43 43 ALA N N 15 0.687841 0.017097 . . 43 ALA . 25025 4 17 . 1 1 45 45 SER N N 15 0.675878 0.04526 . . 45 SER . 25025 4 18 . 1 1 48 48 ASN N N 15 0.741953 0.028 . . 48 ASN . 25025 4 19 . 1 1 50 50 GLN N N 15 0.678445 0.029008 . . 50 GLN . 25025 4 20 . 1 1 52 52 TRP N N 15 0.664443 0.011875 . . 52 TRP . 25025 4 21 . 1 1 54 54 ILE N N 15 0.589901 0.015267 . . 54 ILE . 25025 4 22 . 1 1 55 55 VAL N N 15 0.608305 0.014163 . . 55 VAL . 25025 4 23 . 1 1 56 56 VAL N N 15 0.618999 0.013628 . . 56 VAL . 25025 4 24 . 1 1 57 57 VAL N N 15 0.602391 0.017689 . . 57 VAL . 25025 4 25 . 1 1 62 62 THR N N 15 0.709382 0.012647 . . 62 THR . 25025 4 26 . 1 1 63 63 LYS N N 15 0.695174 0.012885 . . 63 LYS . 25025 4 27 . 1 1 64 64 ARG N N 15 0.636974 0.016196 . . 64 ARG . 25025 4 28 . 1 1 65 65 ALA N N 15 0.662726 0.017097 . . 65 ALA . 25025 4 29 . 1 1 66 66 LEU N N 15 0.655175 0.014725 . . 66 LEU . 25025 4 30 . 1 1 67 67 ARG N N 15 0.687079 0.018676 . . 67 ARG . 25025 4 31 . 1 1 70 70 ALA N N 15 0.614444 0.010442 . . 70 ALA . 25025 4 32 . 1 1 76 76 VAL N N 15 0.720761 0.014202 . . 76 VAL . 25025 4 33 . 1 1 79 79 ALA N N 15 0.654486 0.010269 . . 79 ALA . 25025 4 34 . 1 1 81 81 VAL N N 15 0.616893 0.012691 . . 81 VAL . 25025 4 35 . 1 1 82 82 VAL N N 15 0.642804 0.018229 . . 82 VAL . 25025 4 36 . 1 1 85 85 LEU N N 15 0.626714 0.018432 . . 85 LEU . 25025 4 37 . 1 1 86 86 TYR N N 15 0.659965 0.017532 . . 86 TYR . 25025 4 38 . 1 1 87 87 ALA N N 15 0.646048 0.018964 . . 87 ALA . 25025 4 39 . 1 1 89 89 LEU N N 15 0.753962 0.018406 . . 89 LEU . 25025 4 40 . 1 1 90 90 GLU N N 15 0.724131 0.01825 . . 90 GLU . 25025 4 41 . 1 1 91 91 ASP N N 15 0.668173 0.010834 . . 91 ASP . 25025 4 42 . 1 1 93 93 LEU N N 15 0.655284 0.01997 . . 93 LEU . 25025 4 43 . 1 1 95 95 HIS N N 15 0.700161 0.016353 . . 95 HIS . 25025 4 44 . 1 1 96 96 LEU N N 15 0.831178 0.043272 . . 96 LEU . 25025 4 45 . 1 1 98 98 GLU N N 15 0.778292 0.015035 . . 98 GLU . 25025 4 46 . 1 1 99 99 VAL N N 15 0.69948 0.024292 . . 99 VAL . 25025 4 47 . 1 1 100 100 ILE N N 15 0.70188 0.021248 . . 100 ILE . 25025 4 48 . 1 1 110 110 GLU N N 15 0.729255 0.016861 . . 110 GLU . 25025 4 49 . 1 1 113 113 LYS N N 15 0.672105 0.012651 . . 113 LYS . 25025 4 50 . 1 1 115 115 ALA N N 15 0.659016 0.012341 . . 115 ALA . 25025 4 51 . 1 1 117 117 GLN N N 15 0.635318 0.019947 . . 117 GLN . 25025 4 52 . 1 1 118 118 ARG N N 15 0.6281 0.009734 . . 118 ARG . 25025 4 53 . 1 1 120 120 PHE N N 15 0.621446 0.020948 . . 120 PHE . 25025 4 54 . 1 1 121 121 ALA N N 15 0.678193 0.013157 . . 121 ALA . 25025 4 55 . 1 1 128 128 ARG N N 15 0.747701 0.019495 . . 128 ARG . 25025 4 56 . 1 1 129 129 LYS N N 15 0.718384 0.01766 . . 129 LYS . 25025 4 57 . 1 1 130 130 ALA N N 15 0.755299 0.014922 . . 130 ALA . 25025 4 58 . 1 1 131 131 TRP N N 15 0.678852 0.020287 . . 131 TRP . 25025 4 59 . 1 1 132 132 ALA N N 15 0.732494 0.01433 . . 132 ALA . 25025 4 60 . 1 1 133 133 SER N N 15 0.731356 0.018644 . . 133 SER . 25025 4 61 . 1 1 134 134 GLY N N 15 0.713535 0.018996 . . 134 GLY . 25025 4 62 . 1 1 135 135 GLN N N 15 0.674401 0.023974 . . 135 GLN . 25025 4 63 . 1 1 136 136 SER N N 15 0.664761 0.017332 . . 136 SER . 25025 4 64 . 1 1 141 141 GLY N N 15 0.670502 0.019355 . . 141 GLY . 25025 4 65 . 1 1 143 143 LEU N N 15 0.624454 0.022993 . . 143 LEU . 25025 4 66 . 1 1 144 144 LEU N N 15 0.64791 0.020831 . . 144 LEU . 25025 4 67 . 1 1 145 145 LEU N N 15 0.713169 0.024625 . . 145 LEU . 25025 4 68 . 1 1 146 146 LEU N N 15 0.667751 0.017271 . . 146 LEU . 25025 4 69 . 1 1 147 147 LEU N N 15 0.655635 0.025583 . . 147 LEU . 25025 4 70 . 1 1 148 148 GLU N N 15 0.691681 0.019165 . . 148 GLU . 25025 4 71 . 1 1 149 149 ALA N N 15 0.715464 0.02202 . . 149 ALA . 25025 4 72 . 1 1 151 151 GLY N N 15 0.628836 0.014344 . . 151 GLY . 25025 4 73 . 1 1 152 152 LEU N N 15 0.598719 0.016413 . . 152 LEU . 25025 4 74 . 1 1 153 153 GLY N N 15 0.63621 0.026977 . . 153 GLY . 25025 4 75 . 1 1 154 154 SER N N 15 0.718962 0.037839 . . 154 SER . 25025 4 76 . 1 1 155 155 VAL N N 15 0.672971 0.018169 . . 155 VAL . 25025 4 77 . 1 1 166 166 ARG N N 15 0.695195 0.022111 . . 166 ARG . 25025 4 78 . 1 1 168 168 ILE N N 15 0.621942 0.015038 . . 168 ILE . 25025 4 79 . 1 1 169 169 LEU N N 15 0.644359 0.014675 . . 169 LEU . 25025 4 80 . 1 1 170 170 GLY N N 15 0.609807 0.010554 . . 170 GLY . 25025 4 81 . 1 1 175 175 ALA N N 15 0.723171 0.016866 . . 175 ALA . 25025 4 82 . 1 1 180 180 LEU N N 15 0.581296 0.022295 . . 180 LEU . 25025 4 83 . 1 1 181 181 VAL N N 15 0.588592 0.014371 . . 181 VAL . 25025 4 84 . 1 1 182 182 ALA N N 15 0.651094 0.010801 . . 182 ALA . 25025 4 85 . 1 1 183 183 LEU N N 15 0.66739 0.01697 . . 183 LEU . 25025 4 86 . 1 1 184 184 GLY N N 15 0.696821 0.024243 . . 184 GLY . 25025 4 87 . 1 1 185 185 TYR N N 15 0.689467 0.028275 . . 185 TYR . 25025 4 88 . 1 1 187 187 ALA N N 15 0.69281 0.019281 . . 187 ALA . 25025 4 89 . 1 1 188 188 GLU N N 15 0.678152 0.006631 . . 188 GLU . 25025 4 90 . 1 1 190 190 GLY N N 15 0.754828 0.018432 . . 190 GLY . 25025 4 91 . 1 1 191 191 TYR N N 15 0.818393 0.024326 . . 191 TYR . 25025 4 92 . 1 1 199 199 GLU N N 15 0.701414 0.02273 . . 199 GLU . 25025 4 93 . 1 1 200 200 ARG N N 15 0.711407 0.011074 . . 200 ARG . 25025 4 94 . 1 1 201 201 VAL N N 15 0.672268 0.014737 . . 201 VAL . 25025 4 95 . 1 1 202 202 VAL N N 15 0.704056 0.015623 . . 202 VAL . 25025 4 96 . 1 1 203 203 LEU N N 15 0.584477 0.019524 . . 203 LEU . 25025 4 97 . 1 1 204 204 TRP N N 15 0.626403 0.013594 . . 204 TRP . 25025 4 98 . 1 1 205 205 ARG N N 15 0.674608 0.015181 . . 205 ARG . 25025 4 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID 25025 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 14 R1rho . . . 25025 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 9 9 ASP N N 15 18.1974 0.4667 . . . . 9 ASP . 25025 1 2 . 1 1 11 11 LYS N N 15 18.7823 0.8294 . . . . 11 LYS . 25025 1 3 . 1 1 12 12 THR N N 15 18.2696 0.7925 . . . . 12 THR . 25025 1 4 . 1 1 13 13 ALA N N 15 21.4013 1.0404 . . . . 13 ALA . 25025 1 5 . 1 1 14 14 ALA N N 15 19.8929 0.4017 . . . . 14 ALA . 25025 1 6 . 1 1 15 15 LEU N N 15 20.9297 2.3424 . . . . 15 LEU . 25025 1 7 . 1 1 16 16 LYS N N 15 20.3598 1.9256 . . . . 16 LYS . 25025 1 8 . 1 1 17 17 ARG N N 15 22.2933 0.7673 . . . . 17 ARG . 25025 1 9 . 1 1 19 19 SER N N 15 18.6415 1.4152 . . . . 19 SER . 25025 1 10 . 1 1 20 20 ILE N N 15 22.5657 3.2846 . . . . 20 ILE . 25025 1 11 . 1 1 21 21 ARG N N 15 19.6614 0.5985 . . . . 21 ARG . 25025 1 12 . 1 1 22 22 ARG N N 15 19.6216 2.7964 . . . . 22 ARG . 25025 1 13 . 1 1 23 23 TYR N N 15 18.1593 0.7176 . . . . 23 TYR . 25025 1 14 . 1 1 24 24 ARG N N 15 20.5762 3.4257 . . . . 24 ARG . 25025 1 15 . 1 1 26 26 ASP N N 15 17.9292 0.9823 . . . . 26 ASP . 25025 1 16 . 1 1 28 28 VAL N N 15 15.3797 0.8688 . . . . 28 VAL . 25025 1 17 . 1 1 32 32 LEU N N 15 19.2457 0.7434 . . . . 32 LEU . 25025 1 18 . 1 1 34 34 ARG N N 15 19.3916 0.8439 . . . . 34 ARG . 25025 1 19 . 1 1 40 40 ALA N N 15 18.2778 2.4374 . . . . 40 ALA . 25025 1 20 . 1 1 42 42 ARG N N 15 19.5431 0.8247 . . . . 42 ARG . 25025 1 21 . 1 1 43 43 ALA N N 15 20.6599 1.1576 . . . . 43 ALA . 25025 1 22 . 1 1 45 45 SER N N 15 17.7979 1.0198 . . . . 45 SER . 25025 1 23 . 1 1 48 48 ASN N N 15 19.8339 0.9749 . . . . 48 ASN . 25025 1 24 . 1 1 50 50 GLN N N 15 20.9443 2.0146 . . . . 50 GLN . 25025 1 25 . 1 1 52 52 TRP N N 15 17.3308 1.2722 . . . . 52 TRP . 25025 1 26 . 1 1 54 54 ILE N N 15 17.4444 1.6603 . . . . 54 ILE . 25025 1 27 . 1 1 55 55 VAL N N 15 18.6148 0.2842 . . . . 55 VAL . 25025 1 28 . 1 1 56 56 VAL N N 15 19.2542 0.9396 . . . . 56 VAL . 25025 1 29 . 1 1 57 57 VAL N N 15 17.6379 0.5328 . . . . 57 VAL . 25025 1 30 . 1 1 58 58 ARG N N 15 20.0035 0.7974 . . . . 58 ARG . 25025 1 31 . 1 1 62 62 THR N N 15 18.0325 0.7025 . . . . 62 THR . 25025 1 32 . 1 1 63 63 LYS N N 15 19.8798 1.8845 . . . . 63 LYS . 25025 1 33 . 1 1 64 64 ARG N N 15 19.0073 0.6488 . . . . 64 ARG . 25025 1 34 . 1 1 65 65 ALA N N 15 18.8879 0.2327 . . . . 65 ALA . 25025 1 35 . 1 1 66 66 LEU N N 15 17.4485 1.6218 . . . . 66 LEU . 25025 1 36 . 1 1 67 67 ARG N N 15 19.7695 2.4914 . . . . 67 ARG . 25025 1 37 . 1 1 70 70 ALA N N 15 18.666 0.4779 . . . . 70 ALA . 25025 1 38 . 1 1 71 71 PHE N N 15 18.6767 0.4496 . . . . 71 PHE . 25025 1 39 . 1 1 72 72 GLY N N 15 21.0035 2.4429 . . . . 72 GLY . 25025 1 40 . 1 1 73 73 GLN N N 15 21.1914 0.8135 . . . . 73 GLN . 25025 1 41 . 1 1 74 74 ALA N N 15 17.9918 2.8747 . . . . 74 ALA . 25025 1 42 . 1 1 75 75 HIS N N 15 18.7832 0.7158 . . . . 75 HIS . 25025 1 43 . 1 1 76 76 VAL N N 15 21.5437 1.0252 . . . . 76 VAL . 25025 1 44 . 1 1 78 78 GLU N N 15 19.2697 0.4694 . . . . 78 GLU . 25025 1 45 . 1 1 79 79 ALA N N 15 18.9149 0.2496 . . . . 79 ALA . 25025 1 46 . 1 1 81 81 VAL N N 15 18.3983 0.4432 . . . . 81 VAL . 25025 1 47 . 1 1 82 82 VAL N N 15 19.1516 2.1799 . . . . 82 VAL . 25025 1 48 . 1 1 85 85 LEU N N 15 17.2487 2.3638 . . . . 85 LEU . 25025 1 49 . 1 1 86 86 TYR N N 15 19.0952 0.7773 . . . . 86 TYR . 25025 1 50 . 1 1 87 87 ALA N N 15 20.5869 0.9447 . . . . 87 ALA . 25025 1 51 . 1 1 89 89 LEU N N 15 20.0236 0.5809 . . . . 89 LEU . 25025 1 52 . 1 1 90 90 GLU N N 15 19.4965 0.4986 . . . . 90 GLU . 25025 1 53 . 1 1 91 91 ASP N N 15 17.5248 1.1387 . . . . 91 ASP . 25025 1 54 . 1 1 93 93 LEU N N 15 22.0401 1.7146 . . . . 93 LEU . 25025 1 55 . 1 1 95 95 HIS N N 15 19.1104 0.7641 . . . . 95 HIS . 25025 1 56 . 1 1 96 96 LEU N N 15 18.4059 0.835 . . . . 96 LEU . 25025 1 57 . 1 1 98 98 GLU N N 15 19.6205 0.6767 . . . . 98 GLU . 25025 1 58 . 1 1 99 99 VAL N N 15 18.1819 0.424 . . . . 99 VAL . 25025 1 59 . 1 1 100 100 ILE N N 15 19.609 0.548 . . . . 100 ILE . 25025 1 60 . 1 1 105 105 GLN N N 15 17.0315 3.0674 . . . . 105 GLN . 25025 1 61 . 1 1 109 109 ARG N N 15 20.5936 0.8985 . . . . 109 ARG . 25025 1 62 . 1 1 110 110 GLU N N 15 19.3869 0.5573 . . . . 110 GLU . 25025 1 63 . 1 1 113 113 LYS N N 15 19.3728 0.7347 . . . . 113 LYS . 25025 1 64 . 1 1 115 115 ALA N N 15 19.4146 0.437 . . . . 115 ALA . 25025 1 65 . 1 1 117 117 GLN N N 15 20.9882 0.494 . . . . 117 GLN . 25025 1 66 . 1 1 118 118 ARG N N 15 18.1134 0.5083 . . . . 118 ARG . 25025 1 67 . 1 1 120 120 PHE N N 15 18.5439 0.5248 . . . . 120 PHE . 25025 1 68 . 1 1 121 121 ALA N N 15 18.0061 0.5495 . . . . 121 ALA . 25025 1 69 . 1 1 128 128 ARG N N 15 18.939 0.6844 . . . . 128 ARG . 25025 1 70 . 1 1 129 129 LYS N N 15 19.8609 1.3073 . . . . 129 LYS . 25025 1 71 . 1 1 130 130 ALA N N 15 18.2924 1.0306 . . . . 130 ALA . 25025 1 72 . 1 1 131 131 TRP N N 15 18.8585 0.7581 . . . . 131 TRP . 25025 1 73 . 1 1 132 132 ALA N N 15 20.9676 1.2133 . . . . 132 ALA . 25025 1 74 . 1 1 133 133 SER N N 15 19.6414 1.0071 . . . . 133 SER . 25025 1 75 . 1 1 134 134 GLY N N 15 18.8792 1.5353 . . . . 134 GLY . 25025 1 76 . 1 1 135 135 GLN N N 15 18.7985 1.2234 . . . . 135 GLN . 25025 1 77 . 1 1 136 136 SER N N 15 18.3143 0.6407 . . . . 136 SER . 25025 1 78 . 1 1 139 139 LEU N N 15 14.7432 4.8703 . . . . 139 LEU . 25025 1 79 . 1 1 141 141 GLY N N 15 20.0694 3.9002 . . . . 141 GLY . 25025 1 80 . 1 1 143 143 LEU N N 15 19.8317 0.7457 . . . . 143 LEU . 25025 1 81 . 1 1 144 144 LEU N N 15 19.968 1.4173 . . . . 144 LEU . 25025 1 82 . 1 1 145 145 LEU N N 15 21.2248 1.5696 . . . . 145 LEU . 25025 1 83 . 1 1 146 146 LEU N N 15 19.5298 1.0938 . . . . 146 LEU . 25025 1 84 . 1 1 147 147 LEU N N 15 21.0276 0.6883 . . . . 147 LEU . 25025 1 85 . 1 1 148 148 GLU N N 15 20.4419 0.9077 . . . . 148 GLU . 25025 1 86 . 1 1 149 149 ALA N N 15 23.9099 3.0211 . . . . 149 ALA . 25025 1 87 . 1 1 151 151 GLY N N 15 19.4078 0.595 . . . . 151 GLY . 25025 1 88 . 1 1 152 152 LEU N N 15 19.4926 1.0301 . . . . 152 LEU . 25025 1 89 . 1 1 153 153 GLY N N 15 18.2352 0.6419 . . . . 153 GLY . 25025 1 90 . 1 1 154 154 SER N N 15 18.4613 0.5149 . . . . 154 SER . 25025 1 91 . 1 1 155 155 VAL N N 15 17.0701 3.2545 . . . . 155 VAL . 25025 1 92 . 1 1 166 166 ARG N N 15 16.4657 1.2777 . . . . 166 ARG . 25025 1 93 . 1 1 168 168 ILE N N 15 20.5047 1.5762 . . . . 168 ILE . 25025 1 94 . 1 1 169 169 LEU N N 15 19.1846 0.9901 . . . . 169 LEU . 25025 1 95 . 1 1 170 170 GLY N N 15 19.2469 0.4759 . . . . 170 GLY . 25025 1 96 . 1 1 175 175 ALA N N 15 18.9783 0.7247 . . . . 175 ALA . 25025 1 97 . 1 1 180 180 LEU N N 15 19.7174 0.7001 . . . . 180 LEU . 25025 1 98 . 1 1 181 181 VAL N N 15 18.5465 0.3626 . . . . 181 VAL . 25025 1 99 . 1 1 182 182 ALA N N 15 19.3254 0.8446 . . . . 182 ALA . 25025 1 100 . 1 1 183 183 LEU N N 15 16.8452 1.6417 . . . . 183 LEU . 25025 1 101 . 1 1 184 184 GLY N N 15 18.8739 0.7462 . . . . 184 GLY . 25025 1 102 . 1 1 185 185 TYR N N 15 19.9525 0.8445 . . . . 185 TYR . 25025 1 103 . 1 1 187 187 ALA N N 15 16.1215 4.0926 . . . . 187 ALA . 25025 1 104 . 1 1 188 188 GLU N N 15 16.808 0.2886 . . . . 188 GLU . 25025 1 105 . 1 1 190 190 GLY N N 15 16.7836 0.7434 . . . . 190 GLY . 25025 1 106 . 1 1 191 191 TYR N N 15 16.1935 0.6402 . . . . 191 TYR . 25025 1 107 . 1 1 193 193 SER N N 15 13.9448 0.9007 . . . . 193 SER . 25025 1 108 . 1 1 196 196 LEU N N 15 22.1783 1.1602 . . . . 196 LEU . 25025 1 109 . 1 1 199 199 GLU N N 15 18.1328 0.4109 . . . . 199 GLU . 25025 1 110 . 1 1 200 200 ARG N N 15 18.0117 0.8624 . . . . 200 ARG . 25025 1 111 . 1 1 201 201 VAL N N 15 18.3345 0.6821 . . . . 201 VAL . 25025 1 112 . 1 1 202 202 VAL N N 15 17.1865 0.6156 . . . . 202 VAL . 25025 1 113 . 1 1 203 203 LEU N N 15 17.6037 0.9448 . . . . 203 LEU . 25025 1 114 . 1 1 204 204 TRP N N 15 17.4912 0.3366 . . . . 204 TRP . 25025 1 115 . 1 1 205 205 ARG N N 15 17.7139 0.337 . . . . 205 ARG . 25025 1 stop_ save_ save_heteronuclear_T2_list_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_2 _Heteronucl_T2_list.Entry_ID 25025 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 14 R1rho . . . 25025 2 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 9 9 ASP N N 15 19.366 0.7844 . . . . 9 ASP . 25025 2 2 . 1 1 13 13 ALA N N 15 19.8287 0.9795 . . . . 13 ALA . 25025 2 3 . 1 1 14 14 ALA N N 15 20.6154 0.5768 . . . . 14 ALA . 25025 2 4 . 1 1 15 15 LEU N N 15 19.67 4.9384 . . . . 15 LEU . 25025 2 5 . 1 1 16 16 LYS N N 15 19.0492 7.6956 . . . . 16 LYS . 25025 2 6 . 1 1 17 17 ARG N N 15 24.2411 1.7343 . . . . 17 ARG . 25025 2 7 . 1 1 20 20 ILE N N 15 24.472 7.2552 . . . . 20 ILE . 25025 2 8 . 1 1 23 23 TYR N N 15 17.6427 0.7454 . . . . 23 TYR . 25025 2 9 . 1 1 24 24 ARG N N 15 24.3156 5.6126 . . . . 24 ARG . 25025 2 10 . 1 1 26 26 ASP N N 15 19.0915 1.3492 . . . . 26 ASP . 25025 2 11 . 1 1 28 28 VAL N N 15 19.0747 3.0929 . . . . 28 VAL . 25025 2 12 . 1 1 32 32 LEU N N 15 19.69 1.5106 . . . . 32 LEU . 25025 2 13 . 1 1 34 34 ARG N N 15 20.9128 1.3109 . . . . 34 ARG . 25025 2 14 . 1 1 40 40 ALA N N 15 22.4674 3.8614 . . . . 40 ALA . 25025 2 15 . 1 1 42 42 ARG N N 15 20.3458 1.0774 . . . . 42 ARG . 25025 2 16 . 1 1 43 43 ALA N N 15 24.4807 2.1568 . . . . 43 ALA . 25025 2 17 . 1 1 45 45 SER N N 15 22.4239 1.5355 . . . . 45 SER . 25025 2 18 . 1 1 48 48 ASN N N 15 26.4934 2.2013 . . . . 48 ASN . 25025 2 19 . 1 1 50 50 GLN N N 15 25.1555 3.9247 . . . . 50 GLN . 25025 2 20 . 1 1 52 52 TRP N N 15 17.7319 2.013 . . . . 52 TRP . 25025 2 21 . 1 1 54 54 ILE N N 15 20.2083 5.6636 . . . . 54 ILE . 25025 2 22 . 1 1 55 55 VAL N N 15 19.7972 0.9649 . . . . 55 VAL . 25025 2 23 . 1 1 56 56 VAL N N 15 19.5044 0.7853 . . . . 56 VAL . 25025 2 24 . 1 1 57 57 VAL N N 15 18.9198 1.0775 . . . . 57 VAL . 25025 2 25 . 1 1 62 62 THR N N 15 18.6274 1.6522 . . . . 62 THR . 25025 2 26 . 1 1 63 63 LYS N N 15 18.1297 2.4715 . . . . 63 LYS . 25025 2 27 . 1 1 64 64 ARG N N 15 19.6228 1.1355 . . . . 64 ARG . 25025 2 28 . 1 1 65 65 ALA N N 15 18.7796 0.8493 . . . . 65 ALA . 25025 2 29 . 1 1 66 66 LEU N N 15 24.6431 5.4702 . . . . 66 LEU . 25025 2 30 . 1 1 67 67 ARG N N 15 21.3061 3.8565 . . . . 67 ARG . 25025 2 31 . 1 1 70 70 ALA N N 15 18.817 1.3044 . . . . 70 ALA . 25025 2 32 . 1 1 76 76 VAL N N 15 18.8134 2.0151 . . . . 76 VAL . 25025 2 33 . 1 1 79 79 ALA N N 15 19.2989 0.7721 . . . . 79 ALA . 25025 2 34 . 1 1 81 81 VAL N N 15 17.7918 0.929 . . . . 81 VAL . 25025 2 35 . 1 1 82 82 VAL N N 15 12.7346 2.2407 . . . . 82 VAL . 25025 2 36 . 1 1 85 85 LEU N N 15 21.6529 1.9948 . . . . 85 LEU . 25025 2 37 . 1 1 86 86 TYR N N 15 18.4743 0.8131 . . . . 86 TYR . 25025 2 38 . 1 1 87 87 ALA N N 15 19.9503 1.7032 . . . . 87 ALA . 25025 2 39 . 1 1 89 89 LEU N N 15 16.958 0.8202 . . . . 89 LEU . 25025 2 40 . 1 1 90 90 GLU N N 15 18.053 1.1052 . . . . 90 GLU . 25025 2 41 . 1 1 91 91 ASP N N 15 22.124 3.1917 . . . . 91 ASP . 25025 2 42 . 1 1 93 93 LEU N N 15 18.6719 3.2128 . . . . 93 LEU . 25025 2 43 . 1 1 95 95 HIS N N 15 16.8122 0.8797 . . . . 95 HIS . 25025 2 44 . 1 1 96 96 LEU N N 15 20.0895 2.7177 . . . . 96 LEU . 25025 2 45 . 1 1 98 98 GLU N N 15 19.1032 1.0922 . . . . 98 GLU . 25025 2 46 . 1 1 99 99 VAL N N 15 18.8253 1.4802 . . . . 99 VAL . 25025 2 47 . 1 1 100 100 ILE N N 15 19.3028 1.5169 . . . . 100 ILE . 25025 2 48 . 1 1 110 110 GLU N N 15 18.785 0.6795 . . . . 110 GLU . 25025 2 49 . 1 1 113 113 LYS N N 15 18.9485 1.0973 . . . . 113 LYS . 25025 2 50 . 1 1 115 115 ALA N N 15 20.1035 0.905 . . . . 115 ALA . 25025 2 51 . 1 1 117 117 GLN N N 15 19.4353 0.8316 . . . . 117 GLN . 25025 2 52 . 1 1 118 118 ARG N N 15 17.9928 1.3128 . . . . 118 ARG . 25025 2 53 . 1 1 120 120 PHE N N 15 19.2924 1.2396 . . . . 120 PHE . 25025 2 54 . 1 1 121 121 ALA N N 15 20.2463 0.8534 . . . . 121 ALA . 25025 2 55 . 1 1 128 128 ARG N N 15 18.154 1.2267 . . . . 128 ARG . 25025 2 56 . 1 1 129 129 LYS N N 15 25.2333 5.9712 . . . . 129 LYS . 25025 2 57 . 1 1 130 130 ALA N N 15 20.3837 2.2639 . . . . 130 ALA . 25025 2 58 . 1 1 131 131 TRP N N 15 18.2128 0.4954 . . . . 131 TRP . 25025 2 59 . 1 1 132 132 ALA N N 15 20.7328 1.4114 . . . . 132 ALA . 25025 2 60 . 1 1 133 133 SER N N 15 20.8762 1.3919 . . . . 133 SER . 25025 2 61 . 1 1 134 134 GLY N N 15 19.42 1.5512 . . . . 134 GLY . 25025 2 62 . 1 1 135 135 GLN N N 15 18.0151 1.0718 . . . . 135 GLN . 25025 2 63 . 1 1 136 136 SER N N 15 19.7497 1.0065 . . . . 136 SER . 25025 2 64 . 1 1 141 141 GLY N N 15 22.1043 2.8999 . . . . 141 GLY . 25025 2 65 . 1 1 143 143 LEU N N 15 20.2981 0.6754 . . . . 143 LEU . 25025 2 66 . 1 1 144 144 LEU N N 15 20.977 0.7823 . . . . 144 LEU . 25025 2 67 . 1 1 145 145 LEU N N 15 21.4316 1.2551 . . . . 145 LEU . 25025 2 68 . 1 1 146 146 LEU N N 15 24.3679 5.1023 . . . . 146 LEU . 25025 2 69 . 1 1 147 147 LEU N N 15 19.6667 1.1511 . . . . 147 LEU . 25025 2 70 . 1 1 148 148 GLU N N 15 22.4571 1.341 . . . . 148 GLU . 25025 2 71 . 1 1 149 149 ALA N N 15 16.9268 7.2082 . . . . 149 ALA . 25025 2 72 . 1 1 151 151 GLY N N 15 19.9872 4.0072 . . . . 151 GLY . 25025 2 73 . 1 1 152 152 LEU N N 15 19.1588 1.3763 . . . . 152 LEU . 25025 2 74 . 1 1 153 153 GLY N N 15 19.9475 0.9003 . . . . 153 GLY . 25025 2 75 . 1 1 154 154 SER N N 15 18.6642 1.6389 . . . . 154 SER . 25025 2 76 . 1 1 155 155 VAL N N 15 23.6103 2.3542 . . . . 155 VAL . 25025 2 77 . 1 1 166 166 ARG N N 15 21.2407 7.0553 . . . . 166 ARG . 25025 2 78 . 1 1 168 168 ILE N N 15 14.1876 5.2544 . . . . 168 ILE . 25025 2 79 . 1 1 169 169 LEU N N 15 18.837 0.6158 . . . . 169 LEU . 25025 2 80 . 1 1 170 170 GLY N N 15 19.5252 0.6372 . . . . 170 GLY . 25025 2 81 . 1 1 175 175 ALA N N 15 19.3051 0.6565 . . . . 175 ALA . 25025 2 82 . 1 1 180 180 LEU N N 15 18.8249 0.9477 . . . . 180 LEU . 25025 2 83 . 1 1 181 181 VAL N N 15 16.917 0.55 . . . . 181 VAL . 25025 2 84 . 1 1 182 182 ALA N N 15 22.3002 1.0489 . . . . 182 ALA . 25025 2 85 . 1 1 183 183 LEU N N 15 22.1137 2.8641 . . . . 183 LEU . 25025 2 86 . 1 1 184 184 GLY N N 15 26.5209 4.8501 . . . . 184 GLY . 25025 2 87 . 1 1 185 185 TYR N N 15 17.9456 1.2784 . . . . 185 TYR . 25025 2 88 . 1 1 187 187 ALA N N 15 15.7185 5.8742 . . . . 187 ALA . 25025 2 89 . 1 1 188 188 GLU N N 15 17.3894 0.5693 . . . . 188 GLU . 25025 2 90 . 1 1 190 190 GLY N N 15 19.7568 3.0565 . . . . 190 GLY . 25025 2 91 . 1 1 191 191 TYR N N 15 17.453 2.2911 . . . . 191 TYR . 25025 2 92 . 1 1 199 199 GLU N N 15 21.0017 2.0433 . . . . 199 GLU . 25025 2 93 . 1 1 200 200 ARG N N 15 19.2514 2.0173 . . . . 200 ARG . 25025 2 94 . 1 1 201 201 VAL N N 15 17.9942 1.8093 . . . . 201 VAL . 25025 2 95 . 1 1 202 202 VAL N N 15 16.5219 1.5481 . . . . 202 VAL . 25025 2 96 . 1 1 203 203 LEU N N 15 21.3019 1.322 . . . . 203 LEU . 25025 2 97 . 1 1 204 204 TRP N N 15 20.012 0.7007 . . . . 204 TRP . 25025 2 98 . 1 1 205 205 ARG N N 15 19.3527 0.4195 . . . . 205 ARG . 25025 2 stop_ save_ save_heteronuclear_T2_list_3 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_3 _Heteronucl_T2_list.Entry_ID 25025 _Heteronucl_T2_list.ID 3 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 14 R1rho . . . 25025 3 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 9 9 ASP N N 15 23.9662 0.9623 . . . . 9 ASP . 25025 3 2 . 1 1 11 11 LYS N N 15 24.3985 1.4137 . . . . 11 LYS . 25025 3 3 . 1 1 12 12 THR N N 15 25.9020 1.2222 . . . . 12 THR . 25025 3 4 . 1 1 13 13 ALA N N 15 27.8382 0.8385 . . . . 13 ALA . 25025 3 5 . 1 1 14 14 ALA N N 15 26.8137 1.1928 . . . . 14 ALA . 25025 3 6 . 1 1 15 15 LEU N N 15 25.0382 1.1287 . . . . 15 LEU . 25025 3 7 . 1 1 16 16 LYS N N 15 25.0733 0.6240 . . . . 16 LYS . 25025 3 8 . 1 1 17 17 ARG N N 15 25.4484 1.0126 . . . . 17 ARG . 25025 3 9 . 1 1 19 19 SER N N 15 24.5119 1.3373 . . . . 19 SER . 25025 3 10 . 1 1 20 20 ILE N N 15 25.5043 1.4978 . . . . 20 ILE . 25025 3 11 . 1 1 21 21 ARG N N 15 23.8855 1.5325 . . . . 21 ARG . 25025 3 12 . 1 1 22 22 ARG N N 15 23.4080 0.8698 . . . . 22 ARG . 25025 3 13 . 1 1 23 23 TYR N N 15 24.4599 1.1851 . . . . 23 TYR . 25025 3 14 . 1 1 24 24 ARG N N 15 26.0756 0.8282 . . . . 24 ARG . 25025 3 15 . 1 1 26 26 ASP N N 15 22.3770 0.7469 . . . . 26 ASP . 25025 3 16 . 1 1 28 28 VAL N N 15 22.2639 0.8584 . . . . 28 VAL . 25025 3 17 . 1 1 32 32 LEU N N 15 24.9076 1.3993 . . . . 32 LEU . 25025 3 18 . 1 1 34 34 ARG N N 15 25.5538 0.9614 . . . . 34 ARG . 25025 3 19 . 1 1 40 40 ALA N N 15 27.2498 0.7622 . . . . 40 ALA . 25025 3 20 . 1 1 42 42 ARG N N 15 25.6596 0.9917 . . . . 42 ARG . 25025 3 21 . 1 1 43 43 ALA N N 15 28.9059 0.8753 . . . . 43 ALA . 25025 3 22 . 1 1 45 45 SER N N 15 25.0961 1.7332 . . . . 45 SER . 25025 3 23 . 1 1 48 48 ASN N N 15 27.2105 0.6674 . . . . 48 ASN . 25025 3 24 . 1 1 50 50 GLN N N 15 27.2845 1.5033 . . . . 50 GLN . 25025 3 25 . 1 1 52 52 TRP N N 15 25.9599 1.5035 . . . . 52 TRP . 25025 3 26 . 1 1 54 54 ILE N N 15 23.8439 0.9246 . . . . 54 ILE . 25025 3 27 . 1 1 55 55 VAL N N 15 24.0740 0.7672 . . . . 55 VAL . 25025 3 28 . 1 1 56 56 VAL N N 15 25.7138 0.6816 . . . . 56 VAL . 25025 3 29 . 1 1 57 57 VAL N N 15 24.8323 0.7219 . . . . 57 VAL . 25025 3 30 . 1 1 58 58 ARG N N 15 23.2443 1.3239 . . . . 58 ARG . 25025 3 31 . 1 1 62 62 THR N N 15 24.2882 0.8265 . . . . 62 THR . 25025 3 32 . 1 1 63 63 LYS N N 15 23.9117 0.7935 . . . . 63 LYS . 25025 3 33 . 1 1 64 64 ARG N N 15 25.3741 1.1021 . . . . 64 ARG . 25025 3 34 . 1 1 65 65 ALA N N 15 25.3627 0.9766 . . . . 65 ALA . 25025 3 35 . 1 1 66 66 LEU N N 15 25.2403 0.8975 . . . . 66 LEU . 25025 3 36 . 1 1 67 67 ARG N N 15 24.3019 0.7548 . . . . 67 ARG . 25025 3 37 . 1 1 70 70 ALA N N 15 25.1656 0.8759 . . . . 70 ALA . 25025 3 38 . 1 1 71 71 PHE N N 15 25.4217 1.1964 . . . . 71 PHE . 25025 3 39 . 1 1 72 72 GLY N N 15 27.6353 1.3129 . . . . 72 GLY . 25025 3 40 . 1 1 73 73 GLN N N 15 25.5136 1.2735 . . . . 73 GLN . 25025 3 41 . 1 1 74 74 ALA N N 15 29.9409 1.3841 . . . . 74 ALA . 25025 3 42 . 1 1 75 75 HIS N N 15 26.2592 0.8069 . . . . 75 HIS . 25025 3 43 . 1 1 76 76 VAL N N 15 27.0145 1.9009 . . . . 76 VAL . 25025 3 44 . 1 1 78 78 GLU N N 15 23.0016 1.3257 . . . . 78 GLU . 25025 3 45 . 1 1 79 79 ALA N N 15 25.5794 0.8539 . . . . 79 ALA . 25025 3 46 . 1 1 81 81 VAL N N 15 23.8154 0.7715 . . . . 81 VAL . 25025 3 47 . 1 1 82 82 VAL N N 15 25.1831 0.6434 . . . . 82 VAL . 25025 3 48 . 1 1 85 85 LEU N N 15 26.2570 0.5202 . . . . 85 LEU . 25025 3 49 . 1 1 86 86 TYR N N 15 26.0457 0.8754 . . . . 86 TYR . 25025 3 50 . 1 1 87 87 ALA N N 15 25.3064 0.8853 . . . . 87 ALA . 25025 3 51 . 1 1 89 89 LEU N N 15 24.6198 0.7449 . . . . 89 LEU . 25025 3 52 . 1 1 90 90 GLU N N 15 25.4578 1.0099 . . . . 90 GLU . 25025 3 53 . 1 1 91 91 ASP N N 15 25.3186 1.0732 . . . . 91 ASP . 25025 3 54 . 1 1 93 93 LEU N N 15 25.8331 1.4394 . . . . 93 LEU . 25025 3 55 . 1 1 95 95 HIS N N 15 23.3119 1.0515 . . . . 95 HIS . 25025 3 56 . 1 1 96 96 LEU N N 15 24.4994 1.1105 . . . . 96 LEU . 25025 3 57 . 1 1 98 98 GLU N N 15 23.9028 0.8253 . . . . 98 GLU . 25025 3 58 . 1 1 99 99 VAL N N 15 24.8250 1.4223 . . . . 99 VAL . 25025 3 59 . 1 1 100 100 ILE N N 15 25.3495 0.8086 . . . . 100 ILE . 25025 3 60 . 1 1 105 105 GLN N N 15 20.7957 0.9741 . . . . 105 GLN . 25025 3 61 . 1 1 109 109 ARG N N 15 25.9072 2.1539 . . . . 109 ARG . 25025 3 62 . 1 1 110 110 GLU N N 15 26.5568 0.9604 . . . . 110 GLU . 25025 3 63 . 1 1 113 113 LYS N N 15 25.3585 0.6951 . . . . 113 LYS . 25025 3 64 . 1 1 115 115 ALA N N 15 26.2831 0.9009 . . . . 115 ALA . 25025 3 65 . 1 1 117 117 GLN N N 15 25.0484 1.3461 . . . . 117 GLN . 25025 3 66 . 1 1 118 118 ARG N N 15 25.2143 0.7441 . . . . 118 ARG . 25025 3 67 . 1 1 120 120 PHE N N 15 22.4204 0.5318 . . . . 120 PHE . 25025 3 68 . 1 1 121 121 ALA N N 15 25.4285 0.8987 . . . . 121 ALA . 25025 3 69 . 1 1 128 128 ARG N N 15 24.5984 0.7239 . . . . 128 ARG . 25025 3 70 . 1 1 129 129 LYS N N 15 25.1645 0.7514 . . . . 129 LYS . 25025 3 71 . 1 1 130 130 ALA N N 15 25.7856 0.8532 . . . . 130 ALA . 25025 3 72 . 1 1 131 131 TRP N N 15 25.7568 0.9374 . . . . 131 TRP . 25025 3 73 . 1 1 132 132 ALA N N 15 26.0820 0.5903 . . . . 132 ALA . 25025 3 74 . 1 1 133 133 SER N N 15 25.0249 1.1598 . . . . 133 SER . 25025 3 75 . 1 1 134 134 GLY N N 15 25.8611 1.1924 . . . . 134 GLY . 25025 3 76 . 1 1 135 135 GLN N N 15 23.9556 1.8340 . . . . 135 GLN . 25025 3 77 . 1 1 136 136 SER N N 15 24.9776 0.9784 . . . . 136 SER . 25025 3 78 . 1 1 139 139 LEU N N 15 25.8282 3.9954 . . . . 139 LEU . 25025 3 79 . 1 1 141 141 GLY N N 15 25.6012 0.7664 . . . . 141 GLY . 25025 3 80 . 1 1 143 143 LEU N N 15 24.5337 0.9023 . . . . 143 LEU . 25025 3 81 . 1 1 144 144 LEU N N 15 26.3789 0.9115 . . . . 144 LEU . 25025 3 82 . 1 1 145 145 LEU N N 15 28.6530 1.3206 . . . . 145 LEU . 25025 3 83 . 1 1 146 146 LEU N N 15 26.2168 0.9535 . . . . 146 LEU . 25025 3 84 . 1 1 147 147 LEU N N 15 25.1748 1.3161 . . . . 147 LEU . 25025 3 85 . 1 1 148 148 GLU N N 15 25.9421 1.0479 . . . . 148 GLU . 25025 3 86 . 1 1 149 149 ALA N N 15 25.9857 0.8346 . . . . 149 ALA . 25025 3 87 . 1 1 151 151 GLY N N 15 26.5126 0.9859 . . . . 151 GLY . 25025 3 88 . 1 1 152 152 LEU N N 15 26.4933 0.8774 . . . . 152 LEU . 25025 3 89 . 1 1 153 153 GLY N N 15 23.7641 0.5954 . . . . 153 GLY . 25025 3 90 . 1 1 154 154 SER N N 15 24.5450 0.9643 . . . . 154 SER . 25025 3 91 . 1 1 155 155 VAL N N 15 25.7677 1.0778 . . . . 155 VAL . 25025 3 92 . 1 1 166 166 ARG N N 15 25.1718 0.9004 . . . . 166 ARG . 25025 3 93 . 1 1 168 168 ILE N N 15 25.2333 1.0453 . . . . 168 ILE . 25025 3 94 . 1 1 169 169 LEU N N 15 23.6375 0.8790 . . . . 169 LEU . 25025 3 95 . 1 1 170 170 GLY N N 15 25.3046 1.0273 . . . . 170 GLY . 25025 3 96 . 1 1 175 175 ALA N N 15 24.8780 0.8331 . . . . 175 ALA . 25025 3 97 . 1 1 180 180 LEU N N 15 24.7966 1.0271 . . . . 180 LEU . 25025 3 98 . 1 1 181 181 VAL N N 15 23.5220 0.8976 . . . . 181 VAL . 25025 3 99 . 1 1 182 182 ALA N N 15 25.4125 0.6141 . . . . 182 ALA . 25025 3 100 . 1 1 183 183 LEU N N 15 25.8835 1.4759 . . . . 183 LEU . 25025 3 101 . 1 1 184 184 GLY N N 15 23.4542 1.0871 . . . . 184 GLY . 25025 3 102 . 1 1 185 185 TYR N N 15 25.7832 0.6957 . . . . 185 TYR . 25025 3 103 . 1 1 187 187 ALA N N 15 24.5181 0.8335 . . . . 187 ALA . 25025 3 104 . 1 1 188 188 GLU N N 15 23.3003 0.8671 . . . . 188 GLU . 25025 3 105 . 1 1 190 190 GLY N N 15 24.0553 1.2264 . . . . 190 GLY . 25025 3 106 . 1 1 191 191 TYR N N 15 21.5551 0.9271 . . . . 191 TYR . 25025 3 107 . 1 1 193 193 SER N N 15 20.4573 0.8213 . . . . 193 SER . 25025 3 108 . 1 1 196 196 LEU N N 15 25.6603 0.9871 . . . . 196 LEU . 25025 3 109 . 1 1 199 199 GLU N N 15 24.2586 0.9144 . . . . 199 GLU . 25025 3 110 . 1 1 200 200 ARG N N 15 24.9176 0.9574 . . . . 200 ARG . 25025 3 111 . 1 1 201 201 VAL N N 15 22.7262 1.2582 . . . . 201 VAL . 25025 3 112 . 1 1 202 202 VAL N N 15 24.6068 0.6681 . . . . 202 VAL . 25025 3 113 . 1 1 203 203 LEU N N 15 24.7162 0.9184 . . . . 203 LEU . 25025 3 114 . 1 1 204 204 TRP N N 15 24.3724 0.8100 . . . . 204 TRP . 25025 3 115 . 1 1 205 205 ARG N N 15 24.9701 0.3927 . . . . 205 ARG . 25025 3 stop_ save_ save_heteronuclear_T2_list_4 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_4 _Heteronucl_T2_list.Entry_ID 25025 _Heteronucl_T2_list.ID 4 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 14 R1rho . . . 25025 4 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 9 9 ASP N N 15 21.7964 0.5335 . . . . 9 ASP . 25025 4 2 . 1 1 13 13 ALA N N 15 24.831 0.7638 . . . . 13 ALA . 25025 4 3 . 1 1 14 14 ALA N N 15 24.7889 0.6282 . . . . 14 ALA . 25025 4 4 . 1 1 15 15 LEU N N 15 22.9481 0.8048 . . . . 15 LEU . 25025 4 5 . 1 1 16 16 LYS N N 15 25.1175 0.8499 . . . . 16 LYS . 25025 4 6 . 1 1 17 17 ARG N N 15 26.0247 0.9164 . . . . 17 ARG . 25025 4 7 . 1 1 20 20 ILE N N 15 23.517 1.3884 . . . . 20 ILE . 25025 4 8 . 1 1 23 23 TYR N N 15 25.9435 1.0882 . . . . 23 TYR . 25025 4 9 . 1 1 24 24 ARG N N 15 24.6549 0.9738 . . . . 24 ARG . 25025 4 10 . 1 1 26 26 ASP N N 15 19.9933 1.0958 . . . . 26 ASP . 25025 4 11 . 1 1 28 28 VAL N N 15 20.3221 0.4996 . . . . 28 VAL . 25025 4 12 . 1 1 32 32 LEU N N 15 25.2639 0.9426 . . . . 32 LEU . 25025 4 13 . 1 1 34 34 ARG N N 15 24.4639 0.5356 . . . . 34 ARG . 25025 4 14 . 1 1 40 40 ALA N N 15 21.6507 0.6945 . . . . 40 ALA . 25025 4 15 . 1 1 42 42 ARG N N 15 23.7514 0.6675 . . . . 42 ARG . 25025 4 16 . 1 1 43 43 ALA N N 15 27.1422 0.7483 . . . . 43 ALA . 25025 4 17 . 1 1 45 45 SER N N 15 20.922 1.0162 . . . . 45 SER . 25025 4 18 . 1 1 48 48 ASN N N 15 25.7627 1.2375 . . . . 48 ASN . 25025 4 19 . 1 1 50 50 GLN N N 15 24.4686 1.6093 . . . . 50 GLN . 25025 4 20 . 1 1 52 52 TRP N N 15 23.827 0.8632 . . . . 52 TRP . 25025 4 21 . 1 1 54 54 ILE N N 15 23.3892 0.6062 . . . . 54 ILE . 25025 4 22 . 1 1 55 55 VAL N N 15 22.9367 0.9927 . . . . 55 VAL . 25025 4 23 . 1 1 56 56 VAL N N 15 23.6508 0.4766 . . . . 56 VAL . 25025 4 24 . 1 1 57 57 VAL N N 15 24.0303 0.5879 . . . . 57 VAL . 25025 4 25 . 1 1 62 62 THR N N 15 23.5085 0.5796 . . . . 62 THR . 25025 4 26 . 1 1 63 63 LYS N N 15 24.1923 0.876 . . . . 63 LYS . 25025 4 27 . 1 1 64 64 ARG N N 15 24.5543 0.6204 . . . . 64 ARG . 25025 4 28 . 1 1 65 65 ALA N N 15 24.8108 0.4403 . . . . 65 ALA . 25025 4 29 . 1 1 66 66 LEU N N 15 23.2668 0.8753 . . . . 66 LEU . 25025 4 30 . 1 1 67 67 ARG N N 15 24.7987 1.0658 . . . . 67 ARG . 25025 4 31 . 1 1 70 70 ALA N N 15 24.3015 0.6833 . . . . 70 ALA . 25025 4 32 . 1 1 76 76 VAL N N 15 26.3526 0.7533 . . . . 76 VAL . 25025 4 33 . 1 1 79 79 ALA N N 15 24.688 0.7505 . . . . 79 ALA . 25025 4 34 . 1 1 81 81 VAL N N 15 22.5319 0.6733 . . . . 81 VAL . 25025 4 35 . 1 1 82 82 VAL N N 15 24.8028 0.4432 . . . . 82 VAL . 25025 4 36 . 1 1 85 85 LEU N N 15 26.6699 1.0071 . . . . 85 LEU . 25025 4 37 . 1 1 86 86 TYR N N 15 23.2844 0.8939 . . . . 86 TYR . 25025 4 38 . 1 1 87 87 ALA N N 15 24.758 1.0564 . . . . 87 ALA . 25025 4 39 . 1 1 89 89 LEU N N 15 23.1194 1.1092 . . . . 89 LEU . 25025 4 40 . 1 1 90 90 GLU N N 15 23.4412 1.3039 . . . . 90 GLU . 25025 4 41 . 1 1 91 91 ASP N N 15 26.2282 1.0874 . . . . 91 ASP . 25025 4 42 . 1 1 93 93 LEU N N 15 24.4217 1.0157 . . . . 93 LEU . 25025 4 43 . 1 1 95 95 HIS N N 15 22.1142 0.6798 . . . . 95 HIS . 25025 4 44 . 1 1 96 96 LEU N N 15 24.7853 3.6082 . . . . 96 LEU . 25025 4 45 . 1 1 98 98 GLU N N 15 22.1484 0.9266 . . . . 98 GLU . 25025 4 46 . 1 1 99 99 VAL N N 15 21.2318 0.9272 . . . . 99 VAL . 25025 4 47 . 1 1 100 100 ILE N N 15 27.7807 1.2538 . . . . 100 ILE . 25025 4 48 . 1 1 110 110 GLU N N 15 24.4981 1.2228 . . . . 110 GLU . 25025 4 49 . 1 1 113 113 LYS N N 15 22.2143 1.2089 . . . . 113 LYS . 25025 4 50 . 1 1 115 115 ALA N N 15 25.5694 0.9616 . . . . 115 ALA . 25025 4 51 . 1 1 117 117 GLN N N 15 23.2247 0.7248 . . . . 117 GLN . 25025 4 52 . 1 1 118 118 ARG N N 15 24.2867 0.7778 . . . . 118 ARG . 25025 4 53 . 1 1 120 120 PHE N N 15 21.3628 0.6187 . . . . 120 PHE . 25025 4 54 . 1 1 121 121 ALA N N 15 24.4787 0.6618 . . . . 121 ALA . 25025 4 55 . 1 1 128 128 ARG N N 15 24.0559 0.9787 . . . . 128 ARG . 25025 4 56 . 1 1 129 129 LYS N N 15 23.029 1.9343 . . . . 129 LYS . 25025 4 57 . 1 1 130 130 ALA N N 15 23.9662 0.4963 . . . . 130 ALA . 25025 4 58 . 1 1 131 131 TRP N N 15 26.112 1.8125 . . . . 131 TRP . 25025 4 59 . 1 1 132 132 ALA N N 15 27.3493 0.7312 . . . . 132 ALA . 25025 4 60 . 1 1 133 133 SER N N 15 22.1744 0.8646 . . . . 133 SER . 25025 4 61 . 1 1 134 134 GLY N N 15 22.8932 0.6584 . . . . 134 GLY . 25025 4 62 . 1 1 135 135 GLN N N 15 21.7337 1.582 . . . . 135 GLN . 25025 4 63 . 1 1 136 136 SER N N 15 22.7268 0.6603 . . . . 136 SER . 25025 4 64 . 1 1 141 141 GLY N N 15 21.3533 0.4877 . . . . 141 GLY . 25025 4 65 . 1 1 143 143 LEU N N 15 22.3586 0.7225 . . . . 143 LEU . 25025 4 66 . 1 1 144 144 LEU N N 15 22.4079 0.6453 . . . . 144 LEU . 25025 4 67 . 1 1 145 145 LEU N N 15 26.9895 1.6529 . . . . 145 LEU . 25025 4 68 . 1 1 146 146 LEU N N 15 22.8339 0.9661 . . . . 146 LEU . 25025 4 69 . 1 1 147 147 LEU N N 15 23.6362 0.9481 . . . . 147 LEU . 25025 4 70 . 1 1 148 148 GLU N N 15 24.8868 1.0153 . . . . 148 GLU . 25025 4 71 . 1 1 149 149 ALA N N 15 26.0446 1.1402 . . . . 149 ALA . 25025 4 72 . 1 1 151 151 GLY N N 15 23.4394 0.6367 . . . . 151 GLY . 25025 4 73 . 1 1 152 152 LEU N N 15 25.0709 0.5475 . . . . 152 LEU . 25025 4 74 . 1 1 153 153 GLY N N 15 21.8161 0.8083 . . . . 153 GLY . 25025 4 75 . 1 1 154 154 SER N N 15 24.7617 2.7541 . . . . 154 SER . 25025 4 76 . 1 1 155 155 VAL N N 15 22.7237 0.7569 . . . . 155 VAL . 25025 4 77 . 1 1 166 166 ARG N N 15 22.9997 1.4383 . . . . 166 ARG . 25025 4 78 . 1 1 168 168 ILE N N 15 23.9788 1.0285 . . . . 168 ILE . 25025 4 79 . 1 1 169 169 LEU N N 15 20.5847 1.381 . . . . 169 LEU . 25025 4 80 . 1 1 170 170 GLY N N 15 22.355 0.5238 . . . . 170 GLY . 25025 4 81 . 1 1 175 175 ALA N N 15 24.6675 0.868 . . . . 175 ALA . 25025 4 82 . 1 1 180 180 LEU N N 15 20.5424 1.0445 . . . . 180 LEU . 25025 4 83 . 1 1 181 181 VAL N N 15 21.1769 0.5933 . . . . 181 VAL . 25025 4 84 . 1 1 182 182 ALA N N 15 25.982 0.8621 . . . . 182 ALA . 25025 4 85 . 1 1 183 183 LEU N N 15 24.3009 0.7675 . . . . 183 LEU . 25025 4 86 . 1 1 184 184 GLY N N 15 18.22 1.0586 . . . . 184 GLY . 25025 4 87 . 1 1 185 185 TYR N N 15 24.9639 1.3275 . . . . 185 TYR . 25025 4 88 . 1 1 187 187 ALA N N 15 22.0525 0.9857 . . . . 187 ALA . 25025 4 89 . 1 1 188 188 GLU N N 15 20.9663 0.4881 . . . . 188 GLU . 25025 4 90 . 1 1 190 190 GLY N N 15 21.3767 0.42 . . . . 190 GLY . 25025 4 91 . 1 1 191 191 TYR N N 15 18.9436 0.3847 . . . . 191 TYR . 25025 4 92 . 1 1 199 199 GLU N N 15 21.6128 0.4577 . . . . 199 GLU . 25025 4 93 . 1 1 200 200 ARG N N 15 23.3914 0.9149 . . . . 200 ARG . 25025 4 94 . 1 1 201 201 VAL N N 15 20.3174 0.7107 . . . . 201 VAL . 25025 4 95 . 1 1 202 202 VAL N N 15 23.0138 0.7393 . . . . 202 VAL . 25025 4 96 . 1 1 203 203 LEU N N 15 23.8793 0.6404 . . . . 203 LEU . 25025 4 97 . 1 1 204 204 TRP N N 15 21.5295 0.4374 . . . . 204 TRP . 25025 4 98 . 1 1 205 205 ARG N N 15 23.1395 0.4555 . . . . 205 ARG . 25025 4 stop_ save_ ###################### # Order parameters # ###################### save_order_parameter_list_1 _Order_parameter_list.Sf_category order_parameters _Order_parameter_list.Sf_framecode order_parameter_list_1 _Order_parameter_list.Entry_ID 25025 _Order_parameter_list.ID 1 _Order_parameter_list.Sample_condition_list_ID 1 _Order_parameter_list.Sample_condition_list_label $sample_conditions_1 _Order_parameter_list.Tau_e_val_units . _Order_parameter_list.Tau_f_val_units . _Order_parameter_list.Tau_s_val_units . _Order_parameter_list.Rex_field_strength . _Order_parameter_list.Rex_val_units . _Order_parameter_list.Details . _Order_parameter_list.Text_data_format . _Order_parameter_list.Text_data . loop_ _Order_parameter_experiment.Experiment_ID _Order_parameter_experiment.Experiment_name _Order_parameter_experiment.Sample_ID _Order_parameter_experiment.Sample_label _Order_parameter_experiment.Sample_state _Order_parameter_experiment.Entry_ID _Order_parameter_experiment.Order_parameter_list_ID 8 {1H}NOE . . . 25025 1 9 R1rho . . . 25025 1 10 R1 . . . 25025 1 stop_ loop_ _Order_param.ID _Order_param.Assembly_atom_ID _Order_param.Entity_assembly_ID _Order_param.Entity_ID _Order_param.Comp_index_ID _Order_param.Seq_ID _Order_param.Comp_ID _Order_param.Atom_ID _Order_param.Atom_type _Order_param.Atom_isotope_number _Order_param.Order_param_val _Order_param.Order_param_val_fit_err _Order_param.Tau_e_val _Order_param.Tau_e_val_fit_err _Order_param.Tau_f_val _Order_param.Tau_f_val_fit_err _Order_param.Tau_s_val _Order_param.Tau_s_val_fit_err _Order_param.Rex_val _Order_param.Rex_val_fit_err _Order_param.Model_free_sum_squared_errs _Order_param.Model_fit _Order_param.Sf2_val _Order_param.Sf2_val_fit_err _Order_param.Ss2_val _Order_param.Ss2_val_fit_err _Order_param.SH2_val _Order_param.SH2_val_fit_err _Order_param.SN2_val _Order_param.SN2_val_fit_err _Order_param.Resonance_ID _Order_param.Auth_entity_assembly_ID _Order_param.Auth_seq_ID _Order_param.Auth_comp_ID _Order_param.Auth_atom_ID _Order_param.Entry_ID _Order_param.Order_parameter_list_ID 1 . 1 1 9 9 ASP N N 15 0.901145 0.016464 . . . . . . . . . . . . . . . . . . . . 9 ASP . 25025 1 2 . 1 1 11 11 LYS N N 15 0.931721 0.024611 . . . . . . . . . . . . . . . . . . . . 11 LYS . 25025 1 3 . 1 1 12 12 THR N N 15 0.944140 0.019414 . . . . . . . . . . . . . . . . . . . . 12 THR . 25025 1 4 . 1 1 13 13 ALA N N 15 0.982248 0.014169 . . . . . . . . . . . . . . . . . . . . 13 ALA . 25025 1 5 . 1 1 14 14 ALA N N 15 0.954298 0.013065 . . . . . . . . . . . . . . . . . . . . 14 ALA . 25025 1 6 . 1 1 15 15 LEU N N 15 0.954693 0.020144 . . . . . . . . . . . . . . . . . . . . 15 LEU . 25025 1 7 . 1 1 16 16 LYS N N 15 0.944031 0.016154 . . . . . . . . . . . . . . . . . . . . 16 LYS . 25025 1 8 . 1 1 17 17 ARG N N 15 0.981653 0.015264 . . . . . . . . . . . . . . . . . . . . 17 ARG . 25025 1 9 . 1 1 19 19 SER N N 15 0.908220 0.032631 . . . . . . . . . . . . . . . . . . . . 19 SER . 25025 1 10 . 1 1 20 20 ILE N N 15 0.946669 0.030887 . . . . . . . . . . . . . . . . . . . . 20 ILE . 25025 1 11 . 1 1 21 21 ARG N N 15 0.908363 0.020078 . . . . . . . . . . . . . . . . . . . . 21 ARG . 25025 1 12 . 1 1 22 22 ARG N N 15 0.873454 0.026212 . . . . . . . . . . . . . . . . . . . . 22 ARG . 25025 1 13 . 1 1 23 23 TYR N N 15 0.906062 0.020359 . . . . . . . . . . . . . . . . . . . . 23 TYR . 25025 1 14 . 1 1 24 24 ARG N N 15 0.941372 0.020967 . . . . . . . . . . . . . . . . . . . . 24 ARG . 25025 1 15 . 1 1 26 26 ASP N N 15 0.864767 0.021000 . . . . . . . . . . . . . . . . . . . . 26 ASP . 25025 1 16 . 1 1 28 28 VAL N N 15 0.837638 0.019713 . . . . . . . . . . . . . . . . . . . . 28 VAL . 25025 1 17 . 1 1 32 32 LEU N N 15 0.912400 0.024059 . . . . . . . . . . . . . . . . . . . . 32 LEU . 25025 1 18 . 1 1 34 34 ARG N N 15 0.931038 0.021743 . . . . . . . . . . . . . . . . . . . . 34 ARG . 25025 1 19 . 1 1 40 40 ALA N N 15 0.965687 0.015548 . . . . . . . . . . . . . . . . . . . . 40 ALA . 25025 1 20 . 1 1 42 42 ARG N N 15 0.933490 0.016871 . . . . . . . . . . . . . . . . . . . . 42 ARG . 25025 1 21 . 1 1 43 43 ALA N N 15 0.966214 0.017117 . . . . . . . . . . . . . . . . . . . . 43 ALA . 25025 1 22 . 1 1 45 45 SER N N 15 0.915297 0.027836 . . . . . . . . . . . . . . . . . . . . 45 SER . 25025 1 23 . 1 1 48 48 ASN N N 15 0.975333 0.018644 . . . . . . . . . . . . . . . . . . . . 48 ASN . 25025 1 24 . 1 1 50 50 GLN N N 15 0.950358 0.025008 . . . . . . . . . . . . . . . . . . . . 50 GLN . 25025 1 25 . 1 1 52 52 TRP N N 15 0.928352 0.027834 . . . . . . . . . . . . . . . . . . . . 52 TRP . 25025 1 26 . 1 1 54 54 ILE N N 15 0.925004 0.023455 . . . . . . . . . . . . . . . . . . . . 54 ILE . 25025 1 27 . 1 1 55 55 VAL N N 15 0.905833 0.012116 . . . . . . . . . . . . . . . . . . . . 55 VAL . 25025 1 28 . 1 1 56 56 VAL N N 15 0.962162 0.018765 . . . . . . . . . . . . . . . . . . . . 56 VAL . 25025 1 29 . 1 1 57 57 VAL N N 15 0.889563 0.016957 . . . . . . . . . . . . . . . . . . . . 57 VAL . 25025 1 30 . 1 1 58 58 ARG N N 15 0.936178 0.022572 . . . . . . . . . . . . . . . . . . . . 58 ARG . 25025 1 31 . 1 1 62 62 THR N N 15 0.930450 0.019001 . . . . . . . . . . . . . . . . . . . . 62 THR . 25025 1 32 . 1 1 63 63 LYS N N 15 0.910761 0.016074 . . . . . . . . . . . . . . . . . . . . 63 LYS . 25025 1 33 . 1 1 64 64 ARG N N 15 0.948369 0.018676 . . . . . . . . . . . . . . . . . . . . 64 ARG . 25025 1 34 . 1 1 65 65 ALA N N 15 0.929287 0.009822 . . . . . . . . . . . . . . . . . . . . 65 ALA . 25025 1 35 . 1 1 66 66 LEU N N 15 0.962183 0.021055 . . . . . . . . . . . . . . . . . . . . 66 LEU . 25025 1 36 . 1 1 67 67 ARG N N 15 0.931333 0.019486 . . . . . . . . . . . . . . . . . . . . 67 ARG . 25025 1 37 . 1 1 70 70 ALA N N 15 0.916416 0.014949 . . . . . . . . . . . . . . . . . . . . 70 ALA . 25025 1 38 . 1 1 71 71 PHE N N 15 0.921444 0.016810 . . . . . . . . . . . . . . . . . . . . 71 PHE . 25025 1 39 . 1 1 72 72 GLY N N 15 0.951846 0.030687 . . . . . . . . . . . . . . . . . . . . 72 GLY . 25025 1 40 . 1 1 73 73 GLN N N 15 0.957545 0.024440 . . . . . . . . . . . . . . . . . . . . 73 GLN . 25025 1 41 . 1 1 74 74 ALA N N 15 0.973277 0.023626 . . . . . . . . . . . . . . . . . . . . 74 ALA . 25025 1 42 . 1 1 75 75 HIS N N 15 0.946660 0.015970 . . . . . . . . . . . . . . . . . . . . 75 HIS . 25025 1 43 . 1 1 76 76 VAL N N 15 0.968792 0.018366 . . . . . . . . . . . . . . . . . . . . 76 VAL . 25025 1 44 . 1 1 78 78 GLU N N 15 0.930620 0.015508 . . . . . . . . . . . . . . . . . . . . 78 GLU . 25025 1 45 . 1 1 79 79 ALA N N 15 0.943011 0.010627 . . . . . . . . . . . . . . . . . . . . 79 ALA . 25025 1 46 . 1 1 81 81 VAL N N 15 0.908016 0.013938 . . . . . . . . . . . . . . . . . . . . 81 VAL . 25025 1 47 . 1 1 82 82 VAL N N 15 0.929510 0.018110 . . . . . . . . . . . . . . . . . . . . 82 VAL . 25025 1 48 . 1 1 85 85 LEU N N 15 0.967828 0.015270 . . . . . . . . . . . . . . . . . . . . 85 LEU . 25025 1 49 . 1 1 86 86 TYR N N 15 0.959364 0.017259 . . . . . . . . . . . . . . . . . . . . 86 TYR . 25025 1 50 . 1 1 87 87 ALA N N 15 0.933962 0.021850 . . . . . . . . . . . . . . . . . . . . 87 ALA . 25025 1 51 . 1 1 89 89 LEU N N 15 0.936824 0.014916 . . . . . . . . . . . . . . . . . . . . 89 LEU . 25025 1 52 . 1 1 90 90 GLU N N 15 0.924408 0.015005 . . . . . . . . . . . . . . . . . . . . 90 GLU . 25025 1 53 . 1 1 91 91 ASP N N 15 0.922072 0.019055 . . . . . . . . . . . . . . . . . . . . 91 ASP . 25025 1 54 . 1 1 93 93 LEU N N 15 0.964140 0.024366 . . . . . . . . . . . . . . . . . . . . 93 LEU . 25025 1 55 . 1 1 95 95 HIS N N 15 0.883060 0.017227 . . . . . . . . . . . . . . . . . . . . 95 HIS . 25025 1 56 . 1 1 96 96 LEU N N 15 0.922434 0.022945 . . . . . . . . . . . . . . . . . . . . 96 LEU . 25025 1 57 . 1 1 98 98 GLU N N 15 0.917790 0.020664 . . . . . . . . . . . . . . . . . . . . 98 GLU . 25025 1 58 . 1 1 99 99 VAL N N 15 0.913439 0.016499 . . . . . . . . . . . . . . . . . . . . 99 VAL . 25025 1 59 . 1 1 100 100 ILE N N 15 0.932859 0.015087 . . . . . . . . . . . . . . . . . . . . 100 ILE . 25025 1 60 . 1 1 105 105 GLN N N 15 0.756292 0.034318 . . . . . . . . . . . . . . . . . . . . 105 GLN . 25025 1 61 . 1 1 109 109 ARG N N 15 0.894181 0.029183 . . . . . . . . . . . . . . . . . . . . 109 ARG . 25025 1 62 . 1 1 110 110 GLU N N 15 0.937367 0.014646 . . . . . . . . . . . . . . . . . . . . 110 GLU . 25025 1 63 . 1 1 113 113 LYS N N 15 0.955481 0.015404 . . . . . . . . . . . . . . . . . . . . 113 LYS . 25025 1 64 . 1 1 115 115 ALA N N 15 0.952810 0.012227 . . . . . . . . . . . . . . . . . . . . 115 ALA . 25025 1 65 . 1 1 117 117 GLN N N 15 0.979446 0.011946 . . . . . . . . . . . . . . . . . . . . 117 GLN . 25025 1 66 . 1 1 118 118 ARG N N 15 0.918431 0.014749 . . . . . . . . . . . . . . . . . . . . 118 ARG . 25025 1 67 . 1 1 120 120 PHE N N 15 0.870311 0.014475 . . . . . . . . . . . . . . . . . . . . 120 PHE . 25025 1 68 . 1 1 121 121 ALA N N 15 0.889311 0.017705 . . . . . . . . . . . . . . . . . . . . 121 ALA . 25025 1 69 . 1 1 128 128 ARG N N 15 0.934702 0.019817 . . . . . . . . . . . . . . . . . . . . 128 ARG . 25025 1 70 . 1 1 129 129 LYS N N 15 0.943883 0.018937 . . . . . . . . . . . . . . . . . . . . 129 LYS . 25025 1 71 . 1 1 130 130 ALA N N 15 0.949880 0.017143 . . . . . . . . . . . . . . . . . . . . 130 ALA . 25025 1 72 . 1 1 131 131 TRP N N 15 0.950494 0.017450 . . . . . . . . . . . . . . . . . . . . 131 TRP . 25025 1 73 . 1 1 132 132 ALA N N 15 0.981265 0.016110 . . . . . . . . . . . . . . . . . . . . 132 ALA . 25025 1 74 . 1 1 133 133 SER N N 15 0.970979 0.021634 . . . . . . . . . . . . . . . . . . . . 133 SER . 25025 1 75 . 1 1 134 134 GLY N N 15 0.957799 0.019407 . . . . . . . . . . . . . . . . . . . . 134 GLY . 25025 1 76 . 1 1 135 135 GLN N N 15 0.965250 0.019871 . . . . . . . . . . . . . . . . . . . . 135 GLN . 25025 1 77 . 1 1 136 136 SER N N 15 0.939898 0.018485 . . . . . . . . . . . . . . . . . . . . 136 SER . 25025 1 78 . 1 1 139 139 LEU N N 15 0.976982 0.033664 . . . . . . . . . . . . . . . . . . . . 139 LEU . 25025 1 79 . 1 1 141 141 GLY N N 15 0.963451 0.016827 . . . . . . . . . . . . . . . . . . . . 141 GLY . 25025 1 80 . 1 1 143 143 LEU N N 15 0.958083 0.017974 . . . . . . . . . . . . . . . . . . . . 143 LEU . 25025 1 81 . 1 1 144 144 LEU N N 15 0.973921 0.017839 . . . . . . . . . . . . . . . . . . . . 144 LEU . 25025 1 82 . 1 1 145 145 LEU N N 15 0.980998 0.018802 . . . . . . . . . . . . . . . . . . . . 145 LEU . 25025 1 83 . 1 1 146 146 LEU N N 15 0.967617 0.017492 . . . . . . . . . . . . . . . . . . . . 146 LEU . 25025 1 84 . 1 1 147 147 LEU N N 15 0.949035 0.012780 . . . . . . . . . . . . . . . . . . . . 147 LEU . 25025 1 85 . 1 1 148 148 GLU N N 15 0.965209 0.015789 . . . . . . . . . . . . . . . . . . . . 148 GLU . 25025 1 86 . 1 1 149 149 ALA N N 15 0.957074 0.017081 . . . . . . . . . . . . . . . . . . . . 149 ALA . 25025 1 87 . 1 1 151 151 GLY N N 15 0.948799 0.017396 . . . . . . . . . . . . . . . . . . . . 151 GLY . 25025 1 88 . 1 1 152 152 LEU N N 15 0.935066 0.015933 . . . . . . . . . . . . . . . . . . . . 152 LEU . 25025 1 89 . 1 1 153 153 GLY N N 15 0.873341 0.016133 . . . . . . . . . . . . . . . . . . . . 153 GLY . 25025 1 90 . 1 1 154 154 SER N N 15 0.912121 0.018536 . . . . . . . . . . . . . . . . . . . . 154 SER . 25025 1 91 . 1 1 155 155 VAL N N 15 0.954117 0.021428 . . . . . . . . . . . . . . . . . . . . 155 VAL . 25025 1 92 . 1 1 166 166 ARG N N 15 0.937477 0.018825 . . . . . . . . . . . . . . . . . . . . 166 ARG . 25025 1 93 . 1 1 168 168 ILE N N 15 0.969176 0.011769 . . . . . . . . . . . . . . . . . . . . 168 ILE . 25025 1 94 . 1 1 169 169 LEU N N 15 0.931496 0.019997 . . . . . . . . . . . . . . . . . . . . 169 LEU . 25025 1 95 . 1 1 170 170 GLY N N 15 0.936818 0.016109 . . . . . . . . . . . . . . . . . . . . 170 GLY . 25025 1 96 . 1 1 175 175 ALA N N 15 0.906352 0.019408 . . . . . . . . . . . . . . . . . . . . 175 ALA . 25025 1 97 . 1 1 180 180 LEU N N 15 0.937949 0.016180 . . . . . . . . . . . . . . . . . . . . 180 LEU . 25025 1 98 . 1 1 181 181 VAL N N 15 0.891552 0.013271 . . . . . . . . . . . . . . . . . . . . 181 VAL . 25025 1 99 . 1 1 182 182 ALA N N 15 0.959317 0.017403 . . . . . . . . . . . . . . . . . . . . 182 ALA . 25025 1 100 . 1 1 183 183 LEU N N 15 0.952000 0.017280 . . . . . . . . . . . . . . . . . . . . 183 LEU . 25025 1 101 . 1 1 184 184 GLY N N 15 0.902302 0.023081 . . . . . . . . . . . . . . . . . . . . 184 GLY . 25025 1 102 . 1 1 185 185 TYR N N 15 0.951611 0.020410 . . . . . . . . . . . . . . . . . . . . 185 TYR . 25025 1 103 . 1 1 187 187 ALA N N 15 0.940891 0.024765 . . . . . . . . . . . . . . . . . . . . 187 ALA . 25025 1 104 . 1 1 188 188 GLU N N 15 0.800279 0.012020 . . . . . . . . . . . . . . . . . . . . 188 GLU . 25025 1 105 . 1 1 190 190 GLY N N 15 0.828643 0.025448 . . . . . . . . . . . . . . . . . . . . 190 GLY . 25025 1 106 . 1 1 191 191 TYR N N 15 0.834688 0.020108 . . . . . . . . . . . . . . . . . . . . 191 TYR . 25025 1 107 . 1 1 193 193 SER N N 15 0.708582 0.027421 . . . . . . . . . . . . . . . . . . . . 193 SER . 25025 1 108 . 1 1 196 196 LEU N N 15 0.963165 0.021929 . . . . . . . . . . . . . . . . . . . . 196 LEU . 25025 1 109 . 1 1 199 199 GLU N N 15 0.881673 0.015918 . . . . . . . . . . . . . . . . . . . . 199 GLU . 25025 1 110 . 1 1 200 200 ARG N N 15 0.924987 0.016498 . . . . . . . . . . . . . . . . . . . . 200 ARG . 25025 1 111 . 1 1 201 201 VAL N N 15 0.901637 0.021679 . . . . . . . . . . . . . . . . . . . . 201 VAL . 25025 1 112 . 1 1 202 202 VAL N N 15 0.903391 0.014050 . . . . . . . . . . . . . . . . . . . . 202 VAL . 25025 1 113 . 1 1 203 203 LEU N N 15 0.938902 0.019161 . . . . . . . . . . . . . . . . . . . . 203 LEU . 25025 1 114 . 1 1 204 204 TRP N N 15 0.865666 0.013123 . . . . . . . . . . . . . . . . . . . . 204 TRP . 25025 1 115 . 1 1 205 205 ARG N N 15 0.901373 0.010633 . . . . . . . . . . . . . . . . . . . . 205 ARG . 25025 1 stop_ save_ save_order_parameter_list_2 _Order_parameter_list.Sf_category order_parameters _Order_parameter_list.Sf_framecode order_parameter_list_2 _Order_parameter_list.Entry_ID 25025 _Order_parameter_list.ID 2 _Order_parameter_list.Sample_condition_list_ID 1 _Order_parameter_list.Sample_condition_list_label $sample_conditions_1 _Order_parameter_list.Tau_e_val_units . _Order_parameter_list.Tau_f_val_units . _Order_parameter_list.Tau_s_val_units . _Order_parameter_list.Rex_field_strength . _Order_parameter_list.Rex_val_units . _Order_parameter_list.Details . _Order_parameter_list.Text_data_format . _Order_parameter_list.Text_data . loop_ _Order_parameter_experiment.Experiment_ID _Order_parameter_experiment.Experiment_name _Order_parameter_experiment.Sample_ID _Order_parameter_experiment.Sample_label _Order_parameter_experiment.Sample_state _Order_parameter_experiment.Entry_ID _Order_parameter_experiment.Order_parameter_list_ID 8 {1H}NOE . . . 25025 2 9 R1rho . . . 25025 2 10 R1 . . . 25025 2 stop_ loop_ _Order_param.ID _Order_param.Assembly_atom_ID _Order_param.Entity_assembly_ID _Order_param.Entity_ID _Order_param.Comp_index_ID _Order_param.Seq_ID _Order_param.Comp_ID _Order_param.Atom_ID _Order_param.Atom_type _Order_param.Atom_isotope_number _Order_param.Order_param_val _Order_param.Order_param_val_fit_err _Order_param.Tau_e_val _Order_param.Tau_e_val_fit_err _Order_param.Tau_f_val _Order_param.Tau_f_val_fit_err _Order_param.Tau_s_val _Order_param.Tau_s_val_fit_err _Order_param.Rex_val _Order_param.Rex_val_fit_err _Order_param.Model_free_sum_squared_errs _Order_param.Model_fit _Order_param.Sf2_val _Order_param.Sf2_val_fit_err _Order_param.Ss2_val _Order_param.Ss2_val_fit_err _Order_param.SH2_val _Order_param.SH2_val_fit_err _Order_param.SN2_val _Order_param.SN2_val_fit_err _Order_param.Resonance_ID _Order_param.Auth_entity_assembly_ID _Order_param.Auth_seq_ID _Order_param.Auth_comp_ID _Order_param.Auth_atom_ID _Order_param.Entry_ID _Order_param.Order_parameter_list_ID 1 . 1 1 9 9 ASP N N 15 0.934005 0.018290 . . . . . . . . . . . . . . . . . . . . 9 ASP . 25025 2 2 . 1 1 13 13 ALA N N 15 0.948842 0.019230 . . . . . . . . . . . . . . . . . . . . 13 ALA . 25025 2 3 . 1 1 14 14 ALA N N 15 0.953668 0.010318 . . . . . . . . . . . . . . . . . . . . 14 ALA . 25025 2 4 . 1 1 15 15 LEU N N 15 0.924484 0.021247 . . . . . . . . . . . . . . . . . . . . 15 LEU . 25025 2 5 . 1 1 16 16 LYS N N 15 0.973554 0.019111 . . . . . . . . . . . . . . . . . . . . 16 LYS . 25025 2 6 . 1 1 17 17 ARG N N 15 1.000000 0.010136 . . . . . . . . . . . . . . . . . . . . 17 ARG . 25025 2 7 . 1 1 20 20 ILE N N 15 0.954512 0.010466 . . . . . . . . . . . . . . . . . . . . 20 ILE . 25025 2 8 . 1 1 22 22 ARG N N 15 0.905522 0.026839 . . . . . . . . . . . . . . . . . . . . 22 ARG . 25025 2 9 . 1 1 23 23 TYR N N 15 0.961312 0.014830 . . . . . . . . . . . . . . . . . . . . 23 TYR . 25025 2 10 . 1 1 24 24 ARG N N 15 0.989771 0.016262 . . . . . . . . . . . . . . . . . . . . 24 ARG . 25025 2 11 . 1 1 26 26 ASP N N 15 0.874636 0.025184 . . . . . . . . . . . . . . . . . . . . 26 ASP . 25025 2 12 . 1 1 28 28 VAL N N 15 0.844746 0.019280 . . . . . . . . . . . . . . . . . . . . 28 VAL . 25025 2 13 . 1 1 32 32 LEU N N 15 0.939588 0.025042 . . . . . . . . . . . . . . . . . . . . 32 LEU . 25025 2 14 . 1 1 34 34 ARG N N 15 0.962887 0.019736 . . . . . . . . . . . . . . . . . . . . 34 ARG . 25025 2 15 . 1 1 40 40 ALA N N 15 0.847615 0.020195 . . . . . . . . . . . . . . . . . . . . 40 ALA . 25025 2 16 . 1 1 42 42 ARG N N 15 0.941108 0.015705 . . . . . . . . . . . . . . . . . . . . 42 ARG . 25025 2 17 . 1 1 43 43 ALA N N 15 0.969437 0.017599 . . . . . . . . . . . . . . . . . . . . 43 ALA . 25025 2 18 . 1 1 45 45 SER N N 15 0.898083 0.026466 . . . . . . . . . . . . . . . . . . . . 45 SER . 25025 2 19 . 1 1 48 48 ASN N N 15 0.969328 0.011794 . . . . . . . . . . . . . . . . . . . . 48 ASN . 25025 2 20 . 1 1 50 50 GLN N N 15 1.000000 0.020289 . . . . . . . . . . . . . . . . . . . . 50 GLN . 25025 2 21 . 1 1 52 52 TRP N N 15 0.941868 0.023593 . . . . . . . . . . . . . . . . . . . . 52 TRP . 25025 2 22 . 1 1 54 54 ILE N N 15 0.911549 0.012881 . . . . . . . . . . . . . . . . . . . . 54 ILE . 25025 2 23 . 1 1 55 55 VAL N N 15 0.904339 0.015355 . . . . . . . . . . . . . . . . . . . . 55 VAL . 25025 2 24 . 1 1 56 56 VAL N N 15 0.922713 0.010885 . . . . . . . . . . . . . . . . . . . . 56 VAL . 25025 2 25 . 1 1 57 57 VAL N N 15 0.933089 0.015911 . . . . . . . . . . . . . . . . . . . . 57 VAL . 25025 2 26 . 1 1 62 62 THR N N 15 0.945260 0.013236 . . . . . . . . . . . . . . . . . . . . 62 THR . 25025 2 27 . 1 1 63 63 LYS N N 15 0.977511 0.005561 . . . . . . . . . . . . . . . . . . . . 63 LYS . 25025 2 28 . 1 1 64 64 ARG N N 15 0.955194 0.018083 . . . . . . . . . . . . . . . . . . . . 64 ARG . 25025 2 29 . 1 1 65 65 ALA N N 15 0.962571 0.015582 . . . . . . . . . . . . . . . . . . . . 65 ALA . 25025 2 30 . 1 1 66 66 LEU N N 15 0.943746 0.024854 . . . . . . . . . . . . . . . . . . . . 66 LEU . 25025 2 31 . 1 1 67 67 ARG N N 15 0.964881 0.008705 . . . . . . . . . . . . . . . . . . . . 67 ARG . 25025 2 32 . 1 1 70 70 ALA N N 15 0.964813 0.012353 . . . . . . . . . . . . . . . . . . . . 70 ALA . 25025 2 33 . 1 1 71 71 PHE N N 15 0.942631 0.016526 . . . . . . . . . . . . . . . . . . . . 71 PHE . 25025 2 34 . 1 1 76 76 VAL N N 15 0.970834 0.020030 . . . . . . . . . . . . . . . . . . . . 76 VAL . 25025 2 35 . 1 1 79 79 ALA N N 15 0.949635 0.016893 . . . . . . . . . . . . . . . . . . . . 79 ALA . 25025 2 36 . 1 1 81 81 VAL N N 15 0.888328 0.018622 . . . . . . . . . . . . . . . . . . . . 81 VAL . 25025 2 37 . 1 1 82 82 VAL N N 15 0.971973 0.015517 . . . . . . . . . . . . . . . . . . . . 82 VAL . 25025 2 38 . 1 1 85 85 LEU N N 15 0.962074 0.016836 . . . . . . . . . . . . . . . . . . . . 85 LEU . 25025 2 39 . 1 1 86 86 TYR N N 15 0.933302 0.021909 . . . . . . . . . . . . . . . . . . . . 86 TYR . 25025 2 40 . 1 1 87 87 ALA N N 15 0.984241 0.014992 . . . . . . . . . . . . . . . . . . . . 87 ALA . 25025 2 41 . 1 1 89 89 LEU N N 15 0.880508 0.026043 . . . . . . . . . . . . . . . . . . . . 89 LEU . 25025 2 42 . 1 1 90 90 GLU N N 15 0.937364 0.020953 . . . . . . . . . . . . . . . . . . . . 90 GLU . 25025 2 43 . 1 1 91 91 ASP N N 15 1.000000 0.004610 . . . . . . . . . . . . . . . . . . . . 91 ASP . 25025 2 44 . 1 1 93 93 LEU N N 15 0.880919 0.023750 . . . . . . . . . . . . . . . . . . . . 93 LEU . 25025 2 45 . 1 1 95 95 HIS N N 15 0.893950 0.016857 . . . . . . . . . . . . . . . . . . . . 95 HIS . 25025 2 46 . 1 1 96 96 LEU N N 15 0.903399 0.021818 . . . . . . . . . . . . . . . . . . . . 96 LEU . 25025 2 47 . 1 1 98 98 GLU N N 15 0.937395 0.008718 . . . . . . . . . . . . . . . . . . . . 98 GLU . 25025 2 48 . 1 1 99 99 VAL N N 15 0.958235 0.018625 . . . . . . . . . . . . . . . . . . . . 99 VAL . 25025 2 49 . 1 1 100 100 ILE N N 15 0.999905 0.009839 . . . . . . . . . . . . . . . . . . . . 100 ILE . 25025 2 50 . 1 1 110 110 GLU N N 15 0.950843 0.008611 . . . . . . . . . . . . . . . . . . . . 110 GLU . 25025 2 51 . 1 1 113 113 LYS N N 15 0.901122 0.024932 . . . . . . . . . . . . . . . . . . . . 113 LYS . 25025 2 52 . 1 1 115 115 ALA N N 15 0.953612 0.019807 . . . . . . . . . . . . . . . . . . . . 115 ALA . 25025 2 53 . 1 1 117 117 GLN N N 15 0.952967 0.019612 . . . . . . . . . . . . . . . . . . . . 117 GLN . 25025 2 54 . 1 1 118 118 ARG N N 15 0.966039 0.014698 . . . . . . . . . . . . . . . . . . . . 118 ARG . 25025 2 55 . 1 1 120 120 PHE N N 15 0.866106 0.016883 . . . . . . . . . . . . . . . . . . . . 120 PHE . 25025 2 56 . 1 1 121 121 ALA N N 15 0.962150 0.016263 . . . . . . . . . . . . . . . . . . . . 121 ALA . 25025 2 57 . 1 1 128 128 ARG N N 15 0.938696 0.022623 . . . . . . . . . . . . . . . . . . . . 128 ARG . 25025 2 58 . 1 1 129 129 LYS N N 15 0.921445 0.036673 . . . . . . . . . . . . . . . . . . . . 129 LYS . 25025 2 59 . 1 1 130 130 ALA N N 15 0.950908 0.015239 . . . . . . . . . . . . . . . . . . . . 130 ALA . 25025 2 60 . 1 1 131 131 TRP N N 15 0.897496 0.019440 . . . . . . . . . . . . . . . . . . . . 131 TRP . 25025 2 61 . 1 1 132 132 ALA N N 15 0.983273 0.006475 . . . . . . . . . . . . . . . . . . . . 132 ALA . 25025 2 62 . 1 1 133 133 SER N N 15 0.912839 0.024597 . . . . . . . . . . . . . . . . . . . . 133 SER . 25025 2 63 . 1 1 134 134 GLY N N 15 0.916668 0.018190 . . . . . . . . . . . . . . . . . . . . 134 GLY . 25025 2 64 . 1 1 135 135 GLN N N 15 0.954968 0.022501 . . . . . . . . . . . . . . . . . . . . 135 GLN . 25025 2 65 . 1 1 136 136 SER N N 15 0.956581 0.015845 . . . . . . . . . . . . . . . . . . . . 136 SER . 25025 2 66 . 1 1 141 141 GLY N N 15 0.885104 0.013471 . . . . . . . . . . . . . . . . . . . . 141 GLY . 25025 2 67 . 1 1 142 142 TYR N N 15 0.969607 0.016640 . . . . . . . . . . . . . . . . . . . . 142 TYR . 25025 2 68 . 1 1 143 143 LEU N N 15 0.956265 0.013913 . . . . . . . . . . . . . . . . . . . . 143 LEU . 25025 2 69 . 1 1 144 144 LEU N N 15 0.949982 0.014709 . . . . . . . . . . . . . . . . . . . . 144 LEU . 25025 2 70 . 1 1 145 145 LEU N N 15 1.000000 0.001072 . . . . . . . . . . . . . . . . . . . . 145 LEU . 25025 2 71 . 1 1 146 146 LEU N N 15 0.937215 0.026047 . . . . . . . . . . . . . . . . . . . . 146 LEU . 25025 2 72 . 1 1 147 147 LEU N N 15 0.928849 0.022246 . . . . . . . . . . . . . . . . . . . . 147 LEU . 25025 2 73 . 1 1 148 148 GLU N N 15 1.000000 0.013836 . . . . . . . . . . . . . . . . . . . . 148 GLU . 25025 2 74 . 1 1 149 149 ALA N N 15 1.000000 0.006136 . . . . . . . . . . . . . . . . . . . . 149 ALA . 25025 2 75 . 1 1 151 151 GLY N N 15 0.934164 0.015092 . . . . . . . . . . . . . . . . . . . . 151 GLY . 25025 2 76 . 1 1 152 152 LEU N N 15 0.945915 0.015796 . . . . . . . . . . . . . . . . . . . . 152 LEU . 25025 2 77 . 1 1 153 153 GLY N N 15 0.891504 0.022290 . . . . . . . . . . . . . . . . . . . . 153 GLY . 25025 2 78 . 1 1 154 154 SER N N 15 0.961207 0.019107 . . . . . . . . . . . . . . . . . . . . 154 SER . 25025 2 79 . 1 1 155 155 VAL N N 15 0.976565 0.013492 . . . . . . . . . . . . . . . . . . . . 155 VAL . 25025 2 80 . 1 1 166 166 ARG N N 15 0.929208 0.034735 . . . . . . . . . . . . . . . . . . . . 166 ARG . 25025 2 81 . 1 1 168 168 ILE N N 15 0.928337 0.018208 . . . . . . . . . . . . . . . . . . . . 168 ILE . 25025 2 82 . 1 1 169 169 LEU N N 15 0.914805 0.020278 . . . . . . . . . . . . . . . . . . . . 169 LEU . 25025 2 83 . 1 1 170 170 GLY N N 15 0.909718 0.010127 . . . . . . . . . . . . . . . . . . . . 170 GLY . 25025 2 84 . 1 1 175 175 ALA N N 15 0.952917 0.017772 . . . . . . . . . . . . . . . . . . . . 175 ALA . 25025 2 85 . 1 1 180 180 LEU N N 15 0.929123 0.019273 . . . . . . . . . . . . . . . . . . . . 180 LEU . 25025 2 86 . 1 1 181 181 VAL N N 15 0.870276 0.012753 . . . . . . . . . . . . . . . . . . . . 181 VAL . 25025 2 87 . 1 1 182 182 ALA N N 15 0.981924 0.013522 . . . . . . . . . . . . . . . . . . . . 182 ALA . 25025 2 88 . 1 1 183 183 LEU N N 15 0.988821 0.012849 . . . . . . . . . . . . . . . . . . . . 183 LEU . 25025 2 89 . 1 1 184 184 GLY N N 15 0.819628 0.032776 . . . . . . . . . . . . . . . . . . . . 184 GLY . 25025 2 90 . 1 1 185 185 TYR N N 15 1.000000 0.024043 . . . . . . . . . . . . . . . . . . . . 185 TYR . 25025 2 91 . 1 1 187 187 ALA N N 15 0.931207 0.025357 . . . . . . . . . . . . . . . . . . . . 187 ALA . 25025 2 92 . 1 1 188 188 GLU N N 15 0.847431 0.015029 . . . . . . . . . . . . . . . . . . . . 188 GLU . 25025 2 93 . 1 1 190 190 GLY N N 15 0.835847 0.014969 . . . . . . . . . . . . . . . . . . . . 190 GLY . 25025 2 94 . 1 1 191 191 TYR N N 15 0.791212 0.015299 . . . . . . . . . . . . . . . . . . . . 191 TYR . 25025 2 95 . 1 1 199 199 GLU N N 15 0.897874 0.016933 . . . . . . . . . . . . . . . . . . . . 199 GLU . 25025 2 96 . 1 1 200 200 ARG N N 15 0.924006 0.017561 . . . . . . . . . . . . . . . . . . . . 200 ARG . 25025 2 97 . 1 1 201 201 VAL N N 15 0.864149 0.023601 . . . . . . . . . . . . . . . . . . . . 201 VAL . 25025 2 98 . 1 1 202 202 VAL N N 15 0.931955 0.021652 . . . . . . . . . . . . . . . . . . . . 202 VAL . 25025 2 99 . 1 1 203 203 LEU N N 15 0.919580 0.017096 . . . . . . . . . . . . . . . . . . . . 203 LEU . 25025 2 100 . 1 1 204 204 TRP N N 15 0.873487 0.014532 . . . . . . . . . . . . . . . . . . . . 204 TRP . 25025 2 101 . 1 1 205 205 ARG N N 15 0.928091 0.013133 . . . . . . . . . . . . . . . . . . . . 205 ARG . 25025 2 stop_ save_