data_19284 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19284 _Entry.Title ; Relaxation data of the delta subunit of RNA polymerase from Bacillus subtilis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-06-04 _Entry.Accession_date 2013-06-04 _Entry.Last_release_date 2013-10-14 _Entry.Original_release_date 2013-10-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Veronika Papouskova . . . 19284 2 Lukas Zidek . . . 19284 3 Pavel Kaderavek . . . 19284 4 Hana Sanderova . . . 19284 5 Libor Krasny . . . 19284 6 Vladimir Sklenar . . . 19284 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID heteronucl_NOEs 1 19284 heteronucl_T1_relaxation 1 19284 heteronucl_T2_relaxation 1 19284 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'heteronuclear NOE values' 103 19284 'T1 relaxation values' 105 19284 'T2 relaxation values' 105 19284 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 . . 2013-10-14 2013-06-04 original author . 19284 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16912 'Delta subunit of RNA polymerase from Bacillus subtilis' 19284 PDB 2M4K . 19284 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19284 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23868186 _Citation.Full_citation . _Citation.Title 'Structural Study of the Partially Disordered Full-Length Subunit of RNA Polymerase from Bacillus subtilis.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Chembiochem _Citation.Journal_name_full 'Chembiochem : a European journal of chemical biology' _Citation.Journal_volume 14 _Citation.Journal_issue 14 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1772 _Citation.Page_last 1779 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Veronika Papoukova . . . 19284 1 2 Pavel Kadeavek . . . 19284 1 3 Olga Otrusinova . . . 19284 1 4 Albeta Rabatinova . . . 19284 1 5 Hana Sanderova . . . 19284 1 6 Jii Novaek . . . 19284 1 7 Libor Krasny . . . 19284 1 8 Vladimir Sklena . . . 19284 1 9 Luka Zidek . . . 19284 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'delta subunit' 19284 1 'NMR spectroscopy' 19284 1 'partially disordered proteins' 19284 1 'protein structures' 19284 1 'RNA polymerase' 19284 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19284 _Assembly.ID 1 _Assembly.Name delta _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 delta 1 $delta A . yes native no no . . . 19284 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_delta _Entity.Sf_category entity _Entity.Sf_framecode delta _Entity.Entry_ID 19284 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name delta _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 ; GIKQYSQEELKEMALVEIAH ELFEEHKKPVPFQELLNEIA SLLGVKKEELGDRIAQFYTD LNIDGRFLALSDQTWGLRSW YPYDQLDEETQPTVKAKKKK AKKAVEEDLDLDEFEEIDED DLDLDEVEEELDLEADDFDE EDLDEDDDDLEIEEDIIDED DEDYDDEEEEIK ; _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 172 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16635 . N_delta . . . . . 52.91 99 100.00 100.00 1.86e-58 . . . . 19284 1 2 no BMRB 16912 . delta . . . . . 100.00 172 100.00 100.00 9.30e-109 . . . . 19284 1 3 no BMRB 18903 . delta . . . . . 100.00 172 100.00 100.00 9.30e-109 . . . . 19284 1 4 no PDB 2KRC . "Solution Structure Of The N-Terminal Domain Of Bacillus Subtilis Delta Subunit Of Rna Polymerase" . . . . . 52.91 99 100.00 100.00 1.86e-58 . . . . 19284 1 5 no PDB 4NC7 . "N-terminal Domain Of Delta-subunit Of Rna Polymerase Complexed With I3c And Nickel Ions" . . . . . 52.91 99 100.00 100.00 1.86e-58 . . . . 19284 1 6 no PDB 4NC8 . "N-terminal Domain Of Delta-subunit Of Rna Polymerase Complexed With Nickel Ions" . . . . . 52.91 99 100.00 100.00 1.86e-58 . . . . 19284 1 7 no DBJ BAM55799 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis BEST7613]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 8 no DBJ BAM59811 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis BEST7003]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 9 no EMBL CAA89869 . "RNA polymerase delta subunit [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 10 no EMBL CAB15744 . "RNA polymerase (delta subunit) [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 11 no EMBL CCU60814 . "DNA-directed RNA polymerase delta subunit [Bacillus subtilis E1]" . . . . . 100.00 173 99.42 100.00 2.21e-108 . . . . 19284 1 12 no EMBL CEI59524 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 13 no EMBL CEJ79381 . "DNA-directed RNA polymerase subunit delta [Bacillus sp.]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 14 no GB AAA22710 . "rpoE protein (ttg start codon) [Bacillus subtilis]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 15 no GB ADM39706 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis subsp. spizizenii str. W23]" . . . . . 63.37 173 98.17 98.17 1.29e-59 . . . . 19284 1 16 no GB ADV94526 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis BSn5]" . . . . . 100.00 173 98.84 100.00 3.46e-108 . . . . 19284 1 17 no GB AEP92774 . "hypothetical protein I33_3861 [Bacillus subtilis subsp. subtilis str. RO-NN-1]" . . . . . 100.00 173 98.84 99.42 9.54e-108 . . . . 19284 1 18 no GB AFI30331 . "DNA-directed RNA polymerase subunit delta [Bacillus sp. JS]" . . . . . 100.00 173 98.84 100.00 3.46e-108 . . . . 19284 1 19 no REF NP_391597 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 20 no REF WP_003221959 . "MULTISPECIES: DNA-directed RNA polymerase subunit delta [Bacillus]" . . . . . 63.37 173 98.17 98.17 1.29e-59 . . . . 19284 1 21 no REF WP_003227609 . "MULTISPECIES: DNA-directed RNA polymerase subunit delta [Bacillus]" . . . . . 100.00 173 99.42 100.00 2.21e-108 . . . . 19284 1 22 no REF WP_003235832 . "DNA-directed RNA polymerase subunit delta [Bacillus subtilis]" . . . . . 63.37 173 99.08 99.08 1.49e-61 . . . . 19284 1 23 no REF WP_003243661 . "MULTISPECIES: DNA-directed RNA polymerase subunit delta [Bacillus]" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 24 no SP P12464 . "RecName: Full=DNA-directed RNA polymerase subunit delta; AltName: Full=RNAP delta factor" . . . . . 100.00 173 100.00 100.00 6.57e-109 . . . . 19284 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 2 GLY . 19284 1 2 3 ILE . 19284 1 3 4 LYS . 19284 1 4 5 GLN . 19284 1 5 6 TYR . 19284 1 6 7 SER . 19284 1 7 8 GLN . 19284 1 8 9 GLU . 19284 1 9 10 GLU . 19284 1 10 11 LEU . 19284 1 11 12 LYS . 19284 1 12 13 GLU . 19284 1 13 14 MET . 19284 1 14 15 ALA . 19284 1 15 16 LEU . 19284 1 16 17 VAL . 19284 1 17 18 GLU . 19284 1 18 19 ILE . 19284 1 19 20 ALA . 19284 1 20 21 HIS . 19284 1 21 22 GLU . 19284 1 22 23 LEU . 19284 1 23 24 PHE . 19284 1 24 25 GLU . 19284 1 25 26 GLU . 19284 1 26 27 HIS . 19284 1 27 28 LYS . 19284 1 28 29 LYS . 19284 1 29 30 PRO . 19284 1 30 31 VAL . 19284 1 31 32 PRO . 19284 1 32 33 PHE . 19284 1 33 34 GLN . 19284 1 34 35 GLU . 19284 1 35 36 LEU . 19284 1 36 37 LEU . 19284 1 37 38 ASN . 19284 1 38 39 GLU . 19284 1 39 40 ILE . 19284 1 40 41 ALA . 19284 1 41 42 SER . 19284 1 42 43 LEU . 19284 1 43 44 LEU . 19284 1 44 45 GLY . 19284 1 45 46 VAL . 19284 1 46 47 LYS . 19284 1 47 48 LYS . 19284 1 48 49 GLU . 19284 1 49 50 GLU . 19284 1 50 51 LEU . 19284 1 51 52 GLY . 19284 1 52 53 ASP . 19284 1 53 54 ARG . 19284 1 54 55 ILE . 19284 1 55 56 ALA . 19284 1 56 57 GLN . 19284 1 57 58 PHE . 19284 1 58 59 TYR . 19284 1 59 60 THR . 19284 1 60 61 ASP . 19284 1 61 62 LEU . 19284 1 62 63 ASN . 19284 1 63 64 ILE . 19284 1 64 65 ASP . 19284 1 65 66 GLY . 19284 1 66 67 ARG . 19284 1 67 68 PHE . 19284 1 68 69 LEU . 19284 1 69 70 ALA . 19284 1 70 71 LEU . 19284 1 71 72 SER . 19284 1 72 73 ASP . 19284 1 73 74 GLN . 19284 1 74 75 THR . 19284 1 75 76 TRP . 19284 1 76 77 GLY . 19284 1 77 78 LEU . 19284 1 78 79 ARG . 19284 1 79 80 SER . 19284 1 80 81 TRP . 19284 1 81 82 TYR . 19284 1 82 83 PRO . 19284 1 83 84 TYR . 19284 1 84 85 ASP . 19284 1 85 86 GLN . 19284 1 86 87 LEU . 19284 1 87 88 ASP . 19284 1 88 89 GLU . 19284 1 89 90 GLU . 19284 1 90 91 THR . 19284 1 91 92 GLN . 19284 1 92 93 PRO . 19284 1 93 94 THR . 19284 1 94 95 VAL . 19284 1 95 96 LYS . 19284 1 96 97 ALA . 19284 1 97 98 LYS . 19284 1 98 99 LYS . 19284 1 99 100 LYS . 19284 1 100 101 LYS . 19284 1 101 102 ALA . 19284 1 102 103 LYS . 19284 1 103 104 LYS . 19284 1 104 105 ALA . 19284 1 105 106 VAL . 19284 1 106 107 GLU . 19284 1 107 108 GLU . 19284 1 108 109 ASP . 19284 1 109 110 LEU . 19284 1 110 111 ASP . 19284 1 111 112 LEU . 19284 1 112 113 ASP . 19284 1 113 114 GLU . 19284 1 114 115 PHE . 19284 1 115 116 GLU . 19284 1 116 117 GLU . 19284 1 117 118 ILE . 19284 1 118 119 ASP . 19284 1 119 120 GLU . 19284 1 120 121 ASP . 19284 1 121 122 ASP . 19284 1 122 123 LEU . 19284 1 123 124 ASP . 19284 1 124 125 LEU . 19284 1 125 126 ASP . 19284 1 126 127 GLU . 19284 1 127 128 VAL . 19284 1 128 129 GLU . 19284 1 129 130 GLU . 19284 1 130 131 GLU . 19284 1 131 132 LEU . 19284 1 132 133 ASP . 19284 1 133 134 LEU . 19284 1 134 135 GLU . 19284 1 135 136 ALA . 19284 1 136 137 ASP . 19284 1 137 138 ASP . 19284 1 138 139 PHE . 19284 1 139 140 ASP . 19284 1 140 141 GLU . 19284 1 141 142 GLU . 19284 1 142 143 ASP . 19284 1 143 144 LEU . 19284 1 144 145 ASP . 19284 1 145 146 GLU . 19284 1 146 147 ASP . 19284 1 147 148 ASP . 19284 1 148 149 ASP . 19284 1 149 150 ASP . 19284 1 150 151 LEU . 19284 1 151 152 GLU . 19284 1 152 153 ILE . 19284 1 153 154 GLU . 19284 1 154 155 GLU . 19284 1 155 156 ASP . 19284 1 156 157 ILE . 19284 1 157 158 ILE . 19284 1 158 159 ASP . 19284 1 159 160 GLU . 19284 1 160 161 ASP . 19284 1 161 162 ASP . 19284 1 162 163 GLU . 19284 1 163 164 ASP . 19284 1 164 165 TYR . 19284 1 165 166 ASP . 19284 1 166 167 ASP . 19284 1 167 168 GLU . 19284 1 168 169 GLU . 19284 1 169 170 GLU . 19284 1 170 171 GLU . 19284 1 171 172 ILE . 19284 1 172 173 LYS . 19284 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 19284 1 . ILE 2 2 19284 1 . LYS 3 3 19284 1 . GLN 4 4 19284 1 . TYR 5 5 19284 1 . SER 6 6 19284 1 . GLN 7 7 19284 1 . GLU 8 8 19284 1 . GLU 9 9 19284 1 . LEU 10 10 19284 1 . LYS 11 11 19284 1 . GLU 12 12 19284 1 . MET 13 13 19284 1 . ALA 14 14 19284 1 . LEU 15 15 19284 1 . VAL 16 16 19284 1 . GLU 17 17 19284 1 . ILE 18 18 19284 1 . ALA 19 19 19284 1 . HIS 20 20 19284 1 . GLU 21 21 19284 1 . LEU 22 22 19284 1 . PHE 23 23 19284 1 . GLU 24 24 19284 1 . GLU 25 25 19284 1 . HIS 26 26 19284 1 . LYS 27 27 19284 1 . LYS 28 28 19284 1 . PRO 29 29 19284 1 . VAL 30 30 19284 1 . PRO 31 31 19284 1 . PHE 32 32 19284 1 . GLN 33 33 19284 1 . GLU 34 34 19284 1 . LEU 35 35 19284 1 . LEU 36 36 19284 1 . ASN 37 37 19284 1 . GLU 38 38 19284 1 . ILE 39 39 19284 1 . ALA 40 40 19284 1 . SER 41 41 19284 1 . LEU 42 42 19284 1 . LEU 43 43 19284 1 . GLY 44 44 19284 1 . VAL 45 45 19284 1 . LYS 46 46 19284 1 . LYS 47 47 19284 1 . GLU 48 48 19284 1 . GLU 49 49 19284 1 . LEU 50 50 19284 1 . GLY 51 51 19284 1 . ASP 52 52 19284 1 . ARG 53 53 19284 1 . ILE 54 54 19284 1 . ALA 55 55 19284 1 . GLN 56 56 19284 1 . PHE 57 57 19284 1 . TYR 58 58 19284 1 . THR 59 59 19284 1 . ASP 60 60 19284 1 . LEU 61 61 19284 1 . ASN 62 62 19284 1 . ILE 63 63 19284 1 . ASP 64 64 19284 1 . GLY 65 65 19284 1 . ARG 66 66 19284 1 . PHE 67 67 19284 1 . LEU 68 68 19284 1 . ALA 69 69 19284 1 . LEU 70 70 19284 1 . SER 71 71 19284 1 . ASP 72 72 19284 1 . GLN 73 73 19284 1 . THR 74 74 19284 1 . TRP 75 75 19284 1 . GLY 76 76 19284 1 . LEU 77 77 19284 1 . ARG 78 78 19284 1 . SER 79 79 19284 1 . TRP 80 80 19284 1 . TYR 81 81 19284 1 . PRO 82 82 19284 1 . TYR 83 83 19284 1 . ASP 84 84 19284 1 . GLN 85 85 19284 1 . LEU 86 86 19284 1 . ASP 87 87 19284 1 . GLU 88 88 19284 1 . GLU 89 89 19284 1 . THR 90 90 19284 1 . GLN 91 91 19284 1 . PRO 92 92 19284 1 . THR 93 93 19284 1 . VAL 94 94 19284 1 . LYS 95 95 19284 1 . ALA 96 96 19284 1 . LYS 97 97 19284 1 . LYS 98 98 19284 1 . LYS 99 99 19284 1 . LYS 100 100 19284 1 . ALA 101 101 19284 1 . LYS 102 102 19284 1 . LYS 103 103 19284 1 . ALA 104 104 19284 1 . VAL 105 105 19284 1 . GLU 106 106 19284 1 . GLU 107 107 19284 1 . ASP 108 108 19284 1 . LEU 109 109 19284 1 . ASP 110 110 19284 1 . LEU 111 111 19284 1 . ASP 112 112 19284 1 . GLU 113 113 19284 1 . PHE 114 114 19284 1 . GLU 115 115 19284 1 . GLU 116 116 19284 1 . ILE 117 117 19284 1 . ASP 118 118 19284 1 . GLU 119 119 19284 1 . ASP 120 120 19284 1 . ASP 121 121 19284 1 . LEU 122 122 19284 1 . ASP 123 123 19284 1 . LEU 124 124 19284 1 . ASP 125 125 19284 1 . GLU 126 126 19284 1 . VAL 127 127 19284 1 . GLU 128 128 19284 1 . GLU 129 129 19284 1 . GLU 130 130 19284 1 . LEU 131 131 19284 1 . ASP 132 132 19284 1 . LEU 133 133 19284 1 . GLU 134 134 19284 1 . ALA 135 135 19284 1 . ASP 136 136 19284 1 . ASP 137 137 19284 1 . PHE 138 138 19284 1 . ASP 139 139 19284 1 . GLU 140 140 19284 1 . GLU 141 141 19284 1 . ASP 142 142 19284 1 . LEU 143 143 19284 1 . ASP 144 144 19284 1 . GLU 145 145 19284 1 . ASP 146 146 19284 1 . ASP 147 147 19284 1 . ASP 148 148 19284 1 . ASP 149 149 19284 1 . LEU 150 150 19284 1 . GLU 151 151 19284 1 . ILE 152 152 19284 1 . GLU 153 153 19284 1 . GLU 154 154 19284 1 . ASP 155 155 19284 1 . ILE 156 156 19284 1 . ILE 157 157 19284 1 . ASP 158 158 19284 1 . GLU 159 159 19284 1 . ASP 160 160 19284 1 . ASP 161 161 19284 1 . GLU 162 162 19284 1 . ASP 163 163 19284 1 . TYR 164 164 19284 1 . ASP 165 165 19284 1 . ASP 166 166 19284 1 . GLU 167 167 19284 1 . GLU 168 168 19284 1 . GLU 169 169 19284 1 . GLU 170 170 19284 1 . ILE 171 171 19284 1 . LYS 172 172 19284 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 19284 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $delta . 1423 organism . 'Bacillus subtilis' Firmicutes . . Bacteria . Bacillus subtilis . . . . . . . . . . . . . . . . . . . . . 19284 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 19284 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $delta . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21-(DE3) . . . . . . . . . . . . . . . pFL31 . . . . . . 19284 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19284 _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 delta '[U-100% 15N]' . . 1 $delta . . 1.1 . . mM . . . . 19284 1 2 D2O '[U-99% 2H]' . . . . . . 10 . . % . . . . 19284 1 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 19284 1 4 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 19284 1 5 'phosphate buffer' 'natural abundance' . . . . . . 20 . . mM . . . . 19284 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19284 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 19284 _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' 20 . mM 19284 1 pH 6.6 . pH 19284 1 pressure 1 . atm 19284 1 temperature 301 . K 19284 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 19284 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 19284 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 19284 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 19284 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 19284 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19284 2 'data analysis' 19284 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19284 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19284 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 19284 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 19284 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19284 1 2 '2D NOE 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19284 1 3 '2D R1 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19284 1 4 '2D R2 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19284 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 19284 _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 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 0 _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 2 '2D NOE 15N,1H correlation' . . . 19284 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 2 2 ILE N N 15 . 1 1 2 2 ILE H H 1 0.68977 0.15816 . . . 3 ILE N . 3 ILE H 19284 1 2 . 1 1 3 3 LYS N N 15 . 1 1 3 3 LYS H H 1 0.51546 0.00643 . . . 4 LYS N . 4 LYS H 19284 1 3 . 1 1 4 4 GLN N N 15 . 1 1 4 4 GLN H H 1 0.50044 0.07197 . . . 5 GLN N . 5 GLN H 19284 1 4 . 1 1 5 5 TYR N N 15 . 1 1 5 5 TYR H H 1 0.62779 0.05287 . . . 6 TYR N . 6 TYR H 19284 1 5 . 1 1 6 6 SER N N 15 . 1 1 6 6 SER H H 1 0.63611 0.03308 . . . 7 SER N . 7 SER H 19284 1 6 . 1 1 7 7 GLN N N 15 . 1 1 7 7 GLN H H 1 0.76880 0.02545 . . . 8 GLN N . 8 GLN H 19284 1 7 . 1 1 8 8 GLU N N 15 . 1 1 8 8 GLU H H 1 0.66660 0.02293 . . . 9 GLU N . 9 GLU H 19284 1 8 . 1 1 9 9 GLU N N 15 . 1 1 9 9 GLU H H 1 0.63149 0.03095 . . . 10 GLU N . 10 GLU H 19284 1 9 . 1 1 10 10 LEU N N 15 . 1 1 10 10 LEU H H 1 0.60116 0.01830 . . . 11 LEU N . 11 LEU H 19284 1 10 . 1 1 11 11 LYS N N 15 . 1 1 11 11 LYS H H 1 0.70603 0.02149 . . . 12 LYS N . 12 LYS H 19284 1 11 . 1 1 12 12 GLU N N 15 . 1 1 12 12 GLU H H 1 0.58415 0.01941 . . . 13 GLU N . 13 GLU H 19284 1 12 . 1 1 13 13 MET N N 15 . 1 1 13 13 MET H H 1 0.68523 0.04811 . . . 14 MET N . 14 MET H 19284 1 13 . 1 1 14 14 ALA N N 15 . 1 1 14 14 ALA H H 1 0.72010 0.01924 . . . 15 ALA N . 15 ALA H 19284 1 14 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 0.73324 0.02403 . . . 17 VAL N . 17 VAL H 19284 1 15 . 1 1 17 17 GLU N N 15 . 1 1 17 17 GLU H H 1 0.83985 0.03473 . . . 18 GLU N . 18 GLU H 19284 1 16 . 1 1 18 18 ILE N N 15 . 1 1 18 18 ILE H H 1 0.75894 0.02865 . . . 19 ILE N . 19 ILE H 19284 1 17 . 1 1 19 19 ALA N N 15 . 1 1 19 19 ALA H H 1 0.77072 0.00909 . . . 20 ALA N . 20 ALA H 19284 1 18 . 1 1 20 20 HIS N N 15 . 1 1 20 20 HIS H H 1 0.75061 0.02575 . . . 21 HIS N . 21 HIS H 19284 1 19 . 1 1 21 21 GLU N N 15 . 1 1 21 21 GLU H H 1 0.83047 0.03051 . . . 22 GLU N . 22 GLU H 19284 1 20 . 1 1 22 22 LEU N N 15 . 1 1 22 22 LEU H H 1 0.74654 0.17770 . . . 23 LEU N . 23 LEU H 19284 1 21 . 1 1 23 23 PHE N N 15 . 1 1 23 23 PHE H H 1 0.72968 0.00708 . . . 24 PHE N . 24 PHE H 19284 1 22 . 1 1 24 24 GLU N N 15 . 1 1 24 24 GLU H H 1 0.68415 0.01313 . . . 25 GLU N . 25 GLU H 19284 1 23 . 1 1 25 25 GLU N N 15 . 1 1 25 25 GLU H H 1 0.66280 0.02457 . . . 26 GLU N . 26 GLU H 19284 1 24 . 1 1 26 26 HIS N N 15 . 1 1 26 26 HIS H H 1 0.72298 0.06755 . . . 27 HIS N . 27 HIS H 19284 1 25 . 1 1 27 27 LYS N N 15 . 1 1 27 27 LYS H H 1 0.84171 0.04007 . . . 28 LYS N . 28 LYS H 19284 1 26 . 1 1 28 28 LYS N N 15 . 1 1 28 28 LYS H H 1 0.69827 0.01813 . . . 29 LYS N . 29 LYS H 19284 1 27 . 1 1 30 30 VAL N N 15 . 1 1 30 30 VAL H H 1 0.72425 0.03751 . . . 31 VAL N . 31 VAL H 19284 1 28 . 1 1 32 32 PHE N N 15 . 1 1 32 32 PHE H H 1 0.78693 0.02882 . . . 33 PHE N . 33 PHE H 19284 1 29 . 1 1 33 33 GLN N N 15 . 1 1 33 33 GLN H H 1 0.79805 0.01216 . . . 34 GLN N . 34 GLN H 19284 1 30 . 1 1 34 34 GLU N N 15 . 1 1 34 34 GLU H H 1 0.67544 0.01512 . . . 35 GLU N . 35 GLU H 19284 1 31 . 1 1 35 35 LEU N N 15 . 1 1 35 35 LEU H H 1 0.78881 0.03060 . . . 36 LEU N . 36 LEU H 19284 1 32 . 1 1 36 36 LEU N N 15 . 1 1 36 36 LEU H H 1 0.74181 0.04509 . . . 37 LEU N . 37 LEU H 19284 1 33 . 1 1 37 37 ASN N N 15 . 1 1 37 37 ASN H H 1 0.71539 0.02437 . . . 38 ASN N . 38 ASN H 19284 1 34 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.80142 0.05047 . . . 41 ALA N . 41 ALA H 19284 1 35 . 1 1 41 41 SER N N 15 . 1 1 41 41 SER H H 1 0.72637 0.01361 . . . 42 SER N . 42 SER H 19284 1 36 . 1 1 42 42 LEU N N 15 . 1 1 42 42 LEU H H 1 0.67875 0.03825 . . . 43 LEU N . 43 LEU H 19284 1 37 . 1 1 44 44 GLY N N 15 . 1 1 44 44 GLY H H 1 0.67199 0.02127 . . . 45 GLY N . 45 GLY H 19284 1 38 . 1 1 45 45 VAL N N 15 . 1 1 45 45 VAL H H 1 0.71625 0.01091 . . . 46 VAL N . 46 VAL H 19284 1 39 . 1 1 46 46 LYS N N 15 . 1 1 46 46 LYS H H 1 0.61021 0.02319 . . . 47 LYS N . 47 LYS H 19284 1 40 . 1 1 47 47 LYS N N 15 . 1 1 47 47 LYS H H 1 0.66378 0.02283 . . . 48 LYS N . 48 LYS H 19284 1 41 . 1 1 48 48 GLU N N 15 . 1 1 48 48 GLU H H 1 0.67778 0.02247 . . . 49 GLU N . 49 GLU H 19284 1 42 . 1 1 49 49 GLU N N 15 . 1 1 49 49 GLU H H 1 0.70744 0.02919 . . . 50 GLU N . 50 GLU H 19284 1 43 . 1 1 50 50 LEU N N 15 . 1 1 50 50 LEU H H 1 0.63728 0.01042 . . . 51 LEU N . 51 LEU H 19284 1 44 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.55136 0.02195 . . . 52 GLY N . 52 GLY H 19284 1 45 . 1 1 52 52 ASP N N 15 . 1 1 52 52 ASP H H 1 0.47921 0.06380 . . . 53 ASP N . 53 ASP H 19284 1 46 . 1 1 53 53 ARG N N 15 . 1 1 53 53 ARG H H 1 0.58764 0.00796 . . . 54 ARG N . 54 ARG H 19284 1 47 . 1 1 54 54 ILE N N 15 . 1 1 54 54 ILE H H 1 0.67354 0.02932 . . . 55 ILE N . 55 ILE H 19284 1 48 . 1 1 56 56 GLN N N 15 . 1 1 56 56 GLN H H 1 0.66415 0.00636 . . . 57 GLN N . 57 GLN H 19284 1 49 . 1 1 57 57 PHE N N 15 . 1 1 57 57 PHE H H 1 0.71822 0.02810 . . . 58 PHE N . 58 PHE H 19284 1 50 . 1 1 58 58 TYR N N 15 . 1 1 58 58 TYR H H 1 0.74199 0.03503 . . . 59 TYR N . 59 TYR H 19284 1 51 . 1 1 60 60 ASP N N 15 . 1 1 60 60 ASP H H 1 0.74414 0.02446 . . . 61 ASP N . 61 ASP H 19284 1 52 . 1 1 62 62 ASN N N 15 . 1 1 62 62 ASN H H 1 0.76508 0.05961 . . . 63 ASN N . 63 ASN H 19284 1 53 . 1 1 63 63 ILE N N 15 . 1 1 63 63 ILE H H 1 0.75188 0.07014 . . . 64 ILE N . 64 ILE H 19284 1 54 . 1 1 64 64 ASP N N 15 . 1 1 64 64 ASP H H 1 0.55216 0.08550 . . . 65 ASP N . 65 ASP H 19284 1 55 . 1 1 66 66 ARG N N 15 . 1 1 66 66 ARG H H 1 0.78933 0.03165 . . . 67 ARG N . 67 ARG H 19284 1 56 . 1 1 67 67 PHE N N 15 . 1 1 67 67 PHE H H 1 0.87069 0.08793 . . . 68 PHE N . 68 PHE H 19284 1 57 . 1 1 68 68 LEU N N 15 . 1 1 68 68 LEU H H 1 0.78983 0.05666 . . . 69 LEU N . 69 LEU H 19284 1 58 . 1 1 69 69 ALA N N 15 . 1 1 69 69 ALA H H 1 0.69907 0.01616 . . . 70 ALA N . 70 ALA H 19284 1 59 . 1 1 71 71 SER N N 15 . 1 1 71 71 SER H H 1 0.57995 0.03370 . . . 72 SER N . 72 SER H 19284 1 60 . 1 1 72 72 ASP N N 15 . 1 1 72 72 ASP H H 1 0.72070 0.02671 . . . 73 ASP N . 73 ASP H 19284 1 61 . 1 1 73 73 GLN N N 15 . 1 1 73 73 GLN H H 1 0.66631 0.04908 . . . 74 GLN N . 74 GLN H 19284 1 62 . 1 1 74 74 THR N N 15 . 1 1 74 74 THR H H 1 0.67860 0.02834 . . . 75 THR N . 75 THR H 19284 1 63 . 1 1 75 75 TRP N N 15 . 1 1 75 75 TRP H H 1 0.87984 0.12077 . . . 76 TRP N . 76 TRP H 19284 1 64 . 1 1 76 76 GLY N N 15 . 1 1 76 76 GLY H H 1 0.79108 0.02064 . . . 77 GLY N . 77 GLY H 19284 1 65 . 1 1 79 79 SER N N 15 . 1 1 79 79 SER H H 1 0.73692 0.05553 . . . 80 SER N . 80 SER H 19284 1 66 . 1 1 80 80 TRP N N 15 . 1 1 80 80 TRP H H 1 0.75725 0.02026 . . . 81 TRP N . 81 TRP H 19284 1 67 . 1 1 81 81 TYR N N 15 . 1 1 81 81 TYR H H 1 0.74202 0.00989 . . . 82 TYR N . 82 TYR H 19284 1 68 . 1 1 84 84 ASP N N 15 . 1 1 84 84 ASP H H 1 0.17947 0.00700 . . . 85 ASP N . 85 ASP H 19284 1 69 . 1 1 86 86 LEU N N 15 . 1 1 86 86 LEU H H 1 -0.04303 0.00314 . . . 87 LEU N . 87 LEU H 19284 1 70 . 1 1 89 89 GLU N N 15 . 1 1 89 89 GLU H H 1 -0.07710 0.02784 . . . 90 GLU N . 90 GLU H 19284 1 71 . 1 1 90 90 THR N N 15 . 1 1 90 90 THR H H 1 -0.17320 0.00592 . . . 91 THR N . 91 THR H 19284 1 72 . 1 1 91 91 GLN N N 15 . 1 1 91 91 GLN H H 1 -0.22013 0.00502 . . . 92 GLN N . 92 GLN H 19284 1 73 . 1 1 93 93 THR N N 15 . 1 1 93 93 THR H H 1 -0.14788 0.01736 . . . 94 THR N . 94 THR H 19284 1 74 . 1 1 94 94 VAL N N 15 . 1 1 94 94 VAL H H 1 -0.13812 0.00553 . . . 95 VAL N . 95 VAL H 19284 1 75 . 1 1 96 96 ALA N N 15 . 1 1 96 96 ALA H H 1 0.02890 0.00612 . . . 97 ALA N . 97 ALA H 19284 1 76 . 1 1 97 97 LYS N N 15 . 1 1 97 97 LYS H H 1 0.27646 0.03980 . . . 98 LYS N . 98 LYS H 19284 1 77 . 1 1 101 101 ALA N N 15 . 1 1 101 101 ALA H H 1 0.20688 0.00047 . . . 102 ALA N . 102 ALA H 19284 1 78 . 1 1 105 105 VAL N N 15 . 1 1 105 105 VAL H H 1 0.01002 0.00252 . . . 106 VAL N . 106 VAL H 19284 1 79 . 1 1 114 114 PHE N N 15 . 1 1 114 114 PHE H H 1 0.07394 0.01080 . . . 115 PHE N . 115 PHE H 19284 1 80 . 1 1 115 115 GLU N N 15 . 1 1 115 115 GLU H H 1 0.07345 0.01519 . . . 116 GLU N . 116 GLU H 19284 1 81 . 1 1 117 117 ILE N N 15 . 1 1 117 117 ILE H H 1 0.04781 0.01444 . . . 118 ILE N . 118 ILE H 19284 1 82 . 1 1 118 118 ASP N N 15 . 1 1 118 118 ASP H H 1 0.02628 0.01484 . . . 119 ASP N . 119 ASP H 19284 1 83 . 1 1 120 120 ASP N N 15 . 1 1 120 120 ASP H H 1 0.06577 0.01725 . . . 121 ASP N . 121 ASP H 19284 1 84 . 1 1 121 121 ASP N N 15 . 1 1 121 121 ASP H H 1 0.05100 0.01174 . . . 122 ASP N . 122 ASP H 19284 1 85 . 1 1 126 126 GLU N N 15 . 1 1 126 126 GLU H H 1 -0.16924 0.00937 . . . 127 GLU N . 127 GLU H 19284 1 86 . 1 1 127 127 VAL N N 15 . 1 1 127 127 VAL H H 1 -0.24021 0.00236 . . . 128 VAL N . 128 VAL H 19284 1 87 . 1 1 128 128 GLU N N 15 . 1 1 128 128 GLU H H 1 -0.34037 0.01284 . . . 129 GLU N . 129 GLU H 19284 1 88 . 1 1 129 129 GLU N N 15 . 1 1 129 129 GLU H H 1 -0.31494 0.01178 . . . 130 GLU N . 130 GLU H 19284 1 89 . 1 1 135 135 ALA N N 15 . 1 1 135 135 ALA H H 1 -0.43691 0.00584 . . . 136 ALA N . 136 ALA H 19284 1 90 . 1 1 138 138 PHE N N 15 . 1 1 138 138 PHE H H 1 -0.42343 0.00769 . . . 139 PHE N . 139 PHE H 19284 1 91 . 1 1 140 140 GLU N N 15 . 1 1 140 140 GLU H H 1 -0.42138 0.00872 . . . 141 GLU N . 141 GLU H 19284 1 92 . 1 1 141 141 GLU N N 15 . 1 1 141 141 GLU H H 1 -0.43657 0.00854 . . . 142 GLU N . 142 GLU H 19284 1 93 . 1 1 152 152 ILE N N 15 . 1 1 152 152 ILE H H 1 -0.53211 0.00741 . . . 153 ILE N . 153 ILE H 19284 1 94 . 1 1 153 153 GLU N N 15 . 1 1 153 153 GLU H H 1 -0.52455 0.00775 . . . 154 GLU N . 154 GLU H 19284 1 95 . 1 1 155 155 ASP N N 15 . 1 1 155 155 ASP H H 1 -0.45493 0.00282 . . . 156 ASP N . 156 ASP H 19284 1 96 . 1 1 156 156 ILE N N 15 . 1 1 156 156 ILE H H 1 -0.46218 0.00732 . . . 157 ILE N . 157 ILE H 19284 1 97 . 1 1 157 157 ILE N N 15 . 1 1 157 157 ILE H H 1 -0.54678 0.01519 . . . 158 ILE N . 158 ILE H 19284 1 98 . 1 1 158 158 ASP N N 15 . 1 1 158 158 ASP H H 1 -0.50483 0.01225 . . . 159 ASP N . 159 ASP H 19284 1 99 . 1 1 163 163 ASP N N 15 . 1 1 163 163 ASP H H 1 -0.39164 0.01186 . . . 164 ASP N . 164 ASP H 19284 1 100 . 1 1 164 164 TYR N N 15 . 1 1 164 164 TYR H H 1 -0.37959 0.01006 . . . 165 TYR N . 165 TYR H 19284 1 101 . 1 1 165 165 ASP N N 15 . 1 1 165 165 ASP H H 1 -0.45535 0.00992 . . . 166 ASP N . 166 ASP H 19284 1 102 . 1 1 167 167 GLU N N 15 . 1 1 167 167 GLU H H 1 -0.69620 0.00683 . . . 168 GLU N . 168 GLU H 19284 1 103 . 1 1 172 172 LYS N N 15 . 1 1 172 172 LYS H H 1 -1.40559 0.01482 . . . 173 LYS N . 173 LYS H 19284 1 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 19284 _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 600 _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 3 '2D R1 15N,1H correlation' . . . 19284 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 2 2 ILE N N 15 1.42530 0.05477 . . 3 ILE N 19284 1 2 . 1 1 3 3 LYS N N 15 1.43863 0.01642 . . 4 LYS N 19284 1 3 . 1 1 4 4 GLN N N 15 1.47582 0.01762 . . 5 GLN N 19284 1 4 . 1 1 5 5 TYR N N 15 1.44358 0.01858 . . 6 TYR N 19284 1 5 . 1 1 6 6 SER N N 15 1.59456 0.03081 . . 7 SER N 19284 1 6 . 1 1 7 7 GLN N N 15 1.59528 0.02009 . . 8 GLN N 19284 1 7 . 1 1 8 8 GLU N N 15 1.60512 0.00922 . . 9 GLU N 19284 1 8 . 1 1 9 9 GLU N N 15 1.55737 0.01275 . . 10 GLU N 19284 1 9 . 1 1 10 10 LEU N N 15 1.51319 0.01105 . . 11 LEU N 19284 1 10 . 1 1 11 11 LYS N N 15 1.53318 0.01836 . . 12 LYS N 19284 1 11 . 1 1 12 12 GLU N N 15 1.60358 0.01377 . . 13 GLU N 19284 1 12 . 1 1 13 13 MET N N 15 1.44067 0.01579 . . 14 MET N 19284 1 13 . 1 1 14 14 ALA N N 15 1.50041 0.00983 . . 15 ALA N 19284 1 14 . 1 1 16 16 VAL N N 15 1.59534 0.01500 . . 17 VAL N 19284 1 15 . 1 1 17 17 GLU N N 15 1.53744 0.01799 . . 18 GLU N 19284 1 16 . 1 1 18 18 ILE N N 15 1.58272 0.02196 . . 19 ILE N 19284 1 17 . 1 1 19 19 ALA N N 15 1.67229 0.01630 . . 20 ALA N 19284 1 18 . 1 1 20 20 HIS N N 15 1.56330 0.02578 . . 21 HIS N 19284 1 19 . 1 1 21 21 GLU N N 15 1.51444 0.01530 . . 22 GLU N 19284 1 20 . 1 1 22 22 LEU N N 15 1.55063 0.01974 . . 23 LEU N 19284 1 21 . 1 1 23 23 PHE N N 15 1.62548 0.02746 . . 24 PHE N 19284 1 22 . 1 1 24 24 GLU N N 15 1.58363 0.01705 . . 25 GLU N 19284 1 23 . 1 1 25 25 GLU N N 15 1.53044 0.01985 . . 26 GLU N 19284 1 24 . 1 1 26 26 HIS N N 15 1.58214 0.02608 . . 27 HIS N 19284 1 25 . 1 1 27 27 LYS N N 15 1.61490 0.04688 . . 28 LYS N 19284 1 26 . 1 1 28 28 LYS N N 15 1.33918 0.01390 . . 29 LYS N 19284 1 27 . 1 1 30 30 VAL N N 15 1.60411 0.02440 . . 31 VAL N 19284 1 28 . 1 1 32 32 PHE N N 15 1.47422 0.01920 . . 33 PHE N 19284 1 29 . 1 1 33 33 GLN N N 15 1.45971 0.01247 . . 34 GLN N 19284 1 30 . 1 1 34 34 GLU N N 15 1.36078 0.01357 . . 35 GLU N 19284 1 31 . 1 1 35 35 LEU N N 15 1.49329 0.01347 . . 36 LEU N 19284 1 32 . 1 1 36 36 LEU N N 15 1.51389 0.01284 . . 37 LEU N 19284 1 33 . 1 1 37 37 ASN N N 15 1.41674 0.01192 . . 38 ASN N 19284 1 34 . 1 1 38 38 GLU N N 15 1.42440 0.00986 . . 39 GLU N 19284 1 35 . 1 1 40 40 ALA N N 15 1.49834 0.01197 . . 41 ALA N 19284 1 36 . 1 1 41 41 SER N N 15 1.36545 0.00839 . . 42 SER N 19284 1 37 . 1 1 42 42 LEU N N 15 1.47101 0.01037 . . 43 LEU N 19284 1 38 . 1 1 44 44 GLY N N 15 1.36814 0.01471 . . 45 GLY N 19284 1 39 . 1 1 45 45 VAL N N 15 1.33938 0.01104 . . 46 VAL N 19284 1 40 . 1 1 46 46 LYS N N 15 1.36580 0.01043 . . 47 LYS N 19284 1 41 . 1 1 47 47 LYS N N 15 1.64267 0.01227 . . 48 LYS N 19284 1 42 . 1 1 48 48 GLU N N 15 1.67962 0.01083 . . 49 GLU N 19284 1 43 . 1 1 49 49 GLU N N 15 1.60634 0.01139 . . 50 GLU N 19284 1 44 . 1 1 50 50 LEU N N 15 1.60694 0.01274 . . 51 LEU N 19284 1 45 . 1 1 51 51 GLY N N 15 1.61448 0.00952 . . 52 GLY N 19284 1 46 . 1 1 52 52 ASP N N 15 1.47687 0.03607 . . 53 ASP N 19284 1 47 . 1 1 53 53 ARG N N 15 1.63652 0.01265 . . 54 ARG N 19284 1 48 . 1 1 54 54 ILE N N 15 1.43080 0.01302 . . 55 ILE N 19284 1 49 . 1 1 56 56 GLN N N 15 1.35889 0.01121 . . 57 GLN N 19284 1 50 . 1 1 57 57 PHE N N 15 1.43803 0.01304 . . 58 PHE N 19284 1 51 . 1 1 58 58 TYR N N 15 1.44416 0.01414 . . 59 TYR N 19284 1 52 . 1 1 60 60 ASP N N 15 1.41377 0.01251 . . 61 ASP N 19284 1 53 . 1 1 62 62 ASN N N 15 1.34234 0.02388 . . 63 ASN N 19284 1 54 . 1 1 63 63 ILE N N 15 1.24780 0.02874 . . 64 ILE N 19284 1 55 . 1 1 64 64 ASP N N 15 1.46355 0.03271 . . 65 ASP N 19284 1 56 . 1 1 66 66 ARG N N 15 1.46673 0.02524 . . 67 ARG N 19284 1 57 . 1 1 67 67 PHE N N 15 1.71115 0.02461 . . 68 PHE N 19284 1 58 . 1 1 68 68 LEU N N 15 1.47519 0.01726 . . 69 LEU N 19284 1 59 . 1 1 69 69 ALA N N 15 1.53170 0.01633 . . 70 ALA N 19284 1 60 . 1 1 71 71 SER N N 15 1.45987 0.03321 . . 72 SER N 19284 1 61 . 1 1 72 72 ASP N N 15 1.59107 0.03206 . . 73 ASP N 19284 1 62 . 1 1 73 73 GLN N N 15 1.48871 0.02475 . . 74 GLN N 19284 1 63 . 1 1 74 74 THR N N 15 1.22024 0.01969 . . 75 THR N 19284 1 64 . 1 1 75 75 TRP N N 15 1.46682 0.02356 . . 76 TRP N 19284 1 65 . 1 1 76 76 GLY N N 15 1.55757 0.02416 . . 77 GLY N 19284 1 66 . 1 1 79 79 SER N N 15 1.40933 0.01909 . . 80 SER N 19284 1 67 . 1 1 80 80 TRP N N 15 1.58859 0.01534 . . 81 TRP N 19284 1 68 . 1 1 81 81 TYR N N 15 1.54105 0.01618 . . 82 TYR N 19284 1 69 . 1 1 84 84 ASP N N 15 1.47634 0.00588 . . 85 ASP N 19284 1 70 . 1 1 85 85 GLN N N 15 1.46835 0.00535 . . 86 GLN N 19284 1 71 . 1 1 86 86 LEU N N 15 1.43470 0.00511 . . 87 LEU N 19284 1 72 . 1 1 89 89 GLU N N 15 1.43481 0.00488 . . 90 GLU N 19284 1 73 . 1 1 90 90 THR N N 15 1.38443 0.00664 . . 91 THR N 19284 1 74 . 1 1 91 91 GLN N N 15 1.38362 0.00651 . . 92 GLN N 19284 1 75 . 1 1 93 93 THR N N 15 1.37895 0.00749 . . 94 THR N 19284 1 76 . 1 1 94 94 VAL N N 15 1.38695 0.00540 . . 95 VAL N 19284 1 77 . 1 1 96 96 ALA N N 15 1.46315 0.00668 . . 97 ALA N 19284 1 78 . 1 1 100 100 LYS N N 15 1.68195 0.00682 . . 101 LYS N 19284 1 79 . 1 1 101 101 ALA N N 15 1.64519 0.00664 . . 102 ALA N 19284 1 80 . 1 1 105 105 VAL N N 15 1.48438 0.00439 . . 106 VAL N 19284 1 81 . 1 1 114 114 PHE N N 15 1.55268 0.00442 . . 115 PHE N 19284 1 82 . 1 1 115 115 GLU N N 15 1.56767 0.00526 . . 116 GLU N 19284 1 83 . 1 1 117 117 ILE N N 15 1.50471 0.00472 . . 118 ILE N 19284 1 84 . 1 1 118 118 ASP N N 15 1.56632 0.00489 . . 119 ASP N 19284 1 85 . 1 1 120 120 ASP N N 15 1.54818 0.00432 . . 121 ASP N 19284 1 86 . 1 1 121 121 ASP N N 15 1.52272 0.00411 . . 122 ASP N 19284 1 87 . 1 1 126 126 GLU N N 15 1.37534 0.00333 . . 127 GLU N 19284 1 88 . 1 1 127 127 VAL N N 15 1.32153 0.00364 . . 128 VAL N 19284 1 89 . 1 1 128 128 GLU N N 15 1.35863 0.00369 . . 129 GLU N 19284 1 90 . 1 1 134 134 GLU N N 15 1.32794 0.00306 . . 135 GLU N 19284 1 91 . 1 1 135 135 ALA N N 15 1.23652 0.00294 . . 136 ALA N 19284 1 92 . 1 1 138 138 PHE N N 15 1.26217 0.00318 . . 139 PHE N 19284 1 93 . 1 1 140 140 GLU N N 15 1.26494 0.00286 . . 141 GLU N 19284 1 94 . 1 1 151 151 GLU N N 15 1.29827 0.00327 . . 152 GLU N 19284 1 95 . 1 1 152 152 ILE N N 15 1.22971 0.00299 . . 153 ILE N 19284 1 96 . 1 1 153 153 GLU N N 15 1.28766 0.00313 . . 154 GLU N 19284 1 97 . 1 1 155 155 ASP N N 15 1.27918 0.00278 . . 156 ASP N 19284 1 98 . 1 1 156 156 ILE N N 15 1.21288 0.00282 . . 157 ILE N 19284 1 99 . 1 1 157 157 ILE N N 15 1.26718 0.00358 . . 158 ILE N 19284 1 100 . 1 1 158 158 ASP N N 15 1.29446 0.00384 . . 159 ASP N 19284 1 101 . 1 1 163 163 ASP N N 15 1.33612 0.00337 . . 164 ASP N 19284 1 102 . 1 1 164 164 TYR N N 15 1.27387 0.00323 . . 165 TYR N 19284 1 103 . 1 1 166 166 ASP N N 15 1.30826 0.00284 . . 167 ASP N 19284 1 104 . 1 1 169 169 GLU N N 15 1.26450 0.00213 . . 170 GLU N 19284 1 105 . 1 1 172 172 LYS N N 15 0.94864 0.00183 . . 173 LYS N 19284 1 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 19284 _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 600 _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 4 '2D R2 15N,1H correlation' . . . 19284 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 2 2 ILE N N 15 8.45160 0.30166 . . . . 3 ILE N 19284 1 2 . 1 1 3 3 LYS N N 15 10.78835 0.10805 . . . . 4 LYS N 19284 1 3 . 1 1 4 4 GLN N N 15 11.12748 0.12228 . . . . 5 GLN N 19284 1 4 . 1 1 5 5 TYR N N 15 9.09519 0.10905 . . . . 6 TYR N 19284 1 5 . 1 1 6 6 SER N N 15 9.00956 0.15756 . . . . 7 SER N 19284 1 6 . 1 1 7 7 GLN N N 15 9.78065 0.11629 . . . . 8 GLN N 19284 1 7 . 1 1 8 8 GLU N N 15 9.32522 0.04845 . . . . 9 GLU N 19284 1 8 . 1 1 9 9 GLU N N 15 9.12793 0.07258 . . . . 10 GLU N 19284 1 9 . 1 1 10 10 LEU N N 15 9.35223 0.06187 . . . . 11 LEU N 19284 1 10 . 1 1 11 11 LYS N N 15 11.23718 0.11732 . . . . 12 LYS N 19284 1 11 . 1 1 12 12 GLU N N 15 9.10510 0.07233 . . . . 13 GLU N 19284 1 12 . 1 1 13 13 MET N N 15 9.63251 0.09502 . . . . 14 MET N 19284 1 13 . 1 1 14 14 ALA N N 15 9.59264 0.05639 . . . . 15 ALA N 19284 1 14 . 1 1 16 16 VAL N N 15 14.16852 0.12001 . . . . 17 VAL N 19284 1 15 . 1 1 17 17 GLU N N 15 12.44221 0.12722 . . . . 18 GLU N 19284 1 16 . 1 1 18 18 ILE N N 15 10.82105 0.13950 . . . . 19 ILE N 19284 1 17 . 1 1 19 19 ALA N N 15 10.67352 0.09184 . . . . 20 ALA N 19284 1 18 . 1 1 20 20 HIS N N 15 10.41448 0.15325 . . . . 21 HIS N 19284 1 19 . 1 1 21 21 GLU N N 15 11.43324 0.10520 . . . . 22 GLU N 19284 1 20 . 1 1 22 22 LEU N N 15 6.87579 0.08643 . . . . 23 LEU N 19284 1 21 . 1 1 23 23 PHE N N 15 10.77651 0.16754 . . . . 24 PHE N 19284 1 22 . 1 1 24 24 GLU N N 15 10.61656 0.10361 . . . . 25 GLU N 19284 1 23 . 1 1 25 25 GLU N N 15 10.53542 0.12779 . . . . 26 GLU N 19284 1 24 . 1 1 26 26 HIS N N 15 9.47800 0.13921 . . . . 27 HIS N 19284 1 25 . 1 1 27 27 LYS N N 15 12.34904 0.33331 . . . . 28 LYS N 19284 1 26 . 1 1 28 28 LYS N N 15 12.77032 0.11652 . . . . 29 LYS N 19284 1 27 . 1 1 30 30 VAL N N 15 12.72958 0.17681 . . . . 31 VAL N 19284 1 28 . 1 1 32 32 PHE N N 15 12.51045 0.14704 . . . . 33 PHE N 19284 1 29 . 1 1 33 33 GLN N N 15 11.67439 0.09210 . . . . 34 GLN N 19284 1 30 . 1 1 34 34 GLU N N 15 13.10607 0.11535 . . . . 35 GLU N 19284 1 31 . 1 1 35 35 LEU N N 15 11.44168 0.10171 . . . . 36 LEU N 19284 1 32 . 1 1 36 36 LEU N N 15 11.55448 0.08636 . . . . 37 LEU N 19284 1 33 . 1 1 37 37 ASN N N 15 12.49751 0.09323 . . . . 38 ASN N 19284 1 34 . 1 1 38 38 GLU N N 15 9.55092 0.06514 . . . . 39 GLU N 19284 1 35 . 1 1 40 40 ALA N N 15 11.18291 0.08178 . . . . 41 ALA N 19284 1 36 . 1 1 41 41 SER N N 15 12.32895 0.06742 . . . . 42 SER N 19284 1 37 . 1 1 42 42 LEU N N 15 11.72776 0.07716 . . . . 43 LEU N 19284 1 38 . 1 1 44 44 GLY N N 15 11.76330 0.11368 . . . . 45 GLY N 19284 1 39 . 1 1 45 45 VAL N N 15 11.60907 0.09309 . . . . 46 VAL N 19284 1 40 . 1 1 46 46 LYS N N 15 9.97798 0.06683 . . . . 47 LYS N 19284 1 41 . 1 1 47 47 LYS N N 15 9.36195 0.06413 . . . . 48 LYS N 19284 1 42 . 1 1 48 48 GLU N N 15 9.51432 0.05646 . . . . 49 GLU N 19284 1 43 . 1 1 49 49 GLU N N 15 9.59210 0.06165 . . . . 50 GLU N 19284 1 44 . 1 1 50 50 LEU N N 15 9.43753 0.07035 . . . . 51 LEU N 19284 1 45 . 1 1 51 51 GLY N N 15 7.72780 0.04554 . . . . 52 GLY N 19284 1 46 . 1 1 52 52 ASP N N 15 9.00673 0.20668 . . . . 53 ASP N 19284 1 47 . 1 1 53 53 ARG N N 15 9.63480 0.06887 . . . . 54 ARG N 19284 1 48 . 1 1 54 54 ILE N N 15 12.39629 0.10329 . . . . 55 ILE N 19284 1 49 . 1 1 56 56 GLN N N 15 13.35708 0.09531 . . . . 57 GLN N 19284 1 50 . 1 1 57 57 PHE N N 15 12.40143 0.09913 . . . . 58 PHE N 19284 1 51 . 1 1 58 58 TYR N N 15 12.99889 0.10969 . . . . 59 TYR N 19284 1 52 . 1 1 60 60 ASP N N 15 13.33449 0.10441 . . . . 61 ASP N 19284 1 53 . 1 1 62 62 ASN N N 15 21.55506 0.32900 . . . . 63 ASN N 19284 1 54 . 1 1 63 63 ILE N N 15 18.86243 0.38098 . . . . 64 ILE N 19284 1 55 . 1 1 64 64 ASP N N 15 9.36150 0.21051 . . . . 65 ASP N 19284 1 56 . 1 1 66 66 ARG N N 15 12.59668 0.19313 . . . . 67 ARG N 19284 1 57 . 1 1 67 67 PHE N N 15 10.62030 0.14157 . . . . 68 PHE N 19284 1 58 . 1 1 68 68 LEU N N 15 10.93778 0.11293 . . . . 69 LEU N 19284 1 59 . 1 1 69 69 ALA N N 15 9.57966 0.10113 . . . . 70 ALA N 19284 1 60 . 1 1 71 71 SER N N 15 10.06416 0.20384 . . . . 72 SER N 19284 1 61 . 1 1 72 72 ASP N N 15 9.54870 0.17751 . . . . 73 ASP N 19284 1 62 . 1 1 73 73 GLN N N 15 13.12466 0.19112 . . . . 74 GLN N 19284 1 63 . 1 1 74 74 THR N N 15 12.79290 0.17382 . . . . 75 THR N 19284 1 64 . 1 1 75 75 TRP N N 15 10.55604 0.14529 . . . . 76 TRP N 19284 1 65 . 1 1 76 76 GLY N N 15 10.15790 0.14259 . . . . 77 GLY N 19284 1 66 . 1 1 79 79 SER N N 15 12.69619 0.15363 . . . . 80 SER N 19284 1 67 . 1 1 80 80 TRP N N 15 11.06915 0.09699 . . . . 81 TRP N 19284 1 68 . 1 1 81 81 TYR N N 15 10.27878 0.10490 . . . . 82 TYR N 19284 1 69 . 1 1 84 84 ASP N N 15 4.08590 0.02342 . . . . 85 ASP N 19284 1 70 . 1 1 85 85 GLN N N 15 4.32749 0.02178 . . . . 86 GLN N 19284 1 71 . 1 1 86 86 LEU N N 15 3.33845 0.01874 . . . . 87 LEU N 19284 1 72 . 1 1 89 89 GLU N N 15 3.15425 0.01751 . . . . 90 GLU N 19284 1 73 . 1 1 90 90 THR N N 15 3.17121 0.02487 . . . . 91 THR N 19284 1 74 . 1 1 91 91 GLN N N 15 3.37413 0.02485 . . . . 92 GLN N 19284 1 75 . 1 1 93 93 THR N N 15 3.48766 0.02970 . . . . 94 THR N 19284 1 76 . 1 1 94 94 VAL N N 15 3.30489 0.02158 . . . . 95 VAL N 19284 1 77 . 1 1 96 96 ALA N N 15 3.75828 0.02414 . . . . 97 ALA N 19284 1 78 . 1 1 100 100 LYS N N 15 4.59895 0.02334 . . . . 101 LYS N 19284 1 79 . 1 1 101 101 ALA N N 15 4.05442 0.02286 . . . . 102 ALA N 19284 1 80 . 1 1 105 105 VAL N N 15 3.35060 0.01598 . . . . 106 VAL N 19284 1 81 . 1 1 114 114 PHE N N 15 3.35430 0.01579 . . . . 115 PHE N 19284 1 82 . 1 1 115 115 GLU N N 15 3.44651 0.01782 . . . . 116 GLU N 19284 1 83 . 1 1 117 117 ILE N N 15 3.22982 0.01636 . . . . 118 ILE N 19284 1 84 . 1 1 118 118 ASP N N 15 3.34869 0.01693 . . . . 119 ASP N 19284 1 85 . 1 1 120 120 ASP N N 15 3.33157 0.01418 . . . . 121 ASP N 19284 1 86 . 1 1 121 121 ASP N N 15 3.16354 0.01421 . . . . 122 ASP N 19284 1 87 . 1 1 126 126 GLU N N 15 2.67267 0.01221 . . . . 127 GLU N 19284 1 88 . 1 1 127 127 VAL N N 15 2.95242 0.01464 . . . . 128 VAL N 19284 1 89 . 1 1 128 128 GLU N N 15 2.93953 0.01355 . . . . 129 GLU N 19284 1 90 . 1 1 134 134 GLU N N 15 2.30284 0.01092 . . . . 135 GLU N 19284 1 91 . 1 1 135 135 ALA N N 15 2.38873 0.01161 . . . . 136 ALA N 19284 1 92 . 1 1 138 138 PHE N N 15 2.08387 0.01235 . . . . 139 PHE N 19284 1 93 . 1 1 140 140 GLU N N 15 2.19976 0.01077 . . . . 141 GLU N 19284 1 94 . 1 1 151 151 GLU N N 15 2.19739 0.01205 . . . . 152 GLU N 19284 1 95 . 1 1 152 152 ILE N N 15 2.51198 0.01195 . . . . 153 ILE N 19284 1 96 . 1 1 153 153 GLU N N 15 2.38118 0.01131 . . . . 154 GLU N 19284 1 97 . 1 1 155 155 ASP N N 15 2.38440 0.01015 . . . . 156 ASP N 19284 1 98 . 1 1 156 156 ILE N N 15 2.20536 0.01095 . . . . 157 ILE N 19284 1 99 . 1 1 157 157 ILE N N 15 2.24128 0.01344 . . . . 158 ILE N 19284 1 100 . 1 1 158 158 ASP N N 15 2.39158 0.01369 . . . . 159 ASP N 19284 1 101 . 1 1 163 163 ASP N N 15 1.87153 0.01251 . . . . 164 ASP N 19284 1 102 . 1 1 164 164 TYR N N 15 1.67596 0.01222 . . . . 165 TYR N 19284 1 103 . 1 1 166 166 ASP N N 15 1.70457 0.01036 . . . . 167 ASP N 19284 1 104 . 1 1 169 169 GLU N N 15 1.51611 0.00783 . . . . 170 GLU N 19284 1 105 . 1 1 172 172 LYS N N 15 1.07272 0.00767 . . . . 173 LYS N 19284 1 stop_ save_