data_16580 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16580 _Entry.Title ; 2J coupling constants in Ribonuclease T1 from Aspergillus oryzae ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-10-25 _Entry.Accession_date 2009-10-25 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.112 _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 Jurgen Schmidt . M. . 16580 2 Frank Lohr . . . 16580 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID coupling_constants 10 16580 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'coupling constants' 824 16580 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 2 . . 2010-05-18 2009-10-25 update BMRB 'complete entry citation' 16580 1 . . 2010-02-08 2009-10-25 original author 'original release' 16580 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 133 '1H chemical shift assignments for Ribonuclease T1' 16580 BMRB 15905 '1J coupling constants related to the Ca carbons in Ribonuclease T1' 16580 BMRB 16469 '3J coupling constants related to the phi-torsions in Ribonuclease T1' 16580 BMRB 16579 '2J coupling constants in oxidised Flavodxin' 16580 BMRB 1658 '15N chemical shift assignments for Ribonuclease T1' 16580 BMRB 16581 '2J coupling constants in Frataxin C-terminal domain' 16580 BMRB 16582 '2J coupling constants in human Ubiquitin' 16580 BMRB 16583 '2J coupling constants in Xylanase' 16580 BMRB 16584 '2J coupling constants in DFPase' 16580 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16580 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20131375 _Citation.Full_citation . _Citation.Title 'Correlation of (2)J couplings with protein secondary structure.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full Proteins _Citation.Journal_volume 78 _Citation.Journal_issue 6 _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 1544 _Citation.Page_last 1562 _Citation.Year 2010 _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 Jurgen Schmidt . M. . 16580 1 2 Yixun Hua . . . 16580 1 3 Frank Lohr . . . 16580 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'data mining' 16580 1 statistics 16580 1 'torsion angles' 16580 1 'two-bond coupling' 16580 1 stop_ save_ save_Vuister_&_Bax_1992 _Citation.Sf_category citations _Citation.Sf_framecode Vuister_&_Bax_1992 _Citation.Entry_ID 16580 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 1511238 _Citation.Full_citation . _Citation.Title ; Measurement of two-bond JCOHa coupling constants in proteins uniformly enriched with 13C ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 2 _Citation.Journal_issue . _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 401 _Citation.Page_last 405 _Citation.Year 1992 _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 G. Vuister . W. . 16580 2 2 A. Bax . . . 16580 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JHACO measurement' 16580 2 stop_ save_ save_Lohr_&_Ruterjans_1995 _Citation.Sf_category citations _Citation.Sf_framecode Lohr_&_Ruterjans_1995 _Citation.Entry_ID 16580 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 7881271 _Citation.Full_citation . _Citation.Title '(H)NCAHA and (H)CANNH experiments for the determination of the vicinal coupling constants related to the phi-torsion angle.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 5 _Citation.Journal_issue . _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 25 _Citation.Page_last 36 _Citation.Year 1995 _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 F. Lohr . . . 16580 3 2 H. Ruterjans . . . 16580 3 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JCOHN measurement' 16580 3 stop_ save_ save_Wang_&_Bax_1996 _Citation.Sf_category citations _Citation.Sf_framecode Wang_&_Bax_1996 _Citation.Entry_ID 16580 _Citation.ID 4 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Determination of the backbone dihedral angle in human ubiquitin from reparametrized empirical Karplus equations ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 118 _Citation.Journal_issue . _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 2483 _Citation.Page_last 2494 _Citation.Year 1996 _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 A. Wang . C. . 16580 4 2 A. Bax . . . 16580 4 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JN_CB measurement' 16580 4 stop_ save_ save_Salzmann_et_al_1999 _Citation.Sf_category citations _Citation.Sf_framecode Salzmann_et_al_1999 _Citation.Entry_ID 16580 _Citation.ID 5 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title '[13C]-constant-time [15N,1H]-TROSY-HNCA for sequential assignment of large proteins.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue . _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 85 _Citation.Page_last 88 _Citation.Year 1999 _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 M. Salzmann . . . 16580 5 2 K. Pervushin . . . 16580 5 3 G. Wider . . . 16580 5 4 H. Senn . . . 16580 5 5 K. Wuthrich . . . 16580 5 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JCOCA measurement;' 16580 5 '2JCOHN measurement;' 16580 5 '2JN_CO measurement;' 16580 5 'TROSY method' 16580 5 stop_ save_ save_Permi_&_Annila_2000 _Citation.Sf_category citations _Citation.Sf_framecode Permi_&_Annila_2000 _Citation.Entry_ID 16580 _Citation.ID 6 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 10805128 _Citation.Full_citation . _Citation.Title 'Transverse relaxation optimised spin-state selective NMR experiments for measurement of residual dipolar couplings' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 16 _Citation.Journal_issue . _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 221 _Citation.Page_last 227 _Citation.Year 2000 _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 P. Permi . . . 16580 6 2 A. Annila . . . 16580 6 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JCAN_ measurement' 16580 6 '2JCOHN measurement' 16580 6 '2JHNCA measurement' 16580 6 'IPAP method' 16580 6 stop_ save_ save_Permi_2003 _Citation.Sf_category citations _Citation.Sf_framecode Permi_2003 _Citation.Entry_ID 16580 _Citation.ID 7 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 14512731 _Citation.Full_citation . _Citation.Title 'Measurement of residual dipolar couplings from 1Halpha to 13Calpha and 15N using a simple HNCA-based experiment' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 27 _Citation.Journal_issue . _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 341 _Citation.Page_last 349 _Citation.Year 2003 _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 P. Permi . . . 16580 7 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JN_HA measurement' 16580 7 stop_ save_ save_Kazimierczuk_et_al_2008 _Citation.Sf_category citations _Citation.Sf_framecode Kazimierczuk_et_al_2008 _Citation.Entry_ID 16580 _Citation.ID 8 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18376830 _Citation.Full_citation . _Citation.Title ; Determination of spin-spin couplings from ultrahigh resolution 3D NMR spectra obtained by optimized random sampling and multidimensional Fourier transformation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 130 _Citation.Journal_issue . _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 5404 _Citation.Page_last 5405 _Citation.Year 2008 _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 K. Kazimierczuk . . . 16580 8 2 A. Zawadzka . . . 16580 8 3 W. Kozminski . . . 16580 8 4 I. Zhukov . . . 16580 8 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '2JCAN_ measurement' 16580 8 '2JCOCA measurement' 16580 8 '2JHNCA measurement' 16580 8 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16580 _Assembly.ID 1 _Assembly.Name 'Ribonuclease T1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 11089.3 _Assembly.Enzyme_commission_number 3.1.27.3 _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 protein 1 $RNase_T1 A . yes native no no . . . 16580 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 1IYY . . 'solution NMR' . 'RNaseT1 (Gln25 isoenzyme)' . 16580 1 yes PDB 1YGW . . 'solution NMR' . 'RNaseT1 (Lys25 isoenzyme)' . 16580 1 yes PDB 3RNT . . X-ray 1.8 'RNaseT1:(VO4)5+ complex' . 16580 1 yes PDB 8RNT . . X-ray 1.8 'RNaseT1:Zn2+ complex' . 16580 1 yes PDB 9RNT . . X-ray 1.5 'RNaseT1:Ca2+ complex' . 16580 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'guanine-specific ssRNA cleavage' 16580 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RNase_T1 _Entity.Sf_category entity _Entity.Sf_framecode RNase_T1 _Entity.Entry_ID 16580 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RNase_T1 _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 ; ACDYTCGSNCYSSSDVSTAQ AAGYKLHEDGETVGSNSYPH KYNNYEGFDFSVSSPYYEWP ILSSGDVYSGGSPGADRVVF NENNQLAGVITHTGASGNNF VECT ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 104 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 3.1.27.3 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11089.3 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Lys25 isoenzyme' _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 15905 . RNase_T1 . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 2 no BMRB 16469 . RNase_T1 . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 3 no BMRB 1658 . "ribonuclease T1" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 4 no PDB 1B2M . "Three-Dimensional Structure Of Ribonulcease T1 Complexed With An Isosteric Phosphonate Analogue Of Gpu: Alternate Substrate Bin" . . . . . 100.00 104 99.04 100.00 1.20e-67 . . . . 16580 1 5 no PDB 1BIR . "Ribonuclease T1, Phe 100 To Ala Mutant Complexed With 2' Gmp" . . . . . 100.00 104 99.04 99.04 4.96e-67 . . . . 16580 1 6 no PDB 1BU4 . "Ribonuclease 1 Complex With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 7 no PDB 1BVI . "Ribonuclease T1 (Wildtype) Complexed With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 8 no PDB 1DET . "Ribonuclease T1 Carboxymethylated At Glu 58 In Complex With 2'gmp" . . . . . 100.00 104 98.08 99.04 1.12e-66 . . . . 16580 1 9 no PDB 1FYS . "Ribonuclease T1 V16c Mutant" . . . . . 100.00 104 99.04 99.04 3.50e-67 . . . . 16580 1 10 no PDB 1FZU . "Rnase T1 V78a Mutant" . . . . . 100.00 104 99.04 99.04 1.34e-67 . . . . 16580 1 11 no PDB 1G02 . "Ribonuclease T1 V16s Mutant" . . . . . 100.00 104 99.04 99.04 2.81e-67 . . . . 16580 1 12 no PDB 1GSP . "Ribonuclease T1 Complexed With 2',3'-Cgps, 1 Day" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 13 no PDB 1HYF . "Ribonuclease T1 V16a Mutant In Complex With Sr2+" . . . . . 100.00 104 99.04 99.04 1.34e-67 . . . . 16580 1 14 no PDB 1HZ1 . "Ribonuclease T1 V16a Mutant In Complex With Mg2+" . . . . . 100.00 104 99.04 99.04 1.34e-67 . . . . 16580 1 15 no PDB 1I0V . "Ribonuclease T1 In Complex With 2'gmp (Form I Crystal)" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 16 no PDB 1I0X . "Ribonuclease T1 In Complex With 2'gmp (Form Ii Crystal)" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 17 no PDB 1I2E . "Ribonuclease T1 V16a Mutant, Form I" . . . . . 100.00 104 99.04 99.04 1.34e-67 . . . . 16580 1 18 no PDB 1I2F . "Ribonuclease T1 V16a Mutant, Form Ii" . . . . . 100.00 104 99.04 99.04 1.34e-67 . . . . 16580 1 19 no PDB 1I2G . "Ribonuclease T1 V16t Mutant" . . . . . 100.00 104 99.04 99.04 1.37e-67 . . . . 16580 1 20 no PDB 1I3F . "Ribonuclease T1 V89s Mutant" . . . . . 100.00 104 99.04 99.04 2.81e-67 . . . . 16580 1 21 no PDB 1I3I . "Ribonuclease T1 V78t Mutant" . . . . . 100.00 104 99.04 99.04 1.37e-67 . . . . 16580 1 22 no PDB 1IYY . "Nmr Structure Of Gln25-Ribonuclease T1, 24 Structures" . . . . . 100.00 104 99.04 100.00 1.20e-67 . . . . 16580 1 23 no PDB 1LOV . "X-ray Structure Of The E58a Mutant Of Ribonuclease T1 Complexed With 3'-guanosine Monophosphate" . . . . . 100.00 104 99.04 99.04 2.26e-67 . . . . 16580 1 24 no PDB 1LOW . "X-ray Structure Of The H40a Mutant Of Ribonuclease T1 Complexed With 3'-guanosine Monophosphate" . . . . . 100.00 104 99.04 99.04 6.03e-67 . . . . 16580 1 25 no PDB 1LOY . "X-Ray Structure Of The H40aE58A MUTANT OF RIBONUCLEASE T1 Complexed With 3'-Guanosine Monophosphate" . . . . . 100.00 104 98.08 98.08 3.38e-66 . . . . 16580 1 26 no PDB 1LRA . "Crystallographic Study Of Glu 58 Ala Rnase T1(Asterisk)2'-Guanosine Monophosphate At 1.9 Angstroms Resolution" . . . . . 100.00 104 99.04 99.04 2.26e-67 . . . . 16580 1 27 no PDB 1RGA . "Crystal Structure Of Rnase T1 With 3'-Gmp And Guanosine: A Product Complex" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 28 no PDB 1RGC . "The Complex Between Ribonuclease T1 And 3'-guanylic Acid Suggests Geometry Of Enzymatic Reaction Path. An X-ray Study" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 29 no PDB 1RGK . "Rnase T1 Mutant Glu46gln Binds The Inhibitors 2'gmp And 2'amp At The 3' Subsite" . . . . . 100.00 104 99.04 100.00 8.65e-68 . . . . 16580 1 30 no PDB 1RGL . "Rnase T1 Mutant Glu46gln Binds The Inhibitors 2'gmp And 2'amp At The 3' Subsite" . . . . . 100.00 104 99.04 100.00 8.65e-68 . . . . 16580 1 31 no PDB 1RHL . "Ribonuclease T1 Complexed With 2'gmpG23A MUTANT" . . . . . 100.00 104 99.04 99.04 1.72e-67 . . . . 16580 1 32 no PDB 1RLS . "Crystal Structure Of Rnase T1 Complexed With The Product Nucleotide 3'-Gmp. Structural Evidence For Direct Interaction Of Histi" . . . . . 100.00 104 99.04 100.00 1.20e-67 . . . . 16580 1 33 no PDB 1RN1 . "Three-Dimensional Structure Of Gln 25-Ribonuclease T1 At 1.84 Angstroms Resolution: Structural Variations At The Base Recogniti" . . . . . 100.00 104 99.04 100.00 1.20e-67 . . . . 16580 1 34 no PDB 1RN4 . "His92ala Mutation In Ribonuclease T1 Induces Segmental Flexibility. An X-Ray Study" . . . . . 100.00 104 99.04 99.04 6.03e-67 . . . . 16580 1 35 no PDB 1RNT . "Restrained Least-Squares Refinement Of The Crystal Structure Of The Ribonuclease T1(Asterisk)2(Prime)- Guanylic Acid Complex At" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 36 no PDB 1TRP . "X-ray Crystallographic And Calorimeric Studies Of The Effects Of The Mutation Trp 59 Tyr In Ribonuclease T1" . . . . . 100.00 104 98.08 100.00 3.45e-66 . . . . 16580 1 37 no PDB 1TRQ . "X-ray Crystallographic And Calorimeric Studies Of The Effects Of The Mutation Trp 59 Tyr In Ribonuclease T1" . . . . . 100.00 104 99.04 100.00 4.80e-67 . . . . 16580 1 38 no PDB 1YGW . "Nmr Structure Of Ribonuclease T1, 34 Structures" . . . . . 99.04 104 100.00 100.00 1.72e-67 . . . . 16580 1 39 no PDB 2AAD . "The Role Of Histidine-40 In Ribonuclease T1 Catalysis: Three-Dimensional Structures Of The Partially Active His40lys Mutant" . . . . . 100.00 104 99.04 99.04 3.94e-67 . . . . 16580 1 40 no PDB 2AAE . "The Role Of Histidine-40 In Ribonuclease T1 Catalysis: Three-Dimensional Structures Of The Partially Active His40lys Mutant" . . . . . 100.00 104 99.04 99.04 3.94e-67 . . . . 16580 1 41 no PDB 2BIR . "Additivity Of Substrate Binding In Ribonuclease T1 (Y42a Mutant)" . . . . . 100.00 104 98.08 98.08 3.45e-66 . . . . 16580 1 42 no PDB 2BU4 . "Ribonuclease T1 Complex With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 43 no PDB 2GSP . "Ribonuclease T12',3'-Cgps And 3'-Gmp, 2 Days" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 44 no PDB 2HOH . "Ribonuclease T1 (n9a Mutant) Complexed With 2'gmp" . . . . . 100.00 104 99.04 99.04 2.72e-67 . . . . 16580 1 45 no PDB 2RNT . "Three-Dimensional Structure Of Ribonuclease T1 Complexed With Guanylyl-2(Prime),5(Prime)-Guanosine At 1.8 Angstroms Resolution" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 46 no PDB 3BIR . "Disecting Histidine Interactions In Ribonuclease T1 By Asn And Gln Substitutions" . . . . . 100.00 104 99.04 100.00 3.53e-67 . . . . 16580 1 47 no PDB 3BU4 . "Ribonuclease T1 Complex With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 48 no PDB 3GSP . "Ribonuclease T1 Complexed With 2',3'-Cgps + 3'-Gmp, 4 Days" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 49 no PDB 3HOH . "Ribonuclease T1 (Thr93gln Mutant) Complexed With 2'gmp" . . . . . 100.00 104 99.04 99.04 1.84e-67 . . . . 16580 1 50 no PDB 3RNT . "Crystal Structure Of Guanosine-Free Ribonuclease T1, Complexed With Vanadate(V), Suggests Conformational Change Upon Substrate " . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 51 no PDB 3SYU . "Re-Refined Coordinates For Pdb Entry 1det - Ribonuclease T1 Carboxymethylated At Glu 58 In Complex With 2'gmp" . . . . . 100.00 104 98.08 99.04 1.12e-66 . . . . 16580 1 52 no PDB 3URP . "Re-refinement Of Pdb Entry 5rnt - Ribonuclease T1 With Guanosine-3', 5'-diphosphate And Phosphate Ion Bound" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 53 no PDB 4BIR . "Ribonuclease T1: Free His92gln Mutant" . . . . . 100.00 104 99.04 99.04 2.66e-67 . . . . 16580 1 54 no PDB 4BU4 . "Ribonuclease T1 Complex With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 55 no PDB 4GSP . "Ribonuclease T1 Complexed With 2',3'-Cgps + 3'-Gmp, 7 Days" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 56 no PDB 4HOH . "Ribonuclease T1 (Thr93ala Mutant) Complexed With 2'gmp" . . . . . 100.00 104 99.04 99.04 1.70e-67 . . . . 16580 1 57 no PDB 4RNT . "His 92 Ala Mutation In Ribonuclease T1 Induces Segmental Flexibility. An X-Ray Study" . . . . . 100.00 104 99.04 99.04 6.03e-67 . . . . 16580 1 58 no PDB 5BIR . "Disecting Histidine Interactions In Ribonuclease T1 Using Asn And Gln Mutations" . . . . . 100.00 104 99.04 99.04 2.66e-67 . . . . 16580 1 59 no PDB 5BU4 . "Ribonuclease T1 Complex With 2'gmp" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 60 no PDB 5GSP . "Ribonuclease T13'-Gmp, 9 Weeks" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 61 no PDB 5HOH . "Ribonuclease T1 (Asn9alaTHR93ALA DOUBLEMUTANT) COMPLEXED With 2'gmp" . . . . . 100.00 104 98.08 98.08 1.28e-66 . . . . 16580 1 62 no PDB 5RNT . "X-Ray Analysis Of Cubic Crystals Of The Complex Formed Between Ribonuclease T1 And Guanosine-3',5'-Bisphosphate" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 63 no PDB 6GSP . "Ribonuclease T1/3'-gmp, 15 Weeks" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 64 no PDB 6RNT . "Crystal Structure Of Ribonuclease T1 Complexed With Adenosine 2'-monophosphate At 1.8-angstroms Resolution" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 65 no PDB 7GSP . "Ribonuclease T12',3'-Cgps, Non-Productive" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 66 no PDB 7RNT . "Crystal Structure Of The Tyr45trp Mutant Of Ribonuclease T1 In A Complex With 2'-Adenylic Acid" . . . . . 100.00 104 99.04 100.00 1.48e-67 . . . . 16580 1 67 no PDB 8RNT . "Structure Of Ribonuclease T1 Complexed With Zinc(Ii) At 1.8 Angstroms Resolution: A Zn2+.6h2o.Carboxylate Clathrate" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 68 no PDB 9RNT . "Ribonuclease T1 With Free Recognition And Catalytic Site: Crystal Structure Analysis At 1.5 Angstroms Resolution" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 69 no DBJ BAA05707 . "ribonuclease T1 [Aspergillus oryzae]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 70 no DBJ BAA08407 . "ribonuclease T1 [Aspergillus oryzae]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 71 no DBJ BAE64671 . "unnamed protein product [Aspergillus oryzae RIB40]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 72 no EMBL CAA30560 . "unnamed protein product [Aspergillus oryzae]" . . . . . 100.00 104 100.00 100.00 3.54e-68 . . . . 16580 1 73 no GB AAA72541 . "RNase T1 [synthetic construct]" . . . . . 100.00 105 99.04 100.00 1.25e-67 . . . . 16580 1 74 no GB AAA72994 . "fusion gene containing ompA-signal peptide/RNase T1 [synthetic construct]" . . . . . 100.00 125 100.00 100.00 3.19e-69 . . . . 16580 1 75 no GB EED52238 . "extracellular guanyl-specific ribonuclease RntA [Aspergillus flavus NRRL3357]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 76 no GB EIT74451 . "guanyl-specific ribonuclease T1 [Aspergillus oryzae 3.042]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 77 no GB KDE77875 . "guanyl-specific ribonuclease T1 [Aspergillus oryzae 100-8]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 78 no REF XP_001825804 . "guanyl-specific ribonuclease T1 [Aspergillus oryzae RIB40]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 79 no REF XP_002377402 . "extracellular guanyl-specific ribonuclease RntA [Aspergillus flavus NRRL3357]" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 80 no SP P00651 . "RecName: Full=Guanyl-specific ribonuclease T1; Short=RNase T1; Flags: Precursor" . . . . . 100.00 130 99.04 100.00 1.81e-68 . . . . 16580 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'guanine-specific ssRNA cleavage' 16580 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 . ALA . 16580 1 2 . CYS . 16580 1 3 . ASP . 16580 1 4 . TYR . 16580 1 5 . THR . 16580 1 6 . CYS . 16580 1 7 . GLY . 16580 1 8 . SER . 16580 1 9 . ASN . 16580 1 10 . CYS . 16580 1 11 . TYR . 16580 1 12 . SER . 16580 1 13 . SER . 16580 1 14 . SER . 16580 1 15 . ASP . 16580 1 16 . VAL . 16580 1 17 . SER . 16580 1 18 . THR . 16580 1 19 . ALA . 16580 1 20 . GLN . 16580 1 21 . ALA . 16580 1 22 . ALA . 16580 1 23 . GLY . 16580 1 24 . TYR . 16580 1 25 . LYS . 16580 1 26 . LEU . 16580 1 27 . HIS . 16580 1 28 . GLU . 16580 1 29 . ASP . 16580 1 30 . GLY . 16580 1 31 . GLU . 16580 1 32 . THR . 16580 1 33 . VAL . 16580 1 34 . GLY . 16580 1 35 . SER . 16580 1 36 . ASN . 16580 1 37 . SER . 16580 1 38 . TYR . 16580 1 39 . PRO . 16580 1 40 . HIS . 16580 1 41 . LYS . 16580 1 42 . TYR . 16580 1 43 . ASN . 16580 1 44 . ASN . 16580 1 45 . TYR . 16580 1 46 . GLU . 16580 1 47 . GLY . 16580 1 48 . PHE . 16580 1 49 . ASP . 16580 1 50 . PHE . 16580 1 51 . SER . 16580 1 52 . VAL . 16580 1 53 . SER . 16580 1 54 . SER . 16580 1 55 . PRO . 16580 1 56 . TYR . 16580 1 57 . TYR . 16580 1 58 . GLU . 16580 1 59 . TRP . 16580 1 60 . PRO . 16580 1 61 . ILE . 16580 1 62 . LEU . 16580 1 63 . SER . 16580 1 64 . SER . 16580 1 65 . GLY . 16580 1 66 . ASP . 16580 1 67 . VAL . 16580 1 68 . TYR . 16580 1 69 . SER . 16580 1 70 . GLY . 16580 1 71 . GLY . 16580 1 72 . SER . 16580 1 73 . PRO . 16580 1 74 . GLY . 16580 1 75 . ALA . 16580 1 76 . ASP . 16580 1 77 . ARG . 16580 1 78 . VAL . 16580 1 79 . VAL . 16580 1 80 . PHE . 16580 1 81 . ASN . 16580 1 82 . GLU . 16580 1 83 . ASN . 16580 1 84 . ASN . 16580 1 85 . GLN . 16580 1 86 . LEU . 16580 1 87 . ALA . 16580 1 88 . GLY . 16580 1 89 . VAL . 16580 1 90 . ILE . 16580 1 91 . THR . 16580 1 92 . HIS . 16580 1 93 . THR . 16580 1 94 . GLY . 16580 1 95 . ALA . 16580 1 96 . SER . 16580 1 97 . GLY . 16580 1 98 . ASN . 16580 1 99 . ASN . 16580 1 100 . PHE . 16580 1 101 . VAL . 16580 1 102 . GLU . 16580 1 103 . CYS . 16580 1 104 . THR . 16580 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 . ALA 1 1 16580 1 . CYS 2 2 16580 1 . ASP 3 3 16580 1 . TYR 4 4 16580 1 . THR 5 5 16580 1 . CYS 6 6 16580 1 . GLY 7 7 16580 1 . SER 8 8 16580 1 . ASN 9 9 16580 1 . CYS 10 10 16580 1 . TYR 11 11 16580 1 . SER 12 12 16580 1 . SER 13 13 16580 1 . SER 14 14 16580 1 . ASP 15 15 16580 1 . VAL 16 16 16580 1 . SER 17 17 16580 1 . THR 18 18 16580 1 . ALA 19 19 16580 1 . GLN 20 20 16580 1 . ALA 21 21 16580 1 . ALA 22 22 16580 1 . GLY 23 23 16580 1 . TYR 24 24 16580 1 . LYS 25 25 16580 1 . LEU 26 26 16580 1 . HIS 27 27 16580 1 . GLU 28 28 16580 1 . ASP 29 29 16580 1 . GLY 30 30 16580 1 . GLU 31 31 16580 1 . THR 32 32 16580 1 . VAL 33 33 16580 1 . GLY 34 34 16580 1 . SER 35 35 16580 1 . ASN 36 36 16580 1 . SER 37 37 16580 1 . TYR 38 38 16580 1 . PRO 39 39 16580 1 . HIS 40 40 16580 1 . LYS 41 41 16580 1 . TYR 42 42 16580 1 . ASN 43 43 16580 1 . ASN 44 44 16580 1 . TYR 45 45 16580 1 . GLU 46 46 16580 1 . GLY 47 47 16580 1 . PHE 48 48 16580 1 . ASP 49 49 16580 1 . PHE 50 50 16580 1 . SER 51 51 16580 1 . VAL 52 52 16580 1 . SER 53 53 16580 1 . SER 54 54 16580 1 . PRO 55 55 16580 1 . TYR 56 56 16580 1 . TYR 57 57 16580 1 . GLU 58 58 16580 1 . TRP 59 59 16580 1 . PRO 60 60 16580 1 . ILE 61 61 16580 1 . LEU 62 62 16580 1 . SER 63 63 16580 1 . SER 64 64 16580 1 . GLY 65 65 16580 1 . ASP 66 66 16580 1 . VAL 67 67 16580 1 . TYR 68 68 16580 1 . SER 69 69 16580 1 . GLY 70 70 16580 1 . GLY 71 71 16580 1 . SER 72 72 16580 1 . PRO 73 73 16580 1 . GLY 74 74 16580 1 . ALA 75 75 16580 1 . ASP 76 76 16580 1 . ARG 77 77 16580 1 . VAL 78 78 16580 1 . VAL 79 79 16580 1 . PHE 80 80 16580 1 . ASN 81 81 16580 1 . GLU 82 82 16580 1 . ASN 83 83 16580 1 . ASN 84 84 16580 1 . GLN 85 85 16580 1 . LEU 86 86 16580 1 . ALA 87 87 16580 1 . GLY 88 88 16580 1 . VAL 89 89 16580 1 . ILE 90 90 16580 1 . THR 91 91 16580 1 . HIS 92 92 16580 1 . THR 93 93 16580 1 . GLY 94 94 16580 1 . ALA 95 95 16580 1 . SER 96 96 16580 1 . GLY 97 97 16580 1 . ASN 98 98 16580 1 . ASN 99 99 16580 1 . PHE 100 100 16580 1 . VAL 101 101 16580 1 . GLU 102 102 16580 1 . CYS 103 103 16580 1 . THR 104 104 16580 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 16580 _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 $RNase_T1 . 5062 organism . 'Aspergillus oryzae' 'Aspergillus oryzae' . . Eukaryota Fungi Aspergillus oryzae . . . . . . . . . . . . . . . . . . . . . 16580 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 16580 _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 $RNase_T1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli DH5alpha . . . . . . . . . . . . . . . pA2T1 . . . . . . 16580 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16580 _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 RNase_T1 '[U-95% 13C; U-95% 15N]' . . 1 $RNase_T1 . . 2 . . mM . . . . 16580 1 2 D2O [U-2H] . . . . . . 10 . . % . . . . 16580 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16580 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16580 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 RNase_T1 '[U-95% 13C; U-95% 15N]' . . 1 $RNase_T1 . . 2 . . mM . . . . 16580 2 2 D2O [U-2H] . . . . . . 100 . . % . . . . 16580 2 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 16580 _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 pH 5.5 . pH 16580 1 pressure 1 . atm 16580 1 temperature 308 . K 16580 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 16580 _Software.ID 1 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16580 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16580 1 processing 16580 1 stop_ save_ save_jeval _Software.Sf_category software _Software.Sf_framecode jeval _Software.Entry_ID 16580 _Software.ID 2 _Software.Name jeval _Software.Version . _Software.Details 'Matlab-based suite of utilities for the display, selection, and simulation of 2D multiplet projections from multi-dimensional NMR spectra' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'JM Schmidt' 'Dept. of Biosciences, University of Kent, Canterbury, Kent CT2 7NJ, United Kingdom' j.m.schmidt@kent.ac.uk 16580 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'coupling constant extraction' 16580 2 'data analysis' 16580 2 'multiplet simulation' 16580 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 16580 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details '1H{13C,15N}-triple-resonance three-axis PFG probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 16580 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details '1H{13C,15N}-triple-resonance three-axis PFG probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16580 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'room-temperature and cryogenic triple-resonance z-gradient probes' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 16580 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details 'cryogenic triple-resonance z-gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_5 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_5 _NMR_spectrometer.Entry_ID 16580 _NMR_spectrometer.ID 5 _NMR_spectrometer.Details 'cryogenic triple-resonance z-gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_6 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_6 _NMR_spectrometer.Entry_ID 16580 _NMR_spectrometer.ID 6 _NMR_spectrometer.Details 'cryogenic triple-resonance z-gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 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 16580 _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 DRX . 500 '1H{13C,15N}-triple-resonance three-axis PFG probe' . . 16580 1 2 spectrometer_2 Bruker Avance . 500 '1H{13C,15N}-triple-resonance three-axis PFG probe' . . 16580 1 3 spectrometer_3 Bruker Avance . 600 'room-temperature and cryogenic triple-resonance z-gradient probes' . . 16580 1 4 spectrometer_4 Bruker Avance . 800 'cryogenic triple-resonance z-gradient probe' . . 16580 1 5 spectrometer_5 Bruker Avance . 900 'cryogenic triple-resonance z-gradient probe' . . 16580 1 6 spectrometer_6 Bruker Avance . 950 'cryogenic triple-resonance z-gradient probe' . . 16580 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 16580 _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 Ca-coupled [15N,1H]-TROSY-HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16580 1 2 '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16580 1 3 '2D IPAP-type HN(a/b-NCO-J)-TROSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 16580 1 4 '3D Ha-coupled ct-[15N,1H]-TROSY-iHNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16580 1 5 '3D Cb-coupled [15N,1H]-TROSY-HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 16580 1 6 '3D Ha-coupled [15N,1H]-TROSY-H(N)COCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16580 1 7 '3D Cb-coupled [15N,1H]-TROSY-H(N)COCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16580 1 8 '2D Cb-coupled [13C,1H]-HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 6 $spectrometer_6 . . . . . . . . . . . . . . . . 16580 1 9 '2D CO-coupled ct-[13C,1H]-HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16580 1 10 '3D CO-coupled ct-[15N,1H]-TROSY-HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16580 1 11 '3D CO-coupled (H)CANNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 16580 1 stop_ save_ save_3D_Ca-coupled_(15N_1H)-TROSY-HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_Ca-coupled_(15N_1H)-TROSY-HNCO _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D Ca-coupled [15N,1H]-TROSY-HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Kazimierczuk et al., 2008; 2JCAN_ and 2JHNCA and 2JCOCA measurement; high-resolution, 100-ms 13C and 160-ms 15N evolution ; save_ save_2D_IPAP-type_HN(CO-a_b-NCa-J)-TROSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_IPAP-type_HN(CO-a_b-NCa-J)-TROSY _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_3 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Permi and Annila, 2000 2JCAN_ and 2JHNCA measurement ; save_ save_2D_IPAP-type_HN(a_b-NCO-J)-TROSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_IPAP-type_HN(a_b-NCO-J)-TROSY _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '2D IPAP-type HN(a/b-NCO-J)-TROSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 5 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_5 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Permi and Annila, 2000; 2JCOHN measurement; 250-ms 15N evolution ; save_ save_3D_Ha-coupled_ct-(15N_1H)-TROSY-iHNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_Ha-coupled_ct-(15N_1H)-TROSY-iHNCA _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D Ha-coupled ct-[15N,1H]-TROSY-iHNCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Permi, 2003; 2JN_HA measurement ; save_ save_3D_Cb-coupled_(15N_1H)-TROSY-HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_Cb-coupled_(15N_1H)-TROSY-HNCA _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D Cb-coupled [15N,1H]-TROSY-HNCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 4 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_4 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Wang & Bax, 1996 2JN_CB measurement ; save_ save_3D_Ha-coupled_(15N_1H)-TROSY-H(N)COCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_Ha-coupled_(15N_1H)-TROSY-H(N)COCA _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D Ha-coupled [15N,1H]-TROSY-H(N)COCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Lohr & Schmidt, unpublished; 2JHACO measurement ; save_ save_3D_Cb-coupled_(15N_1H)-TROSY-H(N)COCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_Cb-coupled_(15N_1H)-TROSY-H(N)COCA _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '3D Cb-coupled [15N,1H]-TROSY-H(N)COCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Lohr & Schmidt, unpublished; 2JCBCO measurement ; save_ save_2D_Cb-coupled_(13C_1H)-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_Cb-coupled_(13C_1H)-HSQC _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '2D Cb-coupled [13C,1H]-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 6 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_6 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details '2JHaCb measurement' save_ save_2D_CO-coupled_ct-(13C_1H)-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_CO-coupled_ct-(13C_1H)-HSQC _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '2D CO-coupled ct-[13C,1H]-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_3 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Vuister & Bax, 1992; 2JHaCO measurement ; save_ save_3D_CO-coupled_ct-(15N_1H)-TROSY-HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_CO-coupled_ct-(15N_1H)-TROSY-HNCA _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D CO-coupled ct-[15N,1H]-TROSY-HNCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_3 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Salzmann et al.,1999 Lohr & Schmidt, unpublished 2JN_CO and 2JCOHN and 2JCOCA measurement; high-resolution 28-ms 13C and 95-ms 15N evolution ; save_ save_3D_CO-coupled_(H)CANNH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_CO-coupled_(H)CANNH _NMR_spec_expt.Entry_ID 16580 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D CO-coupled (H)CANNH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 5 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_5 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details ; Lohr & Ruterjans, 1995; 2JCOHN measurement ; save_ ######################## # Coupling constants # ######################## save_2JCaN_ _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JCaN_ _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 1 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 1 '3D Ca-coupled [15N,1H]-TROSY-HNCO' . . . 16580 1 2 '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' . . . 16580 1 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JCAN_ . 1 1 1 1 ALA CA C 13 1 . 1 1 2 2 CYS N N 15 1 -8.26 . . 0.50 . . 1 1 Ala Ca 1 2 Cys N . 16580 1 2 2JCAN_ . 1 1 2 2 CYS CA C 13 1 . 1 1 3 3 ASP N N 15 1 -7.71 . . 0.50 . . 1 2 Cys Ca 1 3 Asp N . 16580 1 3 2JCAN_ . 1 1 3 3 ASP CA C 13 1 . 1 1 4 4 TYR N N 15 1 -6.43 . . 0.50 . . 1 3 Asp Ca 1 4 Tyr N . 16580 1 4 2JCAN_ . 1 1 4 4 TYR CA C 13 1 . 1 1 5 5 THR N N 15 1 -8.88 . . 0.50 . . 1 4 Tyr Ca 1 5 Thr N . 16580 1 5 2JCAN_ . 1 1 5 5 THR CA C 13 1 . 1 1 6 6 CYS N N 15 1 -7.69 . . 0.50 . . 1 5 Thr Ca 1 6 Cys N . 16580 1 6 2JCAN_ . 1 1 6 6 CYS CA C 13 1 . 1 1 7 7 GLY N N 15 1 -7.95 . . 0.50 . . 1 6 Cys Ca 1 7 Gly N . 16580 1 7 2JCAN_ . 1 1 7 7 GLY CA C 13 1 . 1 1 8 8 SER N N 15 1 -8.51 . . 0.50 . . 1 7 Gly Ca 1 8 Ser N . 16580 1 8 2JCAN_ . 1 1 8 8 SER CA C 13 1 . 1 1 9 9 ASN N N 15 1 -5.75 . . 0.50 . . 1 8 Ser Ca 1 9 Asn N . 16580 1 9 2JCAN_ . 1 1 9 9 ASN CA C 13 1 . 1 1 10 10 CYS N N 15 1 -9.68 . . 0.50 . . 1 9 Asn Ca 1 10 Cys N . 16580 1 10 2JCAN_ . 1 1 10 10 CYS CA C 13 1 . 1 1 11 11 TYR N N 15 1 -8.32 . . 0.50 . . 1 10 Cys Ca 1 11 Tyr N . 16580 1 11 2JCAN_ . 1 1 11 11 TYR CA C 13 1 . 1 1 12 12 SER N N 15 1 -8.72 . . 0.50 . . 1 11 Tyr Ca 1 12 Ser N . 16580 1 12 2JCAN_ . 1 1 12 12 SER CA C 13 1 . 1 1 13 13 SER N N 15 1 -8.20 . . 0.50 . . 1 12 Ser Ca 1 13 Ser N . 16580 1 13 2JCAN_ . 1 1 13 13 SER CA C 13 1 . 1 1 14 14 SER N N 15 1 -4.50 . . 0.50 . . 1 13 Ser Ca 1 14 Ser N . 16580 1 14 2JCAN_ . 1 1 14 14 SER CA C 13 1 . 1 1 15 15 ASP N N 15 1 -4.76 . . 0.50 . . 1 14 Ser Ca 1 15 Asp N . 16580 1 15 2JCAN_ . 1 1 15 15 ASP CA C 13 1 . 1 1 16 16 VAL N N 15 1 -5.83 . . 0.50 . . 1 15 Asp Ca 1 16 Val N . 16580 1 16 2JCAN_ . 1 1 16 16 VAL CA C 13 1 . 1 1 17 17 SER N N 15 1 -6.08 . . 0.50 . . 1 16 Val Ca 1 17 Ser N . 16580 1 17 2JCAN_ . 1 1 17 17 SER CA C 13 1 . 1 1 18 18 THR N N 15 1 -4.85 . . 0.50 . . 1 17 Ser Ca 1 18 Thr N . 16580 1 18 2JCAN_ . 1 1 18 18 THR CA C 13 1 . 1 1 19 19 ALA N N 15 1 -5.29 . . 0.50 . . 1 18 Thr Ca 1 19 Ala N . 16580 1 19 2JCAN_ . 1 1 19 19 ALA CA C 13 1 . 1 1 20 20 GLN N N 15 1 -6.56 . . 0.50 . . 1 19 Ala Ca 1 20 Gln N . 16580 1 20 2JCAN_ . 1 1 20 20 GLN CA C 13 1 . 1 1 21 21 ALA N N 15 1 -6.24 . . 0.50 . . 1 20 Gln Ca 1 21 Ala N . 16580 1 21 2JCAN_ . 1 1 21 21 ALA CA C 13 1 . 1 1 22 22 ALA N N 15 1 -5.86 . . 0.50 . . 1 21 Ala Ca 1 22 Ala N . 16580 1 22 2JCAN_ . 1 1 22 22 ALA CA C 13 1 . 1 1 23 23 GLY N N 15 1 -6.56 . . 0.50 . . 1 22 Ala Ca 1 23 Gly N . 16580 1 23 2JCAN_ . 1 1 23 23 GLY CA C 13 1 . 1 1 24 24 TYR N N 15 1 -6.47 . . 0.50 . . 1 23 Gly Ca 1 24 Tyr N . 16580 1 24 2JCAN_ . 1 1 24 24 TYR CA C 13 1 . 1 1 25 25 LYS N N 15 1 -5.94 . . 0.50 . . 1 24 Tyr Ca 1 25 Lys N . 16580 1 25 2JCAN_ . 1 1 25 25 LYS CA C 13 1 . 1 1 26 26 LEU N N 15 1 -6.00 . . 0.50 . . 1 25 Lys Ca 1 26 Leu N . 16580 1 26 2JCAN_ . 1 1 26 26 LEU CA C 13 1 . 1 1 27 27 HIS N N 15 1 -6.30 . . 0.50 . . 1 26 Leu Ca 1 27 His N . 16580 1 27 2JCAN_ . 1 1 27 27 HIS CA C 13 1 . 1 1 28 28 GLU N N 15 1 -6.24 . . 0.50 . . 1 27 His Ca 1 28 Glu N . 16580 1 28 2JCAN_ . 1 1 28 28 GLU CA C 13 1 . 1 1 29 29 ASP N N 15 1 -5.88 . . 0.50 . . 1 28 Glu Ca 1 29 Asp N . 16580 1 29 2JCAN_ . 1 1 29 29 ASP CA C 13 1 . 1 1 30 30 GLY N N 15 1 -6.11 . . 0.50 . . 1 29 Asp Ca 1 30 Gly N . 16580 1 30 2JCAN_ . 1 1 30 30 GLY CA C 13 1 . 1 1 31 31 GLU N N 15 1 -6.17 . . 0.50 . . 1 30 Gly Ca 1 31 Glu N . 16580 1 31 2JCAN_ . 1 1 31 31 GLU CA C 13 1 . 1 1 32 32 THR N N 15 1 -9.39 . . 0.50 . . 1 31 Glu Ca 1 32 Thr N . 16580 1 32 2JCAN_ . 1 1 32 32 THR CA C 13 1 . 1 1 33 33 VAL N N 15 1 -8.27 . . 0.50 . . 1 32 Thr Ca 1 33 Val N . 16580 1 33 2JCAN_ . 1 1 33 33 VAL CA C 13 1 . 1 1 34 34 GLY N N 15 1 -9.05 . . 0.50 . . 1 33 Val Ca 1 34 Gly N . 16580 1 34 2JCAN_ . 1 1 36 36 ASN CA C 13 1 . 1 1 37 37 SER N N 15 1 -6.64 . . 0.50 . . 1 36 Asn Ca 1 37 Ser N . 16580 1 35 2JCAN_ . 1 1 37 37 SER CA C 13 1 . 1 1 38 38 TYR N N 15 1 -6.76 . . 0.50 . . 1 37 Ser Ca 1 38 Tyr N . 16580 1 36 2JCAN_ . 1 1 39 39 PRO CA C 13 1 . 1 1 40 40 HIS N N 15 1 -9.58 . . 0.50 . . 1 39 Pro Ca 1 40 His N . 16580 1 37 2JCAN_ . 1 1 40 40 HIS CA C 13 1 . 1 1 41 41 LYS N N 15 1 -8.30 . . 0.50 . . 1 40 His Ca 1 41 Lys N . 16580 1 38 2JCAN_ . 1 1 41 41 LYS CA C 13 1 . 1 1 42 42 TYR N N 15 1 -8.72 . . 0.50 . . 1 41 Lys Ca 1 42 Tyr N . 16580 1 39 2JCAN_ . 1 1 42 42 TYR CA C 13 1 . 1 1 43 43 ASN N N 15 1 -8.34 . . 0.50 . . 1 42 Tyr Ca 1 43 Asn N . 16580 1 40 2JCAN_ . 1 1 43 43 ASN CA C 13 1 . 1 1 44 44 ASN N N 15 1 -6.69 . . 0.50 . . 1 43 Asn Ca 1 44 Asn N . 16580 1 41 2JCAN_ . 1 1 44 44 ASN CA C 13 1 . 1 1 45 45 TYR N N 15 1 -6.31 . . 0.50 . . 1 44 Asn Ca 1 45 Tyr N . 16580 1 42 2JCAN_ . 1 1 45 45 TYR CA C 13 1 . 1 1 46 46 GLU N N 15 1 -5.68 . . 0.50 . . 1 45 Tyr Ca 1 46 Glu N . 16580 1 43 2JCAN_ . 1 1 46 46 GLU CA C 13 1 . 1 1 47 47 GLY N N 15 1 -6.00 . . 0.50 . . 1 46 Glu Ca 1 47 Gly N . 16580 1 44 2JCAN_ . 1 1 47 47 GLY CA C 13 1 . 1 1 48 48 PHE N N 15 1 -5.80 . . 0.50 . . 1 47 Gly Ca 1 48 Phe N . 16580 1 45 2JCAN_ . 1 1 48 48 PHE CA C 13 1 . 1 1 49 49 ASP N N 15 1 -8.53 . . 0.50 . . 1 48 Phe Ca 1 49 Asp N . 16580 1 46 2JCAN_ . 1 1 49 49 ASP CA C 13 1 . 1 1 50 50 PHE N N 15 1 -7.30 . . 0.50 . . 1 49 Asp Ca 1 50 Phe N . 16580 1 47 2JCAN_ . 1 1 50 50 PHE CA C 13 1 . 1 1 51 51 SER N N 15 1 -8.76 . . 0.50 . . 1 50 Phe Ca 1 51 Ser N . 16580 1 48 2JCAN_ . 1 1 51 51 SER CA C 13 1 . 1 1 52 52 VAL N N 15 1 -5.65 . . 0.50 . . 1 51 Ser Ca 1 52 Val N . 16580 1 49 2JCAN_ . 1 1 52 52 VAL CA C 13 1 . 1 1 53 53 SER N N 15 1 -8.19 . . 0.50 . . 1 52 Val Ca 1 53 Ser N . 16580 1 50 2JCAN_ . 1 1 53 53 SER CA C 13 1 . 1 1 54 54 SER N N 15 1 -9.09 . . 0.50 . . 1 53 Ser Ca 1 54 Ser N . 16580 1 51 2JCAN_ . 1 1 55 55 PRO CA C 13 1 . 1 1 56 56 TYR N N 15 1 -9.88 . . 0.50 . . 1 55 Pro Ca 1 56 Tyr N . 16580 1 52 2JCAN_ . 1 1 56 56 TYR CA C 13 1 . 1 1 57 57 TYR N N 15 1 -8.52 . . 0.50 . . 1 56 Tyr Ca 1 57 Tyr N . 16580 1 53 2JCAN_ . 1 1 57 57 TYR CA C 13 1 . 1 1 58 58 GLU N N 15 1 -9.02 . . 0.50 . . 1 57 Tyr Ca 1 58 Glu N . 16580 1 54 2JCAN_ . 1 1 58 58 GLU CA C 13 1 . 1 1 59 59 TRP N N 15 1 -9.39 . . 0.50 . . 1 58 Glu Ca 1 59 Trp N . 16580 1 55 2JCAN_ . 1 1 60 60 PRO CA C 13 1 . 1 1 61 61 ILE N N 15 1 -9.68 . . 0.50 . . 1 60 Pro Ca 1 61 Ile N . 16580 1 56 2JCAN_ . 1 1 61 61 ILE CA C 13 1 . 1 1 62 62 LEU N N 15 1 -7.79 . . 0.50 . . 1 61 Ile Ca 1 62 Leu N . 16580 1 57 2JCAN_ . 1 1 62 62 LEU CA C 13 1 . 1 1 63 63 SER N N 15 1 -8.55 . . 0.50 . . 1 62 Leu Ca 1 63 Ser N . 16580 1 58 2JCAN_ . 1 1 63 63 SER CA C 13 1 . 1 1 64 64 SER N N 15 1 -5.19 . . 0.50 . . 1 63 Ser Ca 1 64 Ser N . 16580 1 59 2JCAN_ . 1 1 64 64 SER CA C 13 1 . 1 1 65 65 GLY N N 15 1 -5.80 . . 0.50 . . 1 64 Ser Ca 1 65 Gly N . 16580 1 60 2JCAN_ . 1 1 65 65 GLY CA C 13 1 . 1 1 66 66 ASP N N 15 1 -5.79 . . 0.50 . . 1 65 Gly Ca 1 66 Asp N . 16580 1 61 2JCAN_ . 1 1 66 66 ASP CA C 13 1 . 1 1 67 67 VAL N N 15 1 -8.80 . . 0.50 . . 1 66 Asp Ca 1 67 Val N . 16580 1 62 2JCAN_ . 1 1 67 67 VAL CA C 13 1 . 1 1 68 68 TYR N N 15 1 -8.02 . . 0.50 . . 1 67 Val Ca 1 68 Tyr N . 16580 1 63 2JCAN_ . 1 1 68 68 TYR CA C 13 1 . 1 1 69 69 SER N N 15 1 -9.12 . . 0.50 . . 1 68 Tyr Ca 1 69 Ser N . 16580 1 64 2JCAN_ . 1 1 70 70 GLY CA C 13 1 . 1 1 71 71 GLY N N 15 1 -8.56 . . 0.50 . . 1 70 Gly Ca 1 71 Gly N . 16580 1 65 2JCAN_ . 1 1 73 73 PRO CA C 13 1 . 1 1 74 74 GLY N N 15 1 -6.38 . . 0.50 . . 1 73 Pro Ca 1 74 Gly N . 16580 1 66 2JCAN_ . 1 1 74 74 GLY CA C 13 1 . 1 1 75 75 ALA N N 15 1 -8.40 . . 0.50 . . 1 74 Gly Ca 1 75 Ala N . 16580 1 67 2JCAN_ . 1 1 75 75 ALA CA C 13 1 . 1 1 76 76 ASP N N 15 1 -6.27 . . 0.50 . . 1 75 Ala Ca 1 76 Asp N . 16580 1 68 2JCAN_ . 1 1 76 76 ASP CA C 13 1 . 1 1 77 77 ARG N N 15 1 -8.84 . . 0.50 . . 1 76 Asp Ca 1 77 Arg N . 16580 1 69 2JCAN_ . 1 1 77 77 ARG CA C 13 1 . 1 1 78 78 VAL N N 15 1 -8.77 . . 0.50 . . 1 77 Arg Ca 1 78 Val N . 16580 1 70 2JCAN_ . 1 1 78 78 VAL CA C 13 1 . 1 1 79 79 VAL N N 15 1 -8.68 . . 0.50 . . 1 78 Val Ca 1 79 Val N . 16580 1 71 2JCAN_ . 1 1 79 79 VAL CA C 13 1 . 1 1 80 80 PHE N N 15 1 -7.76 . . 0.50 . . 1 79 Val Ca 1 80 Phe N . 16580 1 72 2JCAN_ . 1 1 80 80 PHE CA C 13 1 . 1 1 81 81 ASN N N 15 1 -8.40 . . 0.50 . . 1 80 Phe Ca 1 81 Asn N . 16580 1 73 2JCAN_ . 1 1 81 81 ASN CA C 13 1 . 1 1 82 82 GLU N N 15 1 -8.87 . . 0.50 . . 1 81 Asn Ca 1 82 Glu N . 16580 1 74 2JCAN_ . 1 1 82 82 GLU CA C 13 1 . 1 1 83 83 ASN N N 15 1 -6.08 . . 0.50 . . 1 82 Glu Ca 1 83 Asn N . 16580 1 75 2JCAN_ . 1 1 83 83 ASN CA C 13 1 . 1 1 84 84 ASN N N 15 1 -6.65 . . 0.50 . . 1 83 Asn Ca 1 84 Asn N . 16580 1 76 2JCAN_ . 1 1 84 84 ASN CA C 13 1 . 1 1 85 85 GLN N N 15 1 -6.60 . . 0.50 . . 1 84 Asn Ca 1 85 Gln N . 16580 1 77 2JCAN_ . 1 1 85 85 GLN CA C 13 1 . 1 1 86 86 LEU N N 15 1 -8.89 . . 0.50 . . 1 85 Gln Ca 1 86 Leu N . 16580 1 78 2JCAN_ . 1 1 86 86 LEU CA C 13 1 . 1 1 87 87 ALA N N 15 1 -7.96 . . 0.50 . . 1 86 Leu Ca 1 87 Ala N . 16580 1 79 2JCAN_ . 1 1 87 87 ALA CA C 13 1 . 1 1 88 88 GLY N N 15 1 -6.56 . . 0.50 . . 1 87 Ala Ca 1 88 Gly N . 16580 1 80 2JCAN_ . 1 1 88 88 GLY CA C 13 1 . 1 1 89 89 VAL N N 15 1 -9.64 . . 0.50 . . 1 88 Gly Ca 1 89 Val N . 16580 1 81 2JCAN_ . 1 1 89 89 VAL CA C 13 1 . 1 1 90 90 ILE N N 15 1 -8.07 . . 0.50 . . 1 89 Val Ca 1 90 Ile N . 16580 1 82 2JCAN_ . 1 1 90 90 ILE CA C 13 1 . 1 1 91 91 THR N N 15 1 -8.75 . . 0.50 . . 1 90 Ile Ca 1 91 Thr N . 16580 1 83 2JCAN_ . 1 1 91 91 THR CA C 13 1 . 1 1 92 92 HIS N N 15 1 -7.49 . . 0.50 . . 1 91 Thr Ca 1 92 His N . 16580 1 84 2JCAN_ . 1 1 92 92 HIS CA C 13 1 . 1 1 93 93 THR N N 15 1 -6.47 . . 0.50 . . 1 92 His Ca 1 93 Thr N . 16580 1 85 2JCAN_ . 1 1 93 93 THR CA C 13 1 . 1 1 94 94 GLY N N 15 1 -8.62 . . 0.50 . . 1 93 Thr Ca 1 94 Gly N . 16580 1 86 2JCAN_ . 1 1 94 94 GLY CA C 13 1 . 1 1 95 95 ALA N N 15 1 -5.92 . . 0.50 . . 1 94 Gly Ca 1 95 Ala N . 16580 1 87 2JCAN_ . 1 1 95 95 ALA CA C 13 1 . 1 1 96 96 SER N N 15 1 -8.80 . . 0.50 . . 1 95 Ala Ca 1 96 Ser N . 16580 1 88 2JCAN_ . 1 1 96 96 SER CA C 13 1 . 1 1 97 97 GLY N N 15 1 -8.22 . . 0.50 . . 1 96 Ser Ca 1 97 Gly N . 16580 1 89 2JCAN_ . 1 1 97 97 GLY CA C 13 1 . 1 1 98 98 ASN N N 15 1 -9.54 . . 0.50 . . 1 97 Gly Ca 1 98 Asn N . 16580 1 90 2JCAN_ . 1 1 98 98 ASN CA C 13 1 . 1 1 99 99 ASN N N 15 1 -6.56 . . 0.50 . . 1 98 Asn Ca 1 99 Asn N . 16580 1 91 2JCAN_ . 1 1 99 99 ASN CA C 13 1 . 1 1 100 100 PHE N N 15 1 -8.34 . . 0.50 . . 1 99 Asn Ca 1 100 Phe N . 16580 1 92 2JCAN_ . 1 1 100 100 PHE CA C 13 1 . 1 1 101 101 VAL N N 15 1 -8.95 . . 0.50 . . 1 100 Phe Ca 1 101 Val N . 16580 1 93 2JCAN_ . 1 1 101 101 VAL CA C 13 1 . 1 1 102 102 GLU N N 15 1 -7.59 . . 0.50 . . 1 101 Val Ca 1 102 Glu N . 16580 1 94 2JCAN_ . 1 1 102 102 GLU CA C 13 1 . 1 1 103 103 CYS N N 15 1 -7.92 . . 0.50 . . 1 102 Glu Ca 1 103 Cys N . 16580 1 95 2JCAN_ . 1 1 103 103 CYS CA C 13 1 . 1 1 104 104 THR N N 15 1 -8.61 . . 0.50 . . 1 103 Cys Ca 1 104 Thr N . 16580 1 stop_ save_ save_2JHNCa _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JHNCa _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 2 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 600 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 1 '3D Ca-coupled [15N,1H]-TROSY-HNCO' . . . 16580 2 2 '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' . . . 16580 2 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JHNCA . 1 1 3 3 ASP H H 1 1 . 1 1 3 3 ASP CA C 13 1 2.05 . . 0.50 . . 1 3 Asp HN 1 3 Asp Ca . 16580 2 2 2JHNCA . 1 1 4 4 TYR H H 1 1 . 1 1 4 4 TYR CA C 13 1 0.91 . . 0.50 . . 1 4 Tyr HN 1 4 Tyr Ca . 16580 2 3 2JHNCA . 1 1 5 5 THR H H 1 1 . 1 1 5 5 THR CA C 13 1 1.49 . . 0.50 . . 1 5 Thr HN 1 5 Thr Ca . 16580 2 4 2JHNCA . 1 1 6 6 CYS H H 1 1 . 1 1 6 6 CYS CA C 13 1 2.27 . . 0.50 . . 1 6 Cys HN 1 6 Cys Ca . 16580 2 5 2JHNCA . 1 1 7 7 GLY H H 1 1 . 1 1 7 7 GLY CA C 13 1 2.35 . . 0.50 . . 1 7 Gly HN 1 7 Gly Ca . 16580 2 6 2JHNCA . 1 1 8 8 SER H H 1 1 . 1 1 8 8 SER CA C 13 1 2.28 . . 0.50 . . 1 8 Ser HN 1 8 Ser Ca . 16580 2 7 2JHNCA . 1 1 9 9 ASN H H 1 1 . 1 1 9 9 ASN CA C 13 1 1.13 . . 0.50 . . 1 9 Asn HN 1 9 Asn Ca . 16580 2 8 2JHNCA . 1 1 10 10 CYS H H 1 1 . 1 1 10 10 CYS CA C 13 1 1.54 . . 0.50 . . 1 10 Cys HN 1 10 Cys Ca . 16580 2 9 2JHNCA . 1 1 11 11 TYR H H 1 1 . 1 1 11 11 TYR CA C 13 1 1.27 . . 0.50 . . 1 11 Tyr HN 1 11 Tyr Ca . 16580 2 10 2JHNCA . 1 1 12 12 SER H H 1 1 . 1 1 12 12 SER CA C 13 1 1.57 . . 0.50 . . 1 12 Ser HN 1 12 Ser Ca . 16580 2 11 2JHNCA . 1 1 13 13 SER H H 1 1 . 1 1 13 13 SER CA C 13 1 3.12 . . 0.50 . . 1 13 Ser HN 1 13 Ser Ca . 16580 2 12 2JHNCA . 1 1 14 14 SER H H 1 1 . 1 1 14 14 SER CA C 13 1 2.92 . . 0.50 . . 1 14 Ser HN 1 14 Ser Ca . 16580 2 13 2JHNCA . 1 1 15 15 ASP H H 1 1 . 1 1 15 15 ASP CA C 13 1 2.32 . . 0.50 . . 1 15 Asp HN 1 15 Asp Ca . 16580 2 14 2JHNCA . 1 1 16 16 VAL H H 1 1 . 1 1 16 16 VAL CA C 13 1 2.33 . . 0.50 . . 1 16 Val HN 1 16 Val Ca . 16580 2 15 2JHNCA . 1 1 17 17 SER H H 1 1 . 1 1 17 17 SER CA C 13 1 2.90 . . 0.50 . . 1 17 Ser HN 1 17 Ser Ca . 16580 2 16 2JHNCA . 1 1 18 18 THR H H 1 1 . 1 1 18 18 THR CA C 13 1 2.61 . . 0.50 . . 1 18 Thr HN 1 18 Thr Ca . 16580 2 17 2JHNCA . 1 1 19 19 ALA H H 1 1 . 1 1 19 19 ALA CA C 13 1 2.26 . . 0.50 . . 1 19 Ala HN 1 19 Ala Ca . 16580 2 18 2JHNCA . 1 1 20 20 GLN H H 1 1 . 1 1 20 20 GLN CA C 13 1 2.58 . . 0.50 . . 1 20 Gln HN 1 20 Gln Ca . 16580 2 19 2JHNCA . 1 1 21 21 ALA H H 1 1 . 1 1 21 21 ALA CA C 13 1 3.08 . . 0.50 . . 1 21 Ala HN 1 21 Ala Ca . 16580 2 20 2JHNCA . 1 1 22 22 ALA H H 1 1 . 1 1 22 22 ALA CA C 13 1 2.18 . . 0.50 . . 1 22 Ala HN 1 22 Ala Ca . 16580 2 21 2JHNCA . 1 1 23 23 GLY H H 1 1 . 1 1 23 23 GLY CA C 13 1 2.05 . . 0.50 . . 1 23 Gly HN 1 23 Gly Ca . 16580 2 22 2JHNCA . 1 1 24 24 TYR H H 1 1 . 1 1 24 24 TYR CA C 13 1 3.01 . . 0.50 . . 1 24 Tyr HN 1 24 Tyr Ca . 16580 2 23 2JHNCA . 1 1 25 25 LYS H H 1 1 . 1 1 25 25 LYS CA C 13 1 2.59 . . 0.50 . . 1 25 Lys HN 1 25 Lys Ca . 16580 2 24 2JHNCA . 1 1 26 26 LEU H H 1 1 . 1 1 26 26 LEU CA C 13 1 2.95 . . 0.50 . . 1 26 Leu HN 1 26 Leu Ca . 16580 2 25 2JHNCA . 1 1 27 27 HIS H H 1 1 . 1 1 27 27 HIS CA C 13 1 2.46 . . 0.50 . . 1 27 His HN 1 27 His Ca . 16580 2 26 2JHNCA . 1 1 28 28 GLU H H 1 1 . 1 1 28 28 GLU CA C 13 1 2.62 . . 0.50 . . 1 28 Glu HN 1 28 Glu Ca . 16580 2 27 2JHNCA . 1 1 29 29 ASP H H 1 1 . 1 1 29 29 ASP CA C 13 1 1.92 . . 0.50 . . 1 29 Asp HN 1 29 Asp Ca . 16580 2 28 2JHNCA . 1 1 30 30 GLY H H 1 1 . 1 1 30 30 GLY CA C 13 1 1.94 . . 0.50 . . 1 30 Gly HN 1 30 Gly Ca . 16580 2 29 2JHNCA . 1 1 31 31 GLU H H 1 1 . 1 1 31 31 GLU CA C 13 1 0.68 . . 0.50 . . 1 31 Glu HN 1 31 Glu Ca . 16580 2 30 2JHNCA . 1 1 32 32 THR H H 1 1 . 1 1 32 32 THR CA C 13 1 1.01 . . 0.50 . . 1 32 Thr HN 1 32 Thr Ca . 16580 2 31 2JHNCA . 1 1 33 33 VAL H H 1 1 . 1 1 33 33 VAL CA C 13 1 1.03 . . 0.50 . . 1 33 Val HN 1 33 Val Ca . 16580 2 32 2JHNCA . 1 1 34 34 GLY H H 1 1 . 1 1 34 34 GLY CA C 13 1 1.89 . . 0.50 . . 1 34 Gly HN 1 34 Gly Ca . 16580 2 33 2JHNCA . 1 1 37 37 SER H H 1 1 . 1 1 37 37 SER CA C 13 1 1.56 . . 0.50 . . 1 37 Ser HN 1 37 Ser Ca . 16580 2 34 2JHNCA . 1 1 38 38 TYR H H 1 1 . 1 1 38 38 TYR CA C 13 1 1.65 . . 0.50 . . 1 38 Tyr HN 1 38 Tyr Ca . 16580 2 35 2JHNCA . 1 1 40 40 HIS H H 1 1 . 1 1 40 40 HIS CA C 13 1 2.26 . . 0.50 . . 1 40 His HN 1 40 His Ca . 16580 2 36 2JHNCA . 1 1 41 41 LYS H H 1 1 . 1 1 41 41 LYS CA C 13 1 1.16 . . 0.50 . . 1 41 Lys HN 1 41 Lys Ca . 16580 2 37 2JHNCA . 1 1 42 42 TYR H H 1 1 . 1 1 42 42 TYR CA C 13 1 1.40 . . 0.50 . . 1 42 Tyr HN 1 42 Tyr Ca . 16580 2 38 2JHNCA . 1 1 43 43 ASN H H 1 1 . 1 1 43 43 ASN CA C 13 1 2.38 . . 0.50 . . 1 43 Asn HN 1 43 Asn Ca . 16580 2 39 2JHNCA . 1 1 44 44 ASN H H 1 1 . 1 1 44 44 ASN CA C 13 1 3.22 . . 0.50 . . 1 44 Asn HN 1 44 Asn Ca . 16580 2 40 2JHNCA . 1 1 45 45 TYR H H 1 1 . 1 1 45 45 TYR CA C 13 1 2.50 . . 0.50 . . 1 45 Tyr HN 1 45 Tyr Ca . 16580 2 41 2JHNCA . 1 1 46 46 GLU H H 1 1 . 1 1 46 46 GLU CA C 13 1 2.16 . . 0.50 . . 1 46 Glu HN 1 46 Glu Ca . 16580 2 42 2JHNCA . 1 1 47 47 GLY H H 1 1 . 1 1 47 47 GLY CA C 13 1 1.76 . . 0.50 . . 1 47 Gly HN 1 47 Gly Ca . 16580 2 43 2JHNCA . 1 1 48 48 PHE H H 1 1 . 1 1 48 48 PHE CA C 13 1 1.80 . . 0.50 . . 1 48 Phe HN 1 48 Phe Ca . 16580 2 44 2JHNCA . 1 1 49 49 ASP H H 1 1 . 1 1 49 49 ASP CA C 13 1 2.06 . . 0.50 . . 1 49 Asp HN 1 49 Asp Ca . 16580 2 45 2JHNCA . 1 1 50 50 PHE H H 1 1 . 1 1 50 50 PHE CA C 13 1 2.40 . . 0.50 . . 1 50 Phe HN 1 50 Phe Ca . 16580 2 46 2JHNCA . 1 1 51 51 SER H H 1 1 . 1 1 51 51 SER CA C 13 1 2.28 . . 0.50 . . 1 51 Ser HN 1 51 Ser Ca . 16580 2 47 2JHNCA . 1 1 52 52 VAL H H 1 1 . 1 1 52 52 VAL CA C 13 1 0.99 . . 0.50 . . 1 52 Val HN 1 52 Val Ca . 16580 2 48 2JHNCA . 1 1 53 53 SER H H 1 1 . 1 1 53 53 SER CA C 13 1 2.08 . . 0.50 . . 1 53 Ser HN 1 53 Ser Ca . 16580 2 49 2JHNCA . 1 1 54 54 SER H H 1 1 . 1 1 54 54 SER CA C 13 1 1.70 . . 0.50 . . 1 54 Ser HN 1 54 Ser Ca . 16580 2 50 2JHNCA . 1 1 56 56 TYR H H 1 1 . 1 1 56 56 TYR CA C 13 1 1.32 . . 0.50 . . 1 56 Tyr HN 1 56 Tyr Ca . 16580 2 51 2JHNCA . 1 1 57 57 TYR H H 1 1 . 1 1 57 57 TYR CA C 13 1 1.69 . . 0.50 . . 1 57 Tyr HN 1 57 Tyr Ca . 16580 2 52 2JHNCA . 1 1 58 58 GLU H H 1 1 . 1 1 58 58 GLU CA C 13 1 1.58 . . 0.50 . . 1 58 Glu HN 1 58 Glu Ca . 16580 2 53 2JHNCA . 1 1 59 59 TRP H H 1 1 . 1 1 59 59 TRP CA C 13 1 1.17 . . 0.50 . . 1 59 Trp HN 1 59 Trp Ca . 16580 2 54 2JHNCA . 1 1 61 61 ILE H H 1 1 . 1 1 61 61 ILE CA C 13 1 1.41 . . 0.50 . . 1 61 Ile HN 1 61 Ile Ca . 16580 2 55 2JHNCA . 1 1 62 62 LEU H H 1 1 . 1 1 62 62 LEU CA C 13 1 1.54 . . 0.50 . . 1 62 Leu HN 1 62 Leu Ca . 16580 2 56 2JHNCA . 1 1 63 63 SER H H 1 1 . 1 1 63 63 SER CA C 13 1 2.78 . . 0.50 . . 1 63 Ser HN 1 63 Ser Ca . 16580 2 57 2JHNCA . 1 1 64 64 SER H H 1 1 . 1 1 64 64 SER CA C 13 1 2.39 . . 0.50 . . 1 64 Ser HN 1 64 Ser Ca . 16580 2 58 2JHNCA . 1 1 65 65 GLY H H 1 1 . 1 1 65 65 GLY CA C 13 1 2.20 . . 0.50 . . 1 65 Gly HN 1 65 Gly Ca . 16580 2 59 2JHNCA . 1 1 66 66 ASP H H 1 1 . 1 1 66 66 ASP CA C 13 1 1.10 . . 0.50 . . 1 66 Asp HN 1 66 Asp Ca . 16580 2 60 2JHNCA . 1 1 67 67 VAL H H 1 1 . 1 1 67 67 VAL CA C 13 1 1.95 . . 0.50 . . 1 67 Val HN 1 67 Val Ca . 16580 2 61 2JHNCA . 1 1 68 68 TYR H H 1 1 . 1 1 68 68 TYR CA C 13 1 2.23 . . 0.50 . . 1 68 Tyr HN 1 68 Tyr Ca . 16580 2 62 2JHNCA . 1 1 69 69 SER H H 1 1 . 1 1 69 69 SER CA C 13 1 2.22 . . 0.50 . . 1 69 Ser HN 1 69 Ser Ca . 16580 2 63 2JHNCA . 1 1 74 74 GLY H H 1 1 . 1 1 74 74 GLY CA C 13 1 2.05 . . 0.50 . . 1 74 Gly HN 1 74 Gly Ca . 16580 2 64 2JHNCA . 1 1 75 75 ALA H H 1 1 . 1 1 75 75 ALA CA C 13 1 3.45 . . 0.50 . . 1 75 Ala HN 1 75 Ala Ca . 16580 2 65 2JHNCA . 1 1 76 76 ASP H H 1 1 . 1 1 76 76 ASP CA C 13 1 1.21 . . 0.50 . . 1 76 Asp HN 1 76 Asp Ca . 16580 2 66 2JHNCA . 1 1 77 77 ARG H H 1 1 . 1 1 77 77 ARG CA C 13 1 1.75 . . 0.50 . . 1 77 Arg HN 1 77 Arg Ca . 16580 2 67 2JHNCA . 1 1 78 78 VAL H H 1 1 . 1 1 78 78 VAL CA C 13 1 0.49 . . 0.50 . . 1 78 Val HN 1 78 Val Ca . 16580 2 68 2JHNCA . 1 1 79 79 VAL H H 1 1 . 1 1 79 79 VAL CA C 13 1 1.41 . . 0.50 . . 1 79 Val HN 1 79 Val Ca . 16580 2 69 2JHNCA . 1 1 80 80 PHE H H 1 1 . 1 1 80 80 PHE CA C 13 1 2.12 . . 0.50 . . 1 80 Phe HN 1 80 Phe Ca . 16580 2 70 2JHNCA . 1 1 81 81 ASN H H 1 1 . 1 1 81 81 ASN CA C 13 1 2.13 . . 0.50 . . 1 81 Asn HN 1 81 Asn Ca . 16580 2 71 2JHNCA . 1 1 82 82 GLU H H 1 1 . 1 1 82 82 GLU CA C 13 1 2.06 . . 0.50 . . 1 82 Glu HN 1 82 Glu Ca . 16580 2 72 2JHNCA . 1 1 83 83 ASN H H 1 1 . 1 1 83 83 ASN CA C 13 1 1.49 . . 0.50 . . 1 83 Asn HN 1 83 Asn Ca . 16580 2 73 2JHNCA . 1 1 84 84 ASN H H 1 1 . 1 1 84 84 ASN CA C 13 1 2.33 . . 0.50 . . 1 84 Asn HN 1 84 Asn Ca . 16580 2 74 2JHNCA . 1 1 85 85 GLN H H 1 1 . 1 1 85 85 GLN CA C 13 1 0.95 . . 0.50 . . 1 85 Gln HN 1 85 Gln Ca . 16580 2 75 2JHNCA . 1 1 86 86 LEU H H 1 1 . 1 1 86 86 LEU CA C 13 1 2.46 . . 0.50 . . 1 86 Leu HN 1 86 Leu Ca . 16580 2 76 2JHNCA . 1 1 87 87 ALA H H 1 1 . 1 1 87 87 ALA CA C 13 1 1.93 . . 0.50 . . 1 87 Ala HN 1 87 Ala Ca . 16580 2 77 2JHNCA . 1 1 88 88 GLY H H 1 1 . 1 1 88 88 GLY CA C 13 1 1.73 . . 0.50 . . 1 88 Gly HN 1 88 Gly Ca . 16580 2 78 2JHNCA . 1 1 89 89 VAL H H 1 1 . 1 1 89 89 VAL CA C 13 1 1.28 . . 0.50 . . 1 89 Val HN 1 89 Val Ca . 16580 2 79 2JHNCA . 1 1 90 90 ILE H H 1 1 . 1 1 90 90 ILE CA C 13 1 1.34 . . 0.50 . . 1 90 Ile HN 1 90 Ile Ca . 16580 2 80 2JHNCA . 1 1 91 91 THR H H 1 1 . 1 1 91 91 THR CA C 13 1 1.10 . . 0.50 . . 1 91 Thr HN 1 91 Thr Ca . 16580 2 81 2JHNCA . 1 1 92 92 HIS H H 1 1 . 1 1 92 92 HIS CA C 13 1 2.53 . . 0.50 . . 1 92 His HN 1 92 His Ca . 16580 2 82 2JHNCA . 1 1 93 93 THR H H 1 1 . 1 1 93 93 THR CA C 13 1 2.31 . . 0.50 . . 1 93 Thr HN 1 93 Thr Ca . 16580 2 83 2JHNCA . 1 1 94 94 GLY H H 1 1 . 1 1 94 94 GLY CA C 13 1 2.30 . . 0.50 . . 1 94 Gly HN 1 94 Gly Ca . 16580 2 84 2JHNCA . 1 1 95 95 ALA H H 1 1 . 1 1 95 95 ALA CA C 13 1 1.63 . . 0.50 . . 1 95 Ala HN 1 95 Ala Ca . 16580 2 85 2JHNCA . 1 1 96 96 SER H H 1 1 . 1 1 96 96 SER CA C 13 1 1.90 . . 0.50 . . 1 96 Ser HN 1 96 Ser Ca . 16580 2 86 2JHNCA . 1 1 97 97 GLY H H 1 1 . 1 1 97 97 GLY CA C 13 1 1.42 . . 0.50 . . 1 97 Gly HN 1 97 Gly Ca . 16580 2 87 2JHNCA . 1 1 99 99 ASN H H 1 1 . 1 1 99 99 ASN CA C 13 1 1.33 . . 0.50 . . 1 99 Asn HN 1 99 Asn Ca . 16580 2 88 2JHNCA . 1 1 100 100 PHE H H 1 1 . 1 1 100 100 PHE CA C 13 1 1.04 . . 0.50 . . 1 100 Phe HN 1 100 Phe Ca . 16580 2 89 2JHNCA . 1 1 101 101 VAL H H 1 1 . 1 1 101 101 VAL CA C 13 1 0.62 . . 0.50 . . 1 101 Val HN 1 101 Val Ca . 16580 2 90 2JHNCA . 1 1 102 102 GLU H H 1 1 . 1 1 102 102 GLU CA C 13 1 2.28 . . 0.50 . . 1 102 Glu HN 1 102 Glu Ca . 16580 2 91 2JHNCA . 1 1 103 103 CYS H H 1 1 . 1 1 103 103 CYS CA C 13 1 1.19 . . 0.50 . . 1 103 Cys HN 1 103 Cys Ca . 16580 2 92 2JHNCA . 1 1 104 104 THR H H 1 1 . 1 1 104 104 THR CA C 13 1 1.16 . . 0.50 . . 1 104 Thr HN 1 104 Thr Ca . 16580 2 stop_ save_ save_2JCOHN _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JCOHN _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 3 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 600 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 3 '2D IPAP-type HN(a/b-NCO-J)-TROSY' . . . 16580 3 10 '3D CO-coupled ct-[15N,1H]-TROSY-HNCA' . . . 16580 3 11 '3D CO-coupled (H)CANNH' . . . 16580 3 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JCOHN . 1 1 2 2 CYS C C 13 1 . 1 1 3 3 ASP H H 1 1 3.93 . . 0.50 . . 1 2 Cys C 1 3 Asp HN . 16580 3 2 2JCOHN . 1 1 3 3 ASP C C 13 1 . 1 1 4 4 TYR H H 1 1 4.12 . . 0.50 . . 1 3 Asp C 1 4 Tyr HN . 16580 3 3 2JCOHN . 1 1 4 4 TYR C C 13 1 . 1 1 5 5 THR H H 1 1 4.39 . . 0.50 . . 1 4 Tyr C 1 5 Thr HN . 16580 3 4 2JCOHN . 1 1 5 5 THR C C 13 1 . 1 1 6 6 CYS H H 1 1 3.70 . . 0.50 . . 1 5 Thr C 1 6 Cys HN . 16580 3 5 2JCOHN . 1 1 6 6 CYS C C 13 1 . 1 1 7 7 GLY H H 1 1 4.96 . . 0.50 . . 1 6 Cys C 1 7 Gly HN . 16580 3 6 2JCOHN . 1 1 7 7 GLY C C 13 1 . 1 1 8 8 SER H H 1 1 3.77 . . 0.50 . . 1 7 Gly C 1 8 Ser HN . 16580 3 7 2JCOHN . 1 1 8 8 SER C C 13 1 . 1 1 9 9 ASN H H 1 1 4.11 . . 0.50 . . 1 8 Ser C 1 9 Asn HN . 16580 3 8 2JCOHN . 1 1 9 9 ASN C C 13 1 . 1 1 10 10 CYS H H 1 1 4.14 . . 0.50 . . 1 9 Asn C 1 10 Cys HN . 16580 3 9 2JCOHN . 1 1 10 10 CYS C C 13 1 . 1 1 11 11 TYR H H 1 1 4.30 . . 0.50 . . 1 10 Cys C 1 11 Tyr HN . 16580 3 10 2JCOHN . 1 1 11 11 TYR C C 13 1 . 1 1 12 12 SER H H 1 1 3.98 . . 0.50 . . 1 11 Tyr C 1 12 Ser HN . 16580 3 11 2JCOHN . 1 1 12 12 SER C C 13 1 . 1 1 13 13 SER H H 1 1 3.72 . . 0.50 . . 1 12 Ser C 1 13 Ser HN . 16580 3 12 2JCOHN . 1 1 13 13 SER C C 13 1 . 1 1 14 14 SER H H 1 1 3.95 . . 0.50 . . 1 13 Ser C 1 14 Ser HN . 16580 3 13 2JCOHN . 1 1 14 14 SER C C 13 1 . 1 1 15 15 ASP H H 1 1 4.16 . . 0.50 . . 1 14 Ser C 1 15 Asp HN . 16580 3 14 2JCOHN . 1 1 15 15 ASP C C 13 1 . 1 1 16 16 VAL H H 1 1 3.89 . . 0.50 . . 1 15 Asp C 1 16 Val HN . 16580 3 15 2JCOHN . 1 1 16 16 VAL C C 13 1 . 1 1 17 17 SER H H 1 1 4.22 . . 0.50 . . 1 16 Val C 1 17 Ser HN . 16580 3 16 2JCOHN . 1 1 17 17 SER C C 13 1 . 1 1 18 18 THR H H 1 1 3.99 . . 0.50 . . 1 17 Ser C 1 18 Thr HN . 16580 3 17 2JCOHN . 1 1 18 18 THR C C 13 1 . 1 1 19 19 ALA H H 1 1 4.56 . . 0.50 . . 1 18 Thr C 1 19 Ala HN . 16580 3 18 2JCOHN . 1 1 19 19 ALA C C 13 1 . 1 1 20 20 GLN H H 1 1 4.16 . . 0.50 . . 1 19 Ala C 1 20 Gln HN . 16580 3 19 2JCOHN . 1 1 20 20 GLN C C 13 1 . 1 1 21 21 ALA H H 1 1 4.28 . . 0.50 . . 1 20 Gln C 1 21 Ala HN . 16580 3 20 2JCOHN . 1 1 21 21 ALA C C 13 1 . 1 1 22 22 ALA H H 1 1 4.59 . . 0.50 . . 1 21 Ala C 1 22 Ala HN . 16580 3 21 2JCOHN . 1 1 22 22 ALA C C 13 1 . 1 1 23 23 GLY H H 1 1 4.70 . . 0.50 . . 1 22 Ala C 1 23 Gly HN . 16580 3 22 2JCOHN . 1 1 23 23 GLY C C 13 1 . 1 1 24 24 TYR H H 1 1 4.40 . . 0.50 . . 1 23 Gly C 1 24 Tyr HN . 16580 3 23 2JCOHN . 1 1 24 24 TYR C C 13 1 . 1 1 25 25 LYS H H 1 1 4.52 . . 0.50 . . 1 24 Tyr C 1 25 Lys HN . 16580 3 24 2JCOHN . 1 1 25 25 LYS C C 13 1 . 1 1 26 26 LEU H H 1 1 4.38 . . 0.50 . . 1 25 Lys C 1 26 Leu HN . 16580 3 25 2JCOHN . 1 1 26 26 LEU C C 13 1 . 1 1 27 27 HIS H H 1 1 3.93 . . 0.50 . . 1 26 Leu C 1 27 His HN . 16580 3 26 2JCOHN . 1 1 27 27 HIS C C 13 1 . 1 1 28 28 GLU H H 1 1 4.02 . . 0.50 . . 1 27 His C 1 28 Glu HN . 16580 3 27 2JCOHN . 1 1 28 28 GLU C C 13 1 . 1 1 29 29 ASP H H 1 1 4.12 . . 0.50 . . 1 28 Glu C 1 29 Asp HN . 16580 3 28 2JCOHN . 1 1 29 29 ASP C C 13 1 . 1 1 30 30 GLY H H 1 1 4.52 . . 0.50 . . 1 29 Asp C 1 30 Gly HN . 16580 3 29 2JCOHN . 1 1 30 30 GLY C C 13 1 . 1 1 31 31 GLU H H 1 1 4.00 . . 0.50 . . 1 30 Gly C 1 31 Glu HN . 16580 3 30 2JCOHN . 1 1 31 31 GLU C C 13 1 . 1 1 32 32 THR H H 1 1 4.22 . . 0.50 . . 1 31 Glu C 1 32 Thr HN . 16580 3 31 2JCOHN . 1 1 32 32 THR C C 13 1 . 1 1 33 33 VAL H H 1 1 3.85 . . 0.50 . . 1 32 Thr C 1 33 Val HN . 16580 3 32 2JCOHN . 1 1 33 33 VAL C C 13 1 . 1 1 34 34 GLY H H 1 1 4.36 . . 0.50 . . 1 33 Val C 1 34 Gly HN . 16580 3 33 2JCOHN . 1 1 35 35 SER C C 13 1 . 1 1 36 36 ASN H H 1 1 3.53 . . 0.50 . . 1 35 Ser C 1 36 Asn HN . 16580 3 34 2JCOHN . 1 1 36 36 ASN C C 13 1 . 1 1 37 37 SER H H 1 1 4.33 . . 0.50 . . 1 36 Asn C 1 37 Ser HN . 16580 3 35 2JCOHN . 1 1 37 37 SER C C 13 1 . 1 1 38 38 TYR H H 1 1 3.95 . . 0.50 . . 1 37 Ser C 1 38 Tyr HN . 16580 3 36 2JCOHN . 1 1 39 39 PRO C C 13 1 . 1 1 40 40 HIS H H 1 1 4.57 . . 0.50 . . 1 39 Pro C 1 40 His HN . 16580 3 37 2JCOHN . 1 1 40 40 HIS C C 13 1 . 1 1 41 41 LYS H H 1 1 4.08 . . 0.50 . . 1 40 His C 1 41 Lys HN . 16580 3 38 2JCOHN . 1 1 41 41 LYS C C 13 1 . 1 1 42 42 TYR H H 1 1 3.73 . . 0.50 . . 1 41 Lys C 1 42 Tyr HN . 16580 3 39 2JCOHN . 1 1 42 42 TYR C C 13 1 . 1 1 43 43 ASN H H 1 1 4.14 . . 0.50 . . 1 42 Tyr C 1 43 Asn HN . 16580 3 40 2JCOHN . 1 1 43 43 ASN C C 13 1 . 1 1 44 44 ASN H H 1 1 4.39 . . 0.50 . . 1 43 Asn C 1 44 Asn HN . 16580 3 41 2JCOHN . 1 1 44 44 ASN C C 13 1 . 1 1 45 45 TYR H H 1 1 4.10 . . 0.50 . . 1 44 Asn C 1 45 Tyr HN . 16580 3 42 2JCOHN . 1 1 45 45 TYR C C 13 1 . 1 1 46 46 GLU H H 1 1 4.45 . . 0.50 . . 1 45 Tyr C 1 46 Glu HN . 16580 3 43 2JCOHN . 1 1 46 46 GLU C C 13 1 . 1 1 47 47 GLY H H 1 1 4.77 . . 0.50 . . 1 46 Glu C 1 47 Gly HN . 16580 3 44 2JCOHN . 1 1 47 47 GLY C C 13 1 . 1 1 48 48 PHE H H 1 1 3.90 . . 0.50 . . 1 47 Gly C 1 48 Phe HN . 16580 3 45 2JCOHN . 1 1 48 48 PHE C C 13 1 . 1 1 49 49 ASP H H 1 1 4.32 . . 0.50 . . 1 48 Phe C 1 49 Asp HN . 16580 3 46 2JCOHN . 1 1 49 49 ASP C C 13 1 . 1 1 50 50 PHE H H 1 1 3.51 . . 0.50 . . 1 49 Asp C 1 50 Phe HN . 16580 3 47 2JCOHN . 1 1 50 50 PHE C C 13 1 . 1 1 51 51 SER H H 1 1 3.99 . . 0.50 . . 1 50 Phe C 1 51 Ser HN . 16580 3 48 2JCOHN . 1 1 51 51 SER C C 13 1 . 1 1 52 52 VAL H H 1 1 3.37 . . 0.50 . . 1 51 Ser C 1 52 Val HN . 16580 3 49 2JCOHN . 1 1 52 52 VAL C C 13 1 . 1 1 53 53 SER H H 1 1 3.87 . . 0.50 . . 1 52 Val C 1 53 Ser HN . 16580 3 50 2JCOHN . 1 1 53 53 SER C C 13 1 . 1 1 54 54 SER H H 1 1 3.21 . . 0.50 . . 1 53 Ser C 1 54 Ser HN . 16580 3 51 2JCOHN . 1 1 55 55 PRO C C 13 1 . 1 1 56 56 TYR H H 1 1 4.26 . . 0.50 . . 1 55 Pro C 1 56 Tyr HN . 16580 3 52 2JCOHN . 1 1 56 56 TYR C C 13 1 . 1 1 57 57 TYR H H 1 1 3.88 . . 0.50 . . 1 56 Tyr C 1 57 Tyr HN . 16580 3 53 2JCOHN . 1 1 57 57 TYR C C 13 1 . 1 1 58 58 GLU H H 1 1 3.75 . . 0.50 . . 1 57 Tyr C 1 58 Glu HN . 16580 3 54 2JCOHN . 1 1 58 58 GLU C C 13 1 . 1 1 59 59 TRP H H 1 1 4.17 . . 0.50 . . 1 58 Glu C 1 59 Trp HN . 16580 3 55 2JCOHN . 1 1 60 60 PRO C C 13 1 . 1 1 61 61 ILE H H 1 1 3.88 . . 0.50 . . 1 60 Pro C 1 61 Ile HN . 16580 3 56 2JCOHN . 1 1 61 61 ILE C C 13 1 . 1 1 62 62 LEU H H 1 1 4.21 . . 0.50 . . 1 61 Ile C 1 62 Leu HN . 16580 3 57 2JCOHN . 1 1 62 62 LEU C C 13 1 . 1 1 63 63 SER H H 1 1 3.68 . . 0.50 . . 1 62 Leu C 1 63 Ser HN . 16580 3 58 2JCOHN . 1 1 63 63 SER C C 13 1 . 1 1 64 64 SER H H 1 1 3.93 . . 0.50 . . 1 63 Ser C 1 64 Ser HN . 16580 3 59 2JCOHN . 1 1 64 64 SER C C 13 1 . 1 1 65 65 GLY H H 1 1 4.34 . . 0.50 . . 1 64 Ser C 1 65 Gly HN . 16580 3 60 2JCOHN . 1 1 65 65 GLY C C 13 1 . 1 1 66 66 ASP H H 1 1 3.89 . . 0.50 . . 1 65 Gly C 1 66 Asp HN . 16580 3 61 2JCOHN . 1 1 66 66 ASP C C 13 1 . 1 1 67 67 VAL H H 1 1 3.99 . . 0.50 . . 1 66 Asp C 1 67 Val HN . 16580 3 62 2JCOHN . 1 1 67 67 VAL C C 13 1 . 1 1 68 68 TYR H H 1 1 4.20 . . 0.50 . . 1 67 Val C 1 68 Tyr HN . 16580 3 63 2JCOHN . 1 1 68 68 TYR C C 13 1 . 1 1 69 69 SER H H 1 1 3.49 . . 0.50 . . 1 68 Tyr C 1 69 Ser HN . 16580 3 64 2JCOHN . 1 1 73 73 PRO C C 13 1 . 1 1 74 74 GLY H H 1 1 4.87 . . 0.50 . . 1 73 Pro C 1 74 Gly HN . 16580 3 65 2JCOHN . 1 1 74 74 GLY C C 13 1 . 1 1 75 75 ALA H H 1 1 3.76 . . 0.50 . . 1 74 Gly C 1 75 Ala HN . 16580 3 66 2JCOHN . 1 1 75 75 ALA C C 13 1 . 1 1 76 76 ASP H H 1 1 4.65 . . 0.50 . . 1 75 Ala C 1 76 Asp HN . 16580 3 67 2JCOHN . 1 1 76 76 ASP C C 13 1 . 1 1 77 77 ARG H H 1 1 4.28 . . 0.50 . . 1 76 Asp C 1 77 Arg HN . 16580 3 68 2JCOHN . 1 1 77 77 ARG C C 13 1 . 1 1 78 78 VAL H H 1 1 2.91 . . 0.50 . . 1 77 Arg C 1 78 Val HN . 16580 3 69 2JCOHN . 1 1 78 78 VAL C C 13 1 . 1 1 79 79 VAL H H 1 1 4.71 . . 0.50 . . 1 78 Val C 1 79 Val HN . 16580 3 70 2JCOHN . 1 1 79 79 VAL C C 13 1 . 1 1 80 80 PHE H H 1 1 3.93 . . 0.50 . . 1 79 Val C 1 80 Phe HN . 16580 3 71 2JCOHN . 1 1 80 80 PHE C C 13 1 . 1 1 81 81 ASN H H 1 1 4.51 . . 0.50 . . 1 80 Phe C 1 81 Asn HN . 16580 3 72 2JCOHN . 1 1 81 81 ASN C C 13 1 . 1 1 82 82 GLU H H 1 1 4.22 . . 0.50 . . 1 81 Asn C 1 82 Glu HN . 16580 3 73 2JCOHN . 1 1 82 82 GLU C C 13 1 . 1 1 83 83 ASN H H 1 1 3.98 . . 0.50 . . 1 82 Glu C 1 83 Asn HN . 16580 3 74 2JCOHN . 1 1 83 83 ASN C C 13 1 . 1 1 84 84 ASN H H 1 1 4.88 . . 0.50 . . 1 83 Asn C 1 84 Asn HN . 16580 3 75 2JCOHN . 1 1 84 84 ASN C C 13 1 . 1 1 85 85 GLN H H 1 1 4.61 . . 0.50 . . 1 84 Asn C 1 85 Gln HN . 16580 3 76 2JCOHN . 1 1 85 85 GLN C C 13 1 . 1 1 86 86 LEU H H 1 1 4.49 . . 0.50 . . 1 85 Gln C 1 86 Leu HN . 16580 3 77 2JCOHN . 1 1 86 86 LEU C C 13 1 . 1 1 87 87 ALA H H 1 1 4.11 . . 0.50 . . 1 86 Leu C 1 87 Ala HN . 16580 3 78 2JCOHN . 1 1 87 87 ALA C C 13 1 . 1 1 88 88 GLY H H 1 1 4.69 . . 0.50 . . 1 87 Ala C 1 88 Gly HN . 16580 3 79 2JCOHN . 1 1 88 88 GLY C C 13 1 . 1 1 89 89 VAL H H 1 1 4.24 . . 0.50 . . 1 88 Gly C 1 89 Val HN . 16580 3 80 2JCOHN . 1 1 89 89 VAL C C 13 1 . 1 1 90 90 ILE H H 1 1 3.91 . . 0.50 . . 1 89 Val C 1 90 Ile HN . 16580 3 81 2JCOHN . 1 1 90 90 ILE C C 13 1 . 1 1 91 91 THR H H 1 1 3.97 . . 0.50 . . 1 90 Ile C 1 91 Thr HN . 16580 3 82 2JCOHN . 1 1 91 91 THR C C 13 1 . 1 1 92 92 HIS H H 1 1 3.51 . . 0.50 . . 1 91 Thr C 1 92 His HN . 16580 3 83 2JCOHN . 1 1 92 92 HIS C C 13 1 . 1 1 93 93 THR H H 1 1 4.57 . . 0.50 . . 1 92 His C 1 93 Thr HN . 16580 3 84 2JCOHN . 1 1 93 93 THR C C 13 1 . 1 1 94 94 GLY H H 1 1 4.57 . . 0.50 . . 1 93 Thr C 1 94 Gly HN . 16580 3 85 2JCOHN . 1 1 94 94 GLY C C 13 1 . 1 1 95 95 ALA H H 1 1 4.21 . . 0.50 . . 1 94 Gly C 1 95 Ala HN . 16580 3 86 2JCOHN . 1 1 95 95 ALA C C 13 1 . 1 1 96 96 SER H H 1 1 4.20 . . 0.50 . . 1 95 Ala C 1 96 Ser HN . 16580 3 87 2JCOHN . 1 1 96 96 SER C C 13 1 . 1 1 97 97 GLY H H 1 1 4.59 . . 0.50 . . 1 96 Ser C 1 97 Gly HN . 16580 3 88 2JCOHN . 1 1 98 98 ASN C C 13 1 . 1 1 99 99 ASN H H 1 1 3.85 . . 0.50 . . 1 98 Asn C 1 99 Asn HN . 16580 3 89 2JCOHN . 1 1 99 99 ASN C C 13 1 . 1 1 100 100 PHE H H 1 1 3.81 . . 0.50 . . 1 99 Asn C 1 100 Phe HN . 16580 3 90 2JCOHN . 1 1 100 100 PHE C C 13 1 . 1 1 101 101 VAL H H 1 1 3.64 . . 0.50 . . 1 100 Phe C 1 101 Val HN . 16580 3 91 2JCOHN . 1 1 101 101 VAL C C 13 1 . 1 1 102 102 GLU H H 1 1 4.24 . . 0.50 . . 1 101 Val C 1 102 Glu HN . 16580 3 92 2JCOHN . 1 1 102 102 GLU C C 13 1 . 1 1 103 103 CYS H H 1 1 4.11 . . 0.50 . . 1 102 Glu C 1 103 Cys HN . 16580 3 93 2JCOHN . 1 1 103 103 CYS C C 13 1 . 1 1 104 104 THR H H 1 1 3.98 . . 0.50 . . 1 103 Cys C 1 104 Thr HN . 16580 3 stop_ save_ save_2JCOCa _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JCOCa _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 4 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 1 '3D Ca-coupled [15N,1H]-TROSY-HNCO' . . . 16580 4 10 '3D CO-coupled ct-[15N,1H]-TROSY-HNCA' . . . 16580 4 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JCOCA . 1 1 2 2 CYS C C 13 1 . 1 1 3 3 ASP CA C 13 1 -0.56 . . 0.50 . . 1 2 Cys C 1 3 Asp Ca . 16580 4 2 2JCOCA . 1 1 3 3 ASP C C 13 1 . 1 1 4 4 TYR CA C 13 1 -0.33 . . 0.50 . . 1 3 Asp C 1 4 Tyr Ca . 16580 4 3 2JCOCA . 1 1 4 4 TYR C C 13 1 . 1 1 5 5 THR CA C 13 1 -0.66 . . 0.50 . . 1 4 Tyr C 1 5 Thr Ca . 16580 4 4 2JCOCA . 1 1 5 5 THR C C 13 1 . 1 1 6 6 CYS CA C 13 1 -0.90 . . 0.50 . . 1 5 Thr C 1 6 Cys Ca . 16580 4 5 2JCOCA . 1 1 6 6 CYS C C 13 1 . 1 1 7 7 GLY CA C 13 1 -0.81 . . 0.50 . . 1 6 Cys C 1 7 Gly Ca . 16580 4 6 2JCOCA . 1 1 7 7 GLY C C 13 1 . 1 1 8 8 SER CA C 13 1 -0.71 . . 0.50 . . 1 7 Gly C 1 8 Ser Ca . 16580 4 7 2JCOCA . 1 1 8 8 SER C C 13 1 . 1 1 9 9 ASN CA C 13 1 -0.24 . . 0.50 . . 1 8 Ser C 1 9 Asn Ca . 16580 4 8 2JCOCA . 1 1 9 9 ASN C C 13 1 . 1 1 10 10 CYS CA C 13 1 -0.75 . . 0.50 . . 1 9 Asn C 1 10 Cys Ca . 16580 4 9 2JCOCA . 1 1 10 10 CYS C C 13 1 . 1 1 11 11 TYR CA C 13 1 -0.59 . . 0.50 . . 1 10 Cys C 1 11 Tyr Ca . 16580 4 10 2JCOCA . 1 1 11 11 TYR C C 13 1 . 1 1 12 12 SER CA C 13 1 -0.69 . . 0.50 . . 1 11 Tyr C 1 12 Ser Ca . 16580 4 11 2JCOCA . 1 1 12 12 SER C C 13 1 . 1 1 13 13 SER CA C 13 1 0.48 . . 0.50 . . 1 12 Ser C 1 13 Ser Ca . 16580 4 12 2JCOCA . 1 1 13 13 SER C C 13 1 . 1 1 14 14 SER CA C 13 1 0.24 . . 0.50 . . 1 13 Ser C 1 14 Ser Ca . 16580 4 13 2JCOCA . 1 1 14 14 SER C C 13 1 . 1 1 15 15 ASP CA C 13 1 -0.46 . . 0.50 . . 1 14 Ser C 1 15 Asp Ca . 16580 4 14 2JCOCA . 1 1 15 15 ASP C C 13 1 . 1 1 16 16 VAL CA C 13 1 -0.71 . . 0.50 . . 1 15 Asp C 1 16 Val Ca . 16580 4 15 2JCOCA . 1 1 16 16 VAL C C 13 1 . 1 1 17 17 SER CA C 13 1 0.24 . . 0.50 . . 1 16 Val C 1 17 Ser Ca . 16580 4 16 2JCOCA . 1 1 17 17 SER C C 13 1 . 1 1 18 18 THR CA C 13 1 -0.53 . . 0.50 . . 1 17 Ser C 1 18 Thr Ca . 16580 4 17 2JCOCA . 1 1 18 18 THR C C 13 1 . 1 1 19 19 ALA CA C 13 1 -0.54 . . 0.50 . . 1 18 Thr C 1 19 Ala Ca . 16580 4 18 2JCOCA . 1 1 19 19 ALA C C 13 1 . 1 1 20 20 GLN CA C 13 1 -0.64 . . 0.50 . . 1 19 Ala C 1 20 Gln Ca . 16580 4 19 2JCOCA . 1 1 20 20 GLN C C 13 1 . 1 1 21 21 ALA CA C 13 1 -0.43 . . 0.50 . . 1 20 Gln C 1 21 Ala Ca . 16580 4 20 2JCOCA . 1 1 21 21 ALA C C 13 1 . 1 1 22 22 ALA CA C 13 1 -0.70 . . 0.50 . . 1 21 Ala C 1 22 Ala Ca . 16580 4 21 2JCOCA . 1 1 22 22 ALA C C 13 1 . 1 1 23 23 GLY CA C 13 1 -0.61 . . 0.50 . . 1 22 Ala C 1 23 Gly Ca . 16580 4 22 2JCOCA . 1 1 23 23 GLY C C 13 1 . 1 1 24 24 TYR CA C 13 1 -0.24 . . 0.50 . . 1 23 Gly C 1 24 Tyr Ca . 16580 4 23 2JCOCA . 1 1 24 24 TYR C C 13 1 . 1 1 25 25 LYS CA C 13 1 -0.49 . . 0.50 . . 1 24 Tyr C 1 25 Lys Ca . 16580 4 24 2JCOCA . 1 1 25 25 LYS C C 13 1 . 1 1 26 26 LEU CA C 13 1 -0.22 . . 0.50 . . 1 25 Lys C 1 26 Leu Ca . 16580 4 25 2JCOCA . 1 1 26 26 LEU C C 13 1 . 1 1 27 27 HIS CA C 13 1 -0.51 . . 0.50 . . 1 26 Leu C 1 27 His Ca . 16580 4 26 2JCOCA . 1 1 27 27 HIS C C 13 1 . 1 1 28 28 GLU CA C 13 1 -0.53 . . 0.50 . . 1 27 His C 1 28 Glu Ca . 16580 4 27 2JCOCA . 1 1 28 28 GLU C C 13 1 . 1 1 29 29 ASP CA C 13 1 -0.69 . . 0.50 . . 1 28 Glu C 1 29 Asp Ca . 16580 4 28 2JCOCA . 1 1 29 29 ASP C C 13 1 . 1 1 30 30 GLY CA C 13 1 -0.63 . . 0.50 . . 1 29 Asp C 1 30 Gly Ca . 16580 4 29 2JCOCA . 1 1 30 30 GLY C C 13 1 . 1 1 31 31 GLU CA C 13 1 -0.48 . . 0.50 . . 1 30 Gly C 1 31 Glu Ca . 16580 4 30 2JCOCA . 1 1 31 31 GLU C C 13 1 . 1 1 32 32 THR CA C 13 1 -0.15 . . 0.50 . . 1 31 Glu C 1 32 Thr Ca . 16580 4 31 2JCOCA . 1 1 32 32 THR C C 13 1 . 1 1 33 33 VAL CA C 13 1 -0.41 . . 0.50 . . 1 32 Thr C 1 33 Val Ca . 16580 4 32 2JCOCA . 1 1 33 33 VAL C C 13 1 . 1 1 34 34 GLY CA C 13 1 -1.33 . . 0.50 . . 1 33 Val C 1 34 Gly Ca . 16580 4 33 2JCOCA . 1 1 36 36 ASN C C 13 1 . 1 1 37 37 SER CA C 13 1 -0.57 . . 0.50 . . 1 36 Asn C 1 37 Ser Ca . 16580 4 34 2JCOCA . 1 1 37 37 SER C C 13 1 . 1 1 38 38 TYR CA C 13 1 -0.47 . . 0.50 . . 1 37 Ser C 1 38 Tyr Ca . 16580 4 35 2JCOCA . 1 1 39 39 PRO C C 13 1 . 1 1 40 40 HIS CA C 13 1 0.03 . . 0.50 . . 1 39 Pro C 1 40 His Ca . 16580 4 36 2JCOCA . 1 1 41 41 LYS C C 13 1 . 1 1 42 42 TYR CA C 13 1 -0.63 . . 0.50 . . 1 41 Lys C 1 42 Tyr Ca . 16580 4 37 2JCOCA . 1 1 42 42 TYR C C 13 1 . 1 1 43 43 ASN CA C 13 1 0.13 . . 0.50 . . 1 42 Tyr C 1 43 Asn Ca . 16580 4 38 2JCOCA . 1 1 43 43 ASN C C 13 1 . 1 1 44 44 ASN CA C 13 1 -0.82 . . 0.50 . . 1 43 Asn C 1 44 Asn Ca . 16580 4 39 2JCOCA . 1 1 44 44 ASN C C 13 1 . 1 1 45 45 TYR CA C 13 1 -0.65 . . 0.50 . . 1 44 Asn C 1 45 Tyr Ca . 16580 4 40 2JCOCA . 1 1 45 45 TYR C C 13 1 . 1 1 46 46 GLU CA C 13 1 -0.43 . . 0.50 . . 1 45 Tyr C 1 46 Glu Ca . 16580 4 41 2JCOCA . 1 1 46 46 GLU C C 13 1 . 1 1 47 47 GLY CA C 13 1 -0.62 . . 0.50 . . 1 46 Glu C 1 47 Gly Ca . 16580 4 42 2JCOCA . 1 1 47 47 GLY C C 13 1 . 1 1 48 48 PHE CA C 13 1 -0.63 . . 0.50 . . 1 47 Gly C 1 48 Phe Ca . 16580 4 43 2JCOCA . 1 1 48 48 PHE C C 13 1 . 1 1 49 49 ASP CA C 13 1 -0.95 . . 0.50 . . 1 48 Phe C 1 49 Asp Ca . 16580 4 44 2JCOCA . 1 1 49 49 ASP C C 13 1 . 1 1 50 50 PHE CA C 13 1 -0.87 . . 0.50 . . 1 49 Asp C 1 50 Phe Ca . 16580 4 45 2JCOCA . 1 1 50 50 PHE C C 13 1 . 1 1 51 51 SER CA C 13 1 -1.03 . . 0.50 . . 1 50 Phe C 1 51 Ser Ca . 16580 4 46 2JCOCA . 1 1 51 51 SER C C 13 1 . 1 1 52 52 VAL CA C 13 1 -0.31 . . 0.50 . . 1 51 Ser C 1 52 Val Ca . 16580 4 47 2JCOCA . 1 1 52 52 VAL C C 13 1 . 1 1 53 53 SER CA C 13 1 -0.80 . . 0.50 . . 1 52 Val C 1 53 Ser Ca . 16580 4 48 2JCOCA . 1 1 53 53 SER C C 13 1 . 1 1 54 54 SER CA C 13 1 -1.00 . . 0.50 . . 1 53 Ser C 1 54 Ser Ca . 16580 4 49 2JCOCA . 1 1 55 55 PRO C C 13 1 . 1 1 56 56 TYR CA C 13 1 -0.29 . . 0.50 . . 1 55 Pro C 1 56 Tyr Ca . 16580 4 50 2JCOCA . 1 1 56 56 TYR C C 13 1 . 1 1 57 57 TYR CA C 13 1 -0.25 . . 0.50 . . 1 56 Tyr C 1 57 Tyr Ca . 16580 4 51 2JCOCA . 1 1 57 57 TYR C C 13 1 . 1 1 58 58 GLU CA C 13 1 -0.77 . . 0.50 . . 1 57 Tyr C 1 58 Glu Ca . 16580 4 52 2JCOCA . 1 1 58 58 GLU C C 13 1 . 1 1 59 59 TRP CA C 13 1 -0.52 . . 0.50 . . 1 58 Glu C 1 59 Trp Ca . 16580 4 53 2JCOCA . 1 1 60 60 PRO C C 13 1 . 1 1 61 61 ILE CA C 13 1 -0.26 . . 0.50 . . 1 60 Pro C 1 61 Ile Ca . 16580 4 54 2JCOCA . 1 1 61 61 ILE C C 13 1 . 1 1 62 62 LEU CA C 13 1 -0.70 . . 0.50 . . 1 61 Ile C 1 62 Leu Ca . 16580 4 55 2JCOCA . 1 1 62 62 LEU C C 13 1 . 1 1 63 63 SER CA C 13 1 -0.52 . . 0.50 . . 1 62 Leu C 1 63 Ser Ca . 16580 4 56 2JCOCA . 1 1 63 63 SER C C 13 1 . 1 1 64 64 SER CA C 13 1 -0.36 . . 0.50 . . 1 63 Ser C 1 64 Ser Ca . 16580 4 57 2JCOCA . 1 1 64 64 SER C C 13 1 . 1 1 65 65 GLY CA C 13 1 -0.74 . . 0.50 . . 1 64 Ser C 1 65 Gly Ca . 16580 4 58 2JCOCA . 1 1 65 65 GLY C C 13 1 . 1 1 66 66 ASP CA C 13 1 -0.44 . . 0.50 . . 1 65 Gly C 1 66 Asp Ca . 16580 4 59 2JCOCA . 1 1 66 66 ASP C C 13 1 . 1 1 67 67 VAL CA C 13 1 -0.86 . . 0.50 . . 1 66 Asp C 1 67 Val Ca . 16580 4 60 2JCOCA . 1 1 67 67 VAL C C 13 1 . 1 1 68 68 TYR CA C 13 1 -1.29 . . 0.50 . . 1 67 Val C 1 68 Tyr Ca . 16580 4 61 2JCOCA . 1 1 68 68 TYR C C 13 1 . 1 1 69 69 SER CA C 13 1 -0.67 . . 0.50 . . 1 68 Tyr C 1 69 Ser Ca . 16580 4 62 2JCOCA . 1 1 73 73 PRO C C 13 1 . 1 1 74 74 GLY CA C 13 1 -0.38 . . 0.50 . . 1 73 Pro C 1 74 Gly Ca . 16580 4 63 2JCOCA . 1 1 74 74 GLY C C 13 1 . 1 1 75 75 ALA CA C 13 1 -0.68 . . 0.50 . . 1 74 Gly C 1 75 Ala Ca . 16580 4 64 2JCOCA . 1 1 75 75 ALA C C 13 1 . 1 1 76 76 ASP CA C 13 1 -0.12 . . 0.50 . . 1 75 Ala C 1 76 Asp Ca . 16580 4 65 2JCOCA . 1 1 76 76 ASP C C 13 1 . 1 1 77 77 ARG CA C 13 1 -0.48 . . 0.50 . . 1 76 Asp C 1 77 Arg Ca . 16580 4 66 2JCOCA . 1 1 77 77 ARG C C 13 1 . 1 1 78 78 VAL CA C 13 1 -1.02 . . 0.50 . . 1 77 Arg C 1 78 Val Ca . 16580 4 67 2JCOCA . 1 1 78 78 VAL C C 13 1 . 1 1 79 79 VAL CA C 13 1 -0.88 . . 0.50 . . 1 78 Val C 1 79 Val Ca . 16580 4 68 2JCOCA . 1 1 79 79 VAL C C 13 1 . 1 1 80 80 PHE CA C 13 1 -0.23 . . 0.50 . . 1 79 Val C 1 80 Phe Ca . 16580 4 69 2JCOCA . 1 1 80 80 PHE C C 13 1 . 1 1 81 81 ASN CA C 13 1 -0.43 . . 0.50 . . 1 80 Phe C 1 81 Asn Ca . 16580 4 70 2JCOCA . 1 1 81 81 ASN C C 13 1 . 1 1 82 82 GLU CA C 13 1 -0.93 . . 0.50 . . 1 81 Asn C 1 82 Glu Ca . 16580 4 71 2JCOCA . 1 1 82 82 GLU C C 13 1 . 1 1 83 83 ASN CA C 13 1 -0.58 . . 0.50 . . 1 82 Glu C 1 83 Asn Ca . 16580 4 72 2JCOCA . 1 1 83 83 ASN C C 13 1 . 1 1 84 84 ASN CA C 13 1 -0.73 . . 0.50 . . 1 83 Asn C 1 84 Asn Ca . 16580 4 73 2JCOCA . 1 1 84 84 ASN C C 13 1 . 1 1 85 85 GLN CA C 13 1 -0.33 . . 0.50 . . 1 84 Asn C 1 85 Gln Ca . 16580 4 74 2JCOCA . 1 1 85 85 GLN C C 13 1 . 1 1 86 86 LEU CA C 13 1 -1.08 . . 0.50 . . 1 85 Gln C 1 86 Leu Ca . 16580 4 75 2JCOCA . 1 1 86 86 LEU C C 13 1 . 1 1 87 87 ALA CA C 13 1 -0.63 . . 0.50 . . 1 86 Leu C 1 87 Ala Ca . 16580 4 76 2JCOCA . 1 1 87 87 ALA C C 13 1 . 1 1 88 88 GLY CA C 13 1 -0.04 . . 0.50 . . 1 87 Ala C 1 88 Gly Ca . 16580 4 77 2JCOCA . 1 1 88 88 GLY C C 13 1 . 1 1 89 89 VAL CA C 13 1 -0.38 . . 0.50 . . 1 88 Gly C 1 89 Val Ca . 16580 4 78 2JCOCA . 1 1 89 89 VAL C C 13 1 . 1 1 90 90 ILE CA C 13 1 -0.56 . . 0.50 . . 1 89 Val C 1 90 Ile Ca . 16580 4 79 2JCOCA . 1 1 90 90 ILE C C 13 1 . 1 1 91 91 THR CA C 13 1 -0.08 . . 0.50 . . 1 90 Ile C 1 91 Thr Ca . 16580 4 80 2JCOCA . 1 1 91 91 THR C C 13 1 . 1 1 92 92 HIS CA C 13 1 -0.45 . . 0.50 . . 1 91 Thr C 1 92 His Ca . 16580 4 81 2JCOCA . 1 1 92 92 HIS C C 13 1 . 1 1 93 93 THR CA C 13 1 -0.58 . . 0.50 . . 1 92 His C 1 93 Thr Ca . 16580 4 82 2JCOCA . 1 1 93 93 THR C C 13 1 . 1 1 94 94 GLY CA C 13 1 -0.97 . . 0.50 . . 1 93 Thr C 1 94 Gly Ca . 16580 4 83 2JCOCA . 1 1 94 94 GLY C C 13 1 . 1 1 95 95 ALA CA C 13 1 -0.63 . . 0.50 . . 1 94 Gly C 1 95 Ala Ca . 16580 4 84 2JCOCA . 1 1 95 95 ALA C C 13 1 . 1 1 96 96 SER CA C 13 1 -0.24 . . 0.50 . . 1 95 Ala C 1 96 Ser Ca . 16580 4 85 2JCOCA . 1 1 96 96 SER C C 13 1 . 1 1 97 97 GLY CA C 13 1 -1.53 . . 0.50 . . 1 96 Ser C 1 97 Gly Ca . 16580 4 86 2JCOCA . 1 1 98 98 ASN C C 13 1 . 1 1 99 99 ASN CA C 13 1 -0.70 . . 0.50 . . 1 98 Asn C 1 99 Asn Ca . 16580 4 87 2JCOCA . 1 1 99 99 ASN C C 13 1 . 1 1 100 100 PHE CA C 13 1 -0.53 . . 0.50 . . 1 99 Asn C 1 100 Phe Ca . 16580 4 88 2JCOCA . 1 1 100 100 PHE C C 13 1 . 1 1 101 101 VAL CA C 13 1 -0.69 . . 0.50 . . 1 100 Phe C 1 101 Val Ca . 16580 4 89 2JCOCA . 1 1 101 101 VAL C C 13 1 . 1 1 102 102 GLU CA C 13 1 -0.95 . . 0.50 . . 1 101 Val C 1 102 Glu Ca . 16580 4 90 2JCOCA . 1 1 102 102 GLU C C 13 1 . 1 1 103 103 CYS CA C 13 1 -1.22 . . 0.50 . . 1 102 Glu C 1 103 Cys Ca . 16580 4 91 2JCOCA . 1 1 103 103 CYS C C 13 1 . 1 1 104 104 THR CA C 13 1 -0.91 . . 0.50 . . 1 103 Cys C 1 104 Thr Ca . 16580 4 stop_ save_ save_2JHaCO _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JHaCO _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 5 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 6 '3D Ha-coupled [15N,1H]-TROSY-H(N)COCA' . . . 16580 5 9 '2D CO-coupled ct-[13C,1H]-HSQC' . . . 16580 5 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JHACO . 1 1 1 1 ALA HA H 1 1 . 1 1 1 1 ALA C C 13 1 -3.69 . . 0.50 . . 1 1 Ala Ha 1 1 Ala C . 16580 5 2 2JHACO . 1 1 2 2 CYS HA H 1 1 . 1 1 2 2 CYS C C 13 1 -3.56 . . 0.50 . . 1 2 Cys Ha 1 2 Cys C . 16580 5 3 2JHACO . 1 1 3 3 ASP HA H 1 1 . 1 1 3 3 ASP C C 13 1 -5.22 . . 0.50 . . 1 3 Asp Ha 1 3 Asp C . 16580 5 4 2JHACO . 1 1 4 4 TYR HA H 1 1 . 1 1 4 4 TYR C C 13 1 -3.95 . . 0.50 . . 1 4 Tyr Ha 1 4 Tyr C . 16580 5 5 2JHACO . 1 1 5 5 THR HA H 1 1 . 1 1 5 5 THR C C 13 1 -3.92 . . 0.50 . . 1 5 Thr Ha 1 5 Thr C . 16580 5 6 2JHACO . 1 1 6 6 CYS HA H 1 1 . 1 1 6 6 CYS C C 13 1 -4.08 . . 0.50 . . 1 6 Cys Ha 1 6 Cys C . 16580 5 7 2JHACO . 1 1 8 8 SER HA H 1 1 . 1 1 8 8 SER C C 13 1 -6.84 . . 0.50 . . 1 8 Ser Ha 1 8 Ser C . 16580 5 8 2JHACO . 1 1 9 9 ASN HA H 1 1 . 1 1 9 9 ASN C C 13 1 -3.69 . . 0.50 . . 1 9 Asn Ha 1 9 Asn C . 16580 5 9 2JHACO . 1 1 10 10 CYS HA H 1 1 . 1 1 10 10 CYS C C 13 1 -2.95 . . 0.50 . . 1 10 Cys Ha 1 10 Cys C . 16580 5 10 2JHACO . 1 1 11 11 TYR HA H 1 1 . 1 1 11 11 TYR C C 13 1 -3.20 . . 0.50 . . 1 11 Tyr Ha 1 11 Tyr C . 16580 5 11 2JHACO . 1 1 12 12 SER HA H 1 1 . 1 1 12 12 SER C C 13 1 -3.63 . . 0.50 . . 1 12 Ser Ha 1 12 Ser C . 16580 5 12 2JHACO . 1 1 13 13 SER HA H 1 1 . 1 1 13 13 SER C C 13 1 -4.81 . . 0.50 . . 1 13 Ser Ha 1 13 Ser C . 16580 5 13 2JHACO . 1 1 14 14 SER HA H 1 1 . 1 1 14 14 SER C C 13 1 -6.17 . . 0.50 . . 1 14 Ser Ha 1 14 Ser C . 16580 5 14 2JHACO . 1 1 15 15 ASP HA H 1 1 . 1 1 15 15 ASP C C 13 1 -5.07 . . 0.50 . . 1 15 Asp Ha 1 15 Asp C . 16580 5 15 2JHACO . 1 1 16 16 VAL HA H 1 1 . 1 1 16 16 VAL C C 13 1 -5.46 . . 0.50 . . 1 16 Val Ha 1 16 Val C . 16580 5 16 2JHACO . 1 1 17 17 SER HA H 1 1 . 1 1 17 17 SER C C 13 1 -5.73 . . 0.50 . . 1 17 Ser Ha 1 17 Ser C . 16580 5 17 2JHACO . 1 1 18 18 THR HA H 1 1 . 1 1 18 18 THR C C 13 1 -5.63 . . 0.50 . . 1 18 Thr Ha 1 18 Thr C . 16580 5 18 2JHACO . 1 1 19 19 ALA HA H 1 1 . 1 1 19 19 ALA C C 13 1 -5.36 . . 0.50 . . 1 19 Ala Ha 1 19 Ala C . 16580 5 19 2JHACO . 1 1 20 20 GLN HA H 1 1 . 1 1 20 20 GLN C C 13 1 -5.07 . . 0.50 . . 1 20 Gln Ha 1 20 Gln C . 16580 5 20 2JHACO . 1 1 21 21 ALA HA H 1 1 . 1 1 21 21 ALA C C 13 1 -5.22 . . 0.50 . . 1 21 Ala Ha 1 21 Ala C . 16580 5 21 2JHACO . 1 1 22 22 ALA HA H 1 1 . 1 1 22 22 ALA C C 13 1 -4.87 . . 0.50 . . 1 22 Ala Ha 1 22 Ala C . 16580 5 22 2JHACO . 1 1 24 24 TYR HA H 1 1 . 1 1 24 24 TYR C C 13 1 -5.01 . . 0.50 . . 1 24 Tyr Ha 1 24 Tyr C . 16580 5 23 2JHACO . 1 1 25 25 LYS HA H 1 1 . 1 1 25 25 LYS C C 13 1 -5.02 . . 0.50 . . 1 25 Lys Ha 1 25 Lys C . 16580 5 24 2JHACO . 1 1 26 26 LEU HA H 1 1 . 1 1 26 26 LEU C C 13 1 -5.47 . . 0.50 . . 1 26 Leu Ha 1 26 Leu C . 16580 5 25 2JHACO . 1 1 27 27 HIS HA H 1 1 . 1 1 27 27 HIS C C 13 1 -4.99 . . 0.50 . . 1 27 His Ha 1 27 His C . 16580 5 26 2JHACO . 1 1 28 28 GLU HA H 1 1 . 1 1 28 28 GLU C C 13 1 -5.40 . . 0.50 . . 1 28 Glu Ha 1 28 Glu C . 16580 5 27 2JHACO . 1 1 29 29 ASP HA H 1 1 . 1 1 29 29 ASP C C 13 1 -5.46 . . 0.50 . . 1 29 Asp Ha 1 29 Asp C . 16580 5 28 2JHACO . 1 1 31 31 GLU HA H 1 1 . 1 1 31 31 GLU C C 13 1 -4.19 . . 0.50 . . 1 31 Glu Ha 1 31 Glu C . 16580 5 29 2JHACO . 1 1 32 32 THR HA H 1 1 . 1 1 32 32 THR C C 13 1 -5.58 . . 0.50 . . 1 32 Thr Ha 1 32 Thr C . 16580 5 30 2JHACO . 1 1 33 33 VAL HA H 1 1 . 1 1 33 33 VAL C C 13 1 -4.74 . . 0.50 . . 1 33 Val Ha 1 33 Val C . 16580 5 31 2JHACO . 1 1 36 36 ASN HA H 1 1 . 1 1 36 36 ASN C C 13 1 -5.87 . . 0.50 . . 1 36 Asn Ha 1 36 Asn C . 16580 5 32 2JHACO . 1 1 37 37 SER HA H 1 1 . 1 1 37 37 SER C C 13 1 -5.45 . . 0.50 . . 1 37 Ser Ha 1 37 Ser C . 16580 5 33 2JHACO . 1 1 38 38 TYR HA H 1 1 . 1 1 38 38 TYR C C 13 1 -3.12 . . 0.50 . . 1 38 Tyr Ha 1 38 Tyr C . 16580 5 34 2JHACO . 1 1 39 39 PRO HA H 1 1 . 1 1 39 39 PRO C C 13 1 0.18 . . 0.50 . . 1 39 Pro Ha 1 39 Pro C . 16580 5 35 2JHACO . 1 1 40 40 HIS HA H 1 1 . 1 1 40 40 HIS C C 13 1 -4.07 . . 0.50 . . 1 40 His Ha 1 40 His C . 16580 5 36 2JHACO . 1 1 41 41 LYS HA H 1 1 . 1 1 41 41 LYS C C 13 1 -2.49 . . 0.50 . . 1 41 Lys Ha 1 41 Lys C . 16580 5 37 2JHACO . 1 1 42 42 TYR HA H 1 1 . 1 1 42 42 TYR C C 13 1 -3.81 . . 0.50 . . 1 42 Tyr Ha 1 42 Tyr C . 16580 5 38 2JHACO . 1 1 43 43 ASN HA H 1 1 . 1 1 43 43 ASN C C 13 1 -6.36 . . 0.50 . . 1 43 Asn Ha 1 43 Asn C . 16580 5 39 2JHACO . 1 1 44 44 ASN HA H 1 1 . 1 1 44 44 ASN C C 13 1 -5.96 . . 0.50 . . 1 44 Asn Ha 1 44 Asn C . 16580 5 40 2JHACO . 1 1 45 45 TYR HA H 1 1 . 1 1 45 45 TYR C C 13 1 -5.57 . . 0.50 . . 1 45 Tyr Ha 1 45 Tyr C . 16580 5 41 2JHACO . 1 1 46 46 GLU HA H 1 1 . 1 1 46 46 GLU C C 13 1 -5.18 . . 0.50 . . 1 46 Glu Ha 1 46 Glu C . 16580 5 42 2JHACO . 1 1 48 48 PHE HA H 1 1 . 1 1 48 48 PHE C C 13 1 -2.85 . . 0.50 . . 1 48 Phe Ha 1 48 Phe C . 16580 5 43 2JHACO . 1 1 49 49 ASP HA H 1 1 . 1 1 49 49 ASP C C 13 1 -3.77 . . 0.50 . . 1 49 Asp Ha 1 49 Asp C . 16580 5 44 2JHACO . 1 1 50 50 PHE HA H 1 1 . 1 1 50 50 PHE C C 13 1 -3.99 . . 0.50 . . 1 50 Phe Ha 1 50 Phe C . 16580 5 45 2JHACO . 1 1 51 51 SER HA H 1 1 . 1 1 51 51 SER C C 13 1 -6.21 . . 0.50 . . 1 51 Ser Ha 1 51 Ser C . 16580 5 46 2JHACO . 1 1 52 52 VAL HA H 1 1 . 1 1 52 52 VAL C C 13 1 -4.24 . . 0.50 . . 1 52 Val Ha 1 52 Val C . 16580 5 47 2JHACO . 1 1 53 53 SER HA H 1 1 . 1 1 53 53 SER C C 13 1 -2.77 . . 0.50 . . 1 53 Ser Ha 1 53 Ser C . 16580 5 48 2JHACO . 1 1 54 54 SER HA H 1 1 . 1 1 54 54 SER C C 13 1 -3.62 . . 0.50 . . 1 54 Ser Ha 1 54 Ser C . 16580 5 49 2JHACO . 1 1 55 55 PRO HA H 1 1 . 1 1 55 55 PRO C C 13 1 -0.68 . . 0.50 . . 1 55 Pro Ha 1 55 Pro C . 16580 5 50 2JHACO . 1 1 56 56 TYR HA H 1 1 . 1 1 56 56 TYR C C 13 1 -3.82 . . 0.50 . . 1 56 Tyr Ha 1 56 Tyr C . 16580 5 51 2JHACO . 1 1 57 57 TYR HA H 1 1 . 1 1 57 57 TYR C C 13 1 -3.94 . . 0.50 . . 1 57 Tyr Ha 1 57 Tyr C . 16580 5 52 2JHACO . 1 1 58 58 GLU HA H 1 1 . 1 1 58 58 GLU C C 13 1 -4.52 . . 0.50 . . 1 58 Glu Ha 1 58 Glu C . 16580 5 53 2JHACO . 1 1 59 59 TRP HA H 1 1 . 1 1 59 59 TRP C C 13 1 -3.44 . . 0.50 . . 1 59 Trp Ha 1 59 Trp C . 16580 5 54 2JHACO . 1 1 60 60 PRO HA H 1 1 . 1 1 60 60 PRO C C 13 1 -2.41 . . 0.50 . . 1 60 Pro Ha 1 60 Pro C . 16580 5 55 2JHACO . 1 1 61 61 ILE HA H 1 1 . 1 1 61 61 ILE C C 13 1 -3.66 . . 0.50 . . 1 61 Ile Ha 1 61 Ile C . 16580 5 56 2JHACO . 1 1 62 62 LEU HA H 1 1 . 1 1 62 62 LEU C C 13 1 -3.87 . . 0.50 . . 1 62 Leu Ha 1 62 Leu C . 16580 5 57 2JHACO . 1 1 63 63 SER HA H 1 1 . 1 1 63 63 SER C C 13 1 -5.47 . . 0.50 . . 1 63 Ser Ha 1 63 Ser C . 16580 5 58 2JHACO . 1 1 64 64 SER HA H 1 1 . 1 1 64 64 SER C C 13 1 -5.07 . . 0.50 . . 1 64 Ser Ha 1 64 Ser C . 16580 5 59 2JHACO . 1 1 66 66 ASP HA H 1 1 . 1 1 66 66 ASP C C 13 1 -3.85 . . 0.50 . . 1 66 Asp Ha 1 66 Asp C . 16580 5 60 2JHACO . 1 1 67 67 VAL HA H 1 1 . 1 1 67 67 VAL C C 13 1 -3.05 . . 0.50 . . 1 67 Val Ha 1 67 Val C . 16580 5 61 2JHACO . 1 1 68 68 TYR HA H 1 1 . 1 1 68 68 TYR C C 13 1 -2.16 . . 0.50 . . 1 68 Tyr Ha 1 68 Tyr C . 16580 5 62 2JHACO . 1 1 69 69 SER HA H 1 1 . 1 1 69 69 SER C C 13 1 -5.17 . . 0.50 . . 1 69 Ser Ha 1 69 Ser C . 16580 5 63 2JHACO . 1 1 73 73 PRO HA H 1 1 . 1 1 73 73 PRO C C 13 1 -5.05 . . 0.50 . . 1 73 Pro Ha 1 73 Pro C . 16580 5 64 2JHACO . 1 1 75 75 ALA HA H 1 1 . 1 1 75 75 ALA C C 13 1 -4.78 . . 0.50 . . 1 75 Ala Ha 1 75 Ala C . 16580 5 65 2JHACO . 1 1 76 76 ASP HA H 1 1 . 1 1 76 76 ASP C C 13 1 -3.91 . . 0.50 . . 1 76 Asp Ha 1 76 Asp C . 16580 5 66 2JHACO . 1 1 77 77 ARG HA H 1 1 . 1 1 77 77 ARG C C 13 1 -4.60 . . 0.50 . . 1 77 Arg Ha 1 77 Arg C . 16580 5 67 2JHACO . 1 1 78 78 VAL HA H 1 1 . 1 1 78 78 VAL C C 13 1 -4.02 . . 0.50 . . 1 78 Val Ha 1 78 Val C . 16580 5 68 2JHACO . 1 1 79 79 VAL HA H 1 1 . 1 1 79 79 VAL C C 13 1 -3.98 . . 0.50 . . 1 79 Val Ha 1 79 Val C . 16580 5 69 2JHACO . 1 1 80 80 PHE HA H 1 1 . 1 1 80 80 PHE C C 13 1 -5.21 . . 0.50 . . 1 80 Phe Ha 1 80 Phe C . 16580 5 70 2JHACO . 1 1 81 81 ASN HA H 1 1 . 1 1 81 81 ASN C C 13 1 -6.12 . . 0.50 . . 1 81 Asn Ha 1 81 Asn C . 16580 5 71 2JHACO . 1 1 82 82 GLU HA H 1 1 . 1 1 82 82 GLU C C 13 1 -4.81 . . 0.50 . . 1 82 Glu Ha 1 82 Glu C . 16580 5 72 2JHACO . 1 1 83 83 ASN HA H 1 1 . 1 1 83 83 ASN C C 13 1 -6.21 . . 0.50 . . 1 83 Asn Ha 1 83 Asn C . 16580 5 73 2JHACO . 1 1 84 84 ASN HA H 1 1 . 1 1 84 84 ASN C C 13 1 -5.68 . . 0.50 . . 1 84 Asn Ha 1 84 Asn C . 16580 5 74 2JHACO . 1 1 85 85 GLN HA H 1 1 . 1 1 85 85 GLN C C 13 1 -3.45 . . 0.50 . . 1 85 Gln Ha 1 85 Gln C . 16580 5 75 2JHACO . 1 1 86 86 LEU HA H 1 1 . 1 1 86 86 LEU C C 13 1 -1.87 . . 0.50 . . 1 86 Leu Ha 1 86 Leu C . 16580 5 76 2JHACO . 1 1 87 87 ALA HA H 1 1 . 1 1 87 87 ALA C C 13 1 -6.16 . . 0.50 . . 1 87 Ala Ha 1 87 Ala C . 16580 5 77 2JHACO . 1 1 89 89 VAL HA H 1 1 . 1 1 89 89 VAL C C 13 1 -3.91 . . 0.50 . . 1 89 Val Ha 1 89 Val C . 16580 5 78 2JHACO . 1 1 90 90 ILE HA H 1 1 . 1 1 90 90 ILE C C 13 1 -5.56 . . 0.50 . . 1 90 Ile Ha 1 90 Ile C . 16580 5 79 2JHACO . 1 1 91 91 THR HA H 1 1 . 1 1 91 91 THR C C 13 1 -4.35 . . 0.50 . . 1 91 Thr Ha 1 91 Thr C . 16580 5 80 2JHACO . 1 1 92 92 HIS HA H 1 1 . 1 1 92 92 HIS C C 13 1 -5.49 . . 0.50 . . 1 92 His Ha 1 92 His C . 16580 5 81 2JHACO . 1 1 93 93 THR HA H 1 1 . 1 1 93 93 THR C C 13 1 -3.02 . . 0.50 . . 1 93 Thr Ha 1 93 Thr C . 16580 5 82 2JHACO . 1 1 95 95 ALA HA H 1 1 . 1 1 95 95 ALA C C 13 1 -4.22 . . 0.50 . . 1 95 Ala Ha 1 95 Ala C . 16580 5 83 2JHACO . 1 1 96 96 SER HA H 1 1 . 1 1 96 96 SER C C 13 1 -4.56 . . 0.50 . . 1 96 Ser Ha 1 96 Ser C . 16580 5 84 2JHACO . 1 1 98 98 ASN HA H 1 1 . 1 1 98 98 ASN C C 13 1 -5.91 . . 0.50 . . 1 98 Asn Ha 1 98 Asn C . 16580 5 85 2JHACO . 1 1 99 99 ASN HA H 1 1 . 1 1 99 99 ASN C C 13 1 -3.97 . . 0.50 . . 1 99 Asn Ha 1 99 Asn C . 16580 5 86 2JHACO . 1 1 100 100 PHE HA H 1 1 . 1 1 100 100 PHE C C 13 1 -4.30 . . 0.50 . . 1 100 Phe Ha 1 100 Phe C . 16580 5 87 2JHACO . 1 1 101 101 VAL HA H 1 1 . 1 1 101 101 VAL C C 13 1 -4.62 . . 0.50 . . 1 101 Val Ha 1 101 Val C . 16580 5 88 2JHACO . 1 1 102 102 GLU HA H 1 1 . 1 1 102 102 GLU C C 13 1 -3.29 . . 0.50 . . 1 102 Glu Ha 1 102 Glu C . 16580 5 89 2JHACO . 1 1 103 103 CYS HA H 1 1 . 1 1 103 103 CYS C C 13 1 -3.16 . . 0.50 . . 1 103 Cys Ha 1 103 Cys C . 16580 5 90 2JHACO . 1 1 104 104 THR HA H 1 1 . 1 1 104 104 THR C C 13 1 -6.04 . . 0.50 . . 1 104 Thr Ha 1 104 Thr C . 16580 5 stop_ save_ save_2JHaCb _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JHaCb _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 6 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 950 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 8 '2D Cb-coupled [13C,1H]-HSQC' . . . 16580 6 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JHACB . 1 1 1 1 ALA HA H 1 1 . 1 1 1 1 ALA CB C 13 1 -4.34 . . 0.50 . . 1 1 Ala Ha 1 1 Ala Cb . 16580 6 2 2JHACB . 1 1 2 2 CYS HA H 1 1 . 1 1 2 2 CYS CB C 13 1 -3.44 . . 0.50 . . 1 2 Cys Ha 1 2 Cys Cb . 16580 6 3 2JHACB . 1 1 3 3 ASP HA H 1 1 . 1 1 3 3 ASP CB C 13 1 -4.54 . . 0.50 . . 1 3 Asp Ha 1 3 Asp Cb . 16580 6 4 2JHACB . 1 1 4 4 TYR HA H 1 1 . 1 1 4 4 TYR CB C 13 1 -4.54 . . 0.50 . . 1 4 Tyr Ha 1 4 Tyr Cb . 16580 6 5 2JHACB . 1 1 6 6 CYS HA H 1 1 . 1 1 6 6 CYS CB C 13 1 -4.58 . . 0.50 . . 1 6 Cys Ha 1 6 Cys Cb . 16580 6 6 2JHACB . 1 1 9 9 ASN HA H 1 1 . 1 1 9 9 ASN CB C 13 1 -1.10 . . 0.50 . . 1 9 Asn Ha 1 9 Asn Cb . 16580 6 7 2JHACB . 1 1 10 10 CYS HA H 1 1 . 1 1 10 10 CYS CB C 13 1 -0.85 . . 0.50 . . 1 10 Cys Ha 1 10 Cys Cb . 16580 6 8 2JHACB . 1 1 11 11 TYR HA H 1 1 . 1 1 11 11 TYR CB C 13 1 -4.49 . . 0.50 . . 1 11 Tyr Ha 1 11 Tyr Cb . 16580 6 9 2JHACB . 1 1 15 15 ASP HA H 1 1 . 1 1 15 15 ASP CB C 13 1 -6.24 . . 0.50 . . 1 15 Asp Ha 1 15 Asp Cb . 16580 6 10 2JHACB . 1 1 16 16 VAL HA H 1 1 . 1 1 16 16 VAL CB C 13 1 -4.93 . . 0.50 . . 1 16 Val Ha 1 16 Val Cb . 16580 6 11 2JHACB . 1 1 19 19 ALA HA H 1 1 . 1 1 19 19 ALA CB C 13 1 -4.56 . . 0.50 . . 1 19 Ala Ha 1 19 Ala Cb . 16580 6 12 2JHACB . 1 1 20 20 GLN HA H 1 1 . 1 1 20 20 GLN CB C 13 1 -4.24 . . 0.50 . . 1 20 Gln Ha 1 20 Gln Cb . 16580 6 13 2JHACB . 1 1 21 21 ALA HA H 1 1 . 1 1 21 21 ALA CB C 13 1 -4.89 . . 0.50 . . 1 21 Ala Ha 1 21 Ala Cb . 16580 6 14 2JHACB . 1 1 22 22 ALA HA H 1 1 . 1 1 22 22 ALA CB C 13 1 -4.70 . . 0.50 . . 1 22 Ala Ha 1 22 Ala Cb . 16580 6 15 2JHACB . 1 1 24 24 TYR HA H 1 1 . 1 1 24 24 TYR CB C 13 1 -4.71 . . 0.50 . . 1 24 Tyr Ha 1 24 Tyr Cb . 16580 6 16 2JHACB . 1 1 25 25 LYS HA H 1 1 . 1 1 25 25 LYS CB C 13 1 -4.23 . . 0.50 . . 1 25 Lys Ha 1 25 Lys Cb . 16580 6 17 2JHACB . 1 1 26 26 LEU HA H 1 1 . 1 1 26 26 LEU CB C 13 1 -8.41 . . 0.50 . . 1 26 Leu Ha 1 26 Leu Cb . 16580 6 18 2JHACB . 1 1 27 27 HIS HA H 1 1 . 1 1 27 27 HIS CB C 13 1 -4.39 . . 0.50 . . 1 27 His Ha 1 27 His Cb . 16580 6 19 2JHACB . 1 1 28 28 GLU HA H 1 1 . 1 1 28 28 GLU CB C 13 1 -4.87 . . 0.50 . . 1 28 Glu Ha 1 28 Glu Cb . 16580 6 20 2JHACB . 1 1 31 31 GLU HA H 1 1 . 1 1 31 31 GLU CB C 13 1 -5.37 . . 0.50 . . 1 31 Glu Ha 1 31 Glu Cb . 16580 6 21 2JHACB . 1 1 33 33 VAL HA H 1 1 . 1 1 33 33 VAL CB C 13 1 -4.55 . . 0.50 . . 1 33 Val Ha 1 33 Val Cb . 16580 6 22 2JHACB . 1 1 36 36 ASN HA H 1 1 . 1 1 36 36 ASN CB C 13 1 -6.20 . . 0.50 . . 1 36 Asn Ha 1 36 Asn Cb . 16580 6 23 2JHACB . 1 1 38 38 TYR HA H 1 1 . 1 1 38 38 TYR CB C 13 1 -1.07 . . 0.50 . . 1 38 Tyr Ha 1 38 Tyr Cb . 16580 6 24 2JHACB . 1 1 39 39 PRO HA H 1 1 . 1 1 39 39 PRO CB C 13 1 -4.33 . . 0.50 . . 1 39 Pro Ha 1 39 Pro Cb . 16580 6 25 2JHACB . 1 1 40 40 HIS HA H 1 1 . 1 1 40 40 HIS CB C 13 1 -4.61 . . 0.50 . . 1 40 His Ha 1 40 His Cb . 16580 6 26 2JHACB . 1 1 41 41 LYS HA H 1 1 . 1 1 41 41 LYS CB C 13 1 -4.55 . . 0.50 . . 1 41 Lys Ha 1 41 Lys Cb . 16580 6 27 2JHACB . 1 1 42 42 TYR HA H 1 1 . 1 1 42 42 TYR CB C 13 1 -5.26 . . 0.50 . . 1 42 Tyr Ha 1 42 Tyr Cb . 16580 6 28 2JHACB . 1 1 43 43 ASN HA H 1 1 . 1 1 43 43 ASN CB C 13 1 -7.19 . . 0.50 . . 1 43 Asn Ha 1 43 Asn Cb . 16580 6 29 2JHACB . 1 1 44 44 ASN HA H 1 1 . 1 1 44 44 ASN CB C 13 1 -5.47 . . 0.50 . . 1 44 Asn Ha 1 44 Asn Cb . 16580 6 30 2JHACB . 1 1 45 45 TYR HA H 1 1 . 1 1 45 45 TYR CB C 13 1 -5.67 . . 0.50 . . 1 45 Tyr Ha 1 45 Tyr Cb . 16580 6 31 2JHACB . 1 1 46 46 GLU HA H 1 1 . 1 1 46 46 GLU CB C 13 1 -5.24 . . 0.50 . . 1 46 Glu Ha 1 46 Glu Cb . 16580 6 32 2JHACB . 1 1 48 48 PHE HA H 1 1 . 1 1 48 48 PHE CB C 13 1 -6.14 . . 0.50 . . 1 48 Phe Ha 1 48 Phe Cb . 16580 6 33 2JHACB . 1 1 49 49 ASP HA H 1 1 . 1 1 49 49 ASP CB C 13 1 -5.05 . . 0.50 . . 1 49 Asp Ha 1 49 Asp Cb . 16580 6 34 2JHACB . 1 1 50 50 PHE HA H 1 1 . 1 1 50 50 PHE CB C 13 1 -3.57 . . 0.50 . . 1 50 Phe Ha 1 50 Phe Cb . 16580 6 35 2JHACB . 1 1 52 52 VAL HA H 1 1 . 1 1 52 52 VAL CB C 13 1 -4.35 . . 0.50 . . 1 52 Val Ha 1 52 Val Cb . 16580 6 36 2JHACB . 1 1 55 55 PRO HA H 1 1 . 1 1 55 55 PRO CB C 13 1 -2.63 . . 0.50 . . 1 55 Pro Ha 1 55 Pro Cb . 16580 6 37 2JHACB . 1 1 56 56 TYR HA H 1 1 . 1 1 56 56 TYR CB C 13 1 -6.61 . . 0.50 . . 1 56 Tyr Ha 1 56 Tyr Cb . 16580 6 38 2JHACB . 1 1 57 57 TYR HA H 1 1 . 1 1 57 57 TYR CB C 13 1 -4.59 . . 0.50 . . 1 57 Tyr Ha 1 57 Tyr Cb . 16580 6 39 2JHACB . 1 1 58 58 GLU HA H 1 1 . 1 1 58 58 GLU CB C 13 1 -4.29 . . 0.50 . . 1 58 Glu Ha 1 58 Glu Cb . 16580 6 40 2JHACB . 1 1 59 59 TRP HA H 1 1 . 1 1 59 59 TRP CB C 13 1 -3.34 . . 0.50 . . 1 59 Trp Ha 1 59 Trp Cb . 16580 6 41 2JHACB . 1 1 60 60 PRO HA H 1 1 . 1 1 60 60 PRO CB C 13 1 -5.00 . . 0.50 . . 1 60 Pro Ha 1 60 Pro Cb . 16580 6 42 2JHACB . 1 1 61 61 ILE HA H 1 1 . 1 1 61 61 ILE CB C 13 1 -3.29 . . 0.50 . . 1 61 Ile Ha 1 61 Ile Cb . 16580 6 43 2JHACB . 1 1 62 62 LEU HA H 1 1 . 1 1 62 62 LEU CB C 13 1 -4.01 . . 0.50 . . 1 62 Leu Ha 1 62 Leu Cb . 16580 6 44 2JHACB . 1 1 66 66 ASP HA H 1 1 . 1 1 66 66 ASP CB C 13 1 -5.01 . . 0.50 . . 1 66 Asp Ha 1 66 Asp Cb . 16580 6 45 2JHACB . 1 1 68 68 TYR HA H 1 1 . 1 1 68 68 TYR CB C 13 1 -3.49 . . 0.50 . . 1 68 Tyr Ha 1 68 Tyr Cb . 16580 6 46 2JHACB . 1 1 73 73 PRO HA H 1 1 . 1 1 73 73 PRO CB C 13 1 -1.44 . . 0.50 . . 1 73 Pro Ha 1 73 Pro Cb . 16580 6 47 2JHACB . 1 1 75 75 ALA HA H 1 1 . 1 1 75 75 ALA CB C 13 1 -5.21 . . 0.50 . . 1 75 Ala Ha 1 75 Ala Cb . 16580 6 48 2JHACB . 1 1 76 76 ASP HA H 1 1 . 1 1 76 76 ASP CB C 13 1 -6.11 . . 0.50 . . 1 76 Asp Ha 1 76 Asp Cb . 16580 6 49 2JHACB . 1 1 77 77 ARG HA H 1 1 . 1 1 77 77 ARG CB C 13 1 -4.96 . . 0.50 . . 1 77 Arg Ha 1 77 Arg Cb . 16580 6 50 2JHACB . 1 1 78 78 VAL HA H 1 1 . 1 1 78 78 VAL CB C 13 1 -5.05 . . 0.50 . . 1 78 Val Ha 1 78 Val Cb . 16580 6 51 2JHACB . 1 1 79 79 VAL HA H 1 1 . 1 1 79 79 VAL CB C 13 1 -4.69 . . 0.50 . . 1 79 Val Ha 1 79 Val Cb . 16580 6 52 2JHACB . 1 1 80 80 PHE HA H 1 1 . 1 1 80 80 PHE CB C 13 1 -4.40 . . 0.50 . . 1 80 Phe Ha 1 80 Phe Cb . 16580 6 53 2JHACB . 1 1 81 81 ASN HA H 1 1 . 1 1 81 81 ASN CB C 13 1 -5.03 . . 0.50 . . 1 81 Asn Ha 1 81 Asn Cb . 16580 6 54 2JHACB . 1 1 82 82 GLU HA H 1 1 . 1 1 82 82 GLU CB C 13 1 -4.79 . . 0.50 . . 1 82 Glu Ha 1 82 Glu Cb . 16580 6 55 2JHACB . 1 1 83 83 ASN HA H 1 1 . 1 1 83 83 ASN CB C 13 1 -5.99 . . 0.50 . . 1 83 Asn Ha 1 83 Asn Cb . 16580 6 56 2JHACB . 1 1 84 84 ASN HA H 1 1 . 1 1 84 84 ASN CB C 13 1 -6.07 . . 0.50 . . 1 84 Asn Ha 1 84 Asn Cb . 16580 6 57 2JHACB . 1 1 85 85 GLN HA H 1 1 . 1 1 85 85 GLN CB C 13 1 -5.33 . . 0.50 . . 1 85 Gln Ha 1 85 Gln Cb . 16580 6 58 2JHACB . 1 1 86 86 LEU HA H 1 1 . 1 1 86 86 LEU CB C 13 1 -5.43 . . 0.50 . . 1 86 Leu Ha 1 86 Leu Cb . 16580 6 59 2JHACB . 1 1 87 87 ALA HA H 1 1 . 1 1 87 87 ALA CB C 13 1 -5.39 . . 0.50 . . 1 87 Ala Ha 1 87 Ala Cb . 16580 6 60 2JHACB . 1 1 89 89 VAL HA H 1 1 . 1 1 89 89 VAL CB C 13 1 -4.52 . . 0.50 . . 1 89 Val Ha 1 89 Val Cb . 16580 6 61 2JHACB . 1 1 90 90 ILE HA H 1 1 . 1 1 90 90 ILE CB C 13 1 -4.63 . . 0.50 . . 1 90 Ile Ha 1 90 Ile Cb . 16580 6 62 2JHACB . 1 1 92 92 HIS HA H 1 1 . 1 1 92 92 HIS CB C 13 1 -6.41 . . 0.50 . . 1 92 His Ha 1 92 His Cb . 16580 6 63 2JHACB . 1 1 95 95 ALA HA H 1 1 . 1 1 95 95 ALA CB C 13 1 -7.34 . . 0.50 . . 1 95 Ala Ha 1 95 Ala Cb . 16580 6 64 2JHACB . 1 1 98 98 ASN HA H 1 1 . 1 1 98 98 ASN CB C 13 1 -5.75 . . 0.50 . . 1 98 Asn Ha 1 98 Asn Cb . 16580 6 65 2JHACB . 1 1 99 99 ASN HA H 1 1 . 1 1 99 99 ASN CB C 13 1 -6.26 . . 0.50 . . 1 99 Asn Ha 1 99 Asn Cb . 16580 6 66 2JHACB . 1 1 100 100 PHE HA H 1 1 . 1 1 100 100 PHE CB C 13 1 -2.70 . . 0.50 . . 1 100 Phe Ha 1 100 Phe Cb . 16580 6 67 2JHACB . 1 1 101 101 VAL HA H 1 1 . 1 1 101 101 VAL CB C 13 1 -3.93 . . 0.50 . . 1 101 Val Ha 1 101 Val Cb . 16580 6 68 2JHACB . 1 1 102 102 GLU HA H 1 1 . 1 1 102 102 GLU CB C 13 1 -4.54 . . 0.50 . . 1 102 Glu Ha 1 102 Glu Cb . 16580 6 69 2JHACB . 1 1 103 103 CYS HA H 1 1 . 1 1 103 103 CYS CB C 13 1 -0.30 . . 0.50 . . 1 103 Cys Ha 1 103 Cys Cb . 16580 6 stop_ save_ save_2JCbCO _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JCbCO _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 7 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 7 '3D Cb-coupled [15N,1H]-TROSY-H(N)COCA' . . . 16580 7 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JCBCO . 1 1 2 2 CYS CB C 13 1 . 1 1 2 2 CYS C C 13 1 0.32 . . 0.50 . . 1 2 Cys Cb 1 2 Cys C . 16580 7 2 2JCBCO . 1 1 3 3 ASP CB C 13 1 . 1 1 3 3 ASP C C 13 1 -0.33 . . 0.50 . . 1 3 Asp Cb 1 3 Asp C . 16580 7 3 2JCBCO . 1 1 4 4 TYR CB C 13 1 . 1 1 4 4 TYR C C 13 1 -0.23 . . 0.50 . . 1 4 Tyr Cb 1 4 Tyr C . 16580 7 4 2JCBCO . 1 1 6 6 CYS CB C 13 1 . 1 1 6 6 CYS C C 13 1 1.39 . . 0.50 . . 1 6 Cys Cb 1 6 Cys C . 16580 7 5 2JCBCO . 1 1 9 9 ASN CB C 13 1 . 1 1 9 9 ASN C C 13 1 0.40 . . 0.50 . . 1 9 Asn Cb 1 9 Asn C . 16580 7 6 2JCBCO . 1 1 10 10 CYS CB C 13 1 . 1 1 10 10 CYS C C 13 1 -0.43 . . 0.50 . . 1 10 Cys Cb 1 10 Cys C . 16580 7 7 2JCBCO . 1 1 11 11 TYR CB C 13 1 . 1 1 11 11 TYR C C 13 1 0.23 . . 0.50 . . 1 11 Tyr Cb 1 11 Tyr C . 16580 7 8 2JCBCO . 1 1 15 15 ASP CB C 13 1 . 1 1 15 15 ASP C C 13 1 -0.55 . . 0.50 . . 1 15 Asp Cb 1 15 Asp C . 16580 7 9 2JCBCO . 1 1 16 16 VAL CB C 13 1 . 1 1 16 16 VAL C C 13 1 -0.65 . . 0.50 . . 1 16 Val Cb 1 16 Val C . 16580 7 10 2JCBCO . 1 1 19 19 ALA CB C 13 1 . 1 1 19 19 ALA C C 13 1 -1.00 . . 0.50 . . 1 19 Ala Cb 1 19 Ala C . 16580 7 11 2JCBCO . 1 1 20 20 GLN CB C 13 1 . 1 1 20 20 GLN C C 13 1 -1.57 . . 0.50 . . 1 20 Gln Cb 1 20 Gln C . 16580 7 12 2JCBCO . 1 1 21 21 ALA CB C 13 1 . 1 1 21 21 ALA C C 13 1 -1.52 . . 0.50 . . 1 21 Ala Cb 1 21 Ala C . 16580 7 13 2JCBCO . 1 1 22 22 ALA CB C 13 1 . 1 1 22 22 ALA C C 13 1 -1.24 . . 0.50 . . 1 22 Ala Cb 1 22 Ala C . 16580 7 14 2JCBCO . 1 1 24 24 TYR CB C 13 1 . 1 1 24 24 TYR C C 13 1 -1.36 . . 0.50 . . 1 24 Tyr Cb 1 24 Tyr C . 16580 7 15 2JCBCO . 1 1 25 25 LYS CB C 13 1 . 1 1 25 25 LYS C C 13 1 -1.29 . . 0.50 . . 1 25 Lys Cb 1 25 Lys C . 16580 7 16 2JCBCO . 1 1 26 26 LEU CB C 13 1 . 1 1 26 26 LEU C C 13 1 -0.75 . . 0.50 . . 1 26 Leu Cb 1 26 Leu C . 16580 7 17 2JCBCO . 1 1 27 27 HIS CB C 13 1 . 1 1 27 27 HIS C C 13 1 -1.03 . . 0.50 . . 1 27 His Cb 1 27 His C . 16580 7 18 2JCBCO . 1 1 28 28 GLU CB C 13 1 . 1 1 28 28 GLU C C 13 1 -0.93 . . 0.50 . . 1 28 Glu Cb 1 28 Glu C . 16580 7 19 2JCBCO . 1 1 29 29 ASP CB C 13 1 . 1 1 29 29 ASP C C 13 1 -0.12 . . 0.50 . . 1 29 Asp Cb 1 29 Asp C . 16580 7 20 2JCBCO . 1 1 31 31 GLU CB C 13 1 . 1 1 31 31 GLU C C 13 1 0.51 . . 0.50 . . 1 31 Glu Cb 1 31 Glu C . 16580 7 21 2JCBCO . 1 1 33 33 VAL CB C 13 1 . 1 1 33 33 VAL C C 13 1 0.06 . . 0.50 . . 1 33 Val Cb 1 33 Val C . 16580 7 22 2JCBCO . 1 1 36 36 ASN CB C 13 1 . 1 1 36 36 ASN C C 13 1 0.20 . . 0.50 . . 1 36 Asn Cb 1 36 Asn C . 16580 7 23 2JCBCO . 1 1 39 39 PRO CB C 13 1 . 1 1 39 39 PRO C C 13 1 -1.37 . . 0.50 . . 1 39 Pro Cb 1 39 Pro C . 16580 7 24 2JCBCO . 1 1 40 40 HIS CB C 13 1 . 1 1 40 40 HIS C C 13 1 -0.06 . . 0.50 . . 1 40 His Cb 1 40 His C . 16580 7 25 2JCBCO . 1 1 41 41 LYS CB C 13 1 . 1 1 41 41 LYS C C 13 1 -1.45 . . 0.50 . . 1 41 Lys Cb 1 41 Lys C . 16580 7 26 2JCBCO . 1 1 42 42 TYR CB C 13 1 . 1 1 42 42 TYR C C 13 1 -0.31 . . 0.50 . . 1 42 Tyr Cb 1 42 Tyr C . 16580 7 27 2JCBCO . 1 1 43 43 ASN CB C 13 1 . 1 1 43 43 ASN C C 13 1 -1.02 . . 0.50 . . 1 43 Asn Cb 1 43 Asn C . 16580 7 28 2JCBCO . 1 1 44 44 ASN CB C 13 1 . 1 1 44 44 ASN C C 13 1 -0.53 . . 0.50 . . 1 44 Asn Cb 1 44 Asn C . 16580 7 29 2JCBCO . 1 1 45 45 TYR CB C 13 1 . 1 1 45 45 TYR C C 13 1 -0.48 . . 0.50 . . 1 45 Tyr Cb 1 45 Tyr C . 16580 7 30 2JCBCO . 1 1 46 46 GLU CB C 13 1 . 1 1 46 46 GLU C C 13 1 -0.45 . . 0.50 . . 1 46 Glu Cb 1 46 Glu C . 16580 7 31 2JCBCO . 1 1 48 48 PHE CB C 13 1 . 1 1 48 48 PHE C C 13 1 -0.39 . . 0.50 . . 1 48 Phe Cb 1 48 Phe C . 16580 7 32 2JCBCO . 1 1 49 49 ASP CB C 13 1 . 1 1 49 49 ASP C C 13 1 -0.44 . . 0.50 . . 1 49 Asp Cb 1 49 Asp C . 16580 7 33 2JCBCO . 1 1 50 50 PHE CB C 13 1 . 1 1 50 50 PHE C C 13 1 -0.27 . . 0.50 . . 1 50 Phe Cb 1 50 Phe C . 16580 7 34 2JCBCO . 1 1 52 52 VAL CB C 13 1 . 1 1 52 52 VAL C C 13 1 -0.21 . . 0.50 . . 1 52 Val Cb 1 52 Val C . 16580 7 35 2JCBCO . 1 1 55 55 PRO CB C 13 1 . 1 1 55 55 PRO C C 13 1 -1.20 . . 0.50 . . 1 55 Pro Cb 1 55 Pro C . 16580 7 36 2JCBCO . 1 1 56 56 TYR CB C 13 1 . 1 1 56 56 TYR C C 13 1 0.23 . . 0.50 . . 1 56 Tyr Cb 1 56 Tyr C . 16580 7 37 2JCBCO . 1 1 57 57 TYR CB C 13 1 . 1 1 57 57 TYR C C 13 1 0.04 . . 0.50 . . 1 57 Tyr Cb 1 57 Tyr C . 16580 7 38 2JCBCO . 1 1 58 58 GLU CB C 13 1 . 1 1 58 58 GLU C C 13 1 -0.39 . . 0.50 . . 1 58 Glu Cb 1 58 Glu C . 16580 7 39 2JCBCO . 1 1 60 60 PRO CB C 13 1 . 1 1 60 60 PRO C C 13 1 -0.95 . . 0.50 . . 1 60 Pro Cb 1 60 Pro C . 16580 7 40 2JCBCO . 1 1 61 61 ILE CB C 13 1 . 1 1 61 61 ILE C C 13 1 -0.42 . . 0.50 . . 1 61 Ile Cb 1 61 Ile C . 16580 7 41 2JCBCO . 1 1 62 62 LEU CB C 13 1 . 1 1 62 62 LEU C C 13 1 -0.25 . . 0.50 . . 1 62 Leu Cb 1 62 Leu C . 16580 7 42 2JCBCO . 1 1 66 66 ASP CB C 13 1 . 1 1 66 66 ASP C C 13 1 -0.39 . . 0.50 . . 1 66 Asp Cb 1 66 Asp C . 16580 7 43 2JCBCO . 1 1 67 67 VAL CB C 13 1 . 1 1 67 67 VAL C C 13 1 -0.54 . . 0.50 . . 1 67 Val Cb 1 67 Val C . 16580 7 44 2JCBCO . 1 1 68 68 TYR CB C 13 1 . 1 1 68 68 TYR C C 13 1 -1.24 . . 0.50 . . 1 68 Tyr Cb 1 68 Tyr C . 16580 7 45 2JCBCO . 1 1 73 73 PRO CB C 13 1 . 1 1 73 73 PRO C C 13 1 -1.11 . . 0.50 . . 1 73 Pro Cb 1 73 Pro C . 16580 7 46 2JCBCO . 1 1 75 75 ALA CB C 13 1 . 1 1 75 75 ALA C C 13 1 -1.15 . . 0.50 . . 1 75 Ala Cb 1 75 Ala C . 16580 7 47 2JCBCO . 1 1 76 76 ASP CB C 13 1 . 1 1 76 76 ASP C C 13 1 0.52 . . 0.50 . . 1 76 Asp Cb 1 76 Asp C . 16580 7 48 2JCBCO . 1 1 77 77 ARG CB C 13 1 . 1 1 77 77 ARG C C 13 1 -0.19 . . 0.50 . . 1 77 Arg Cb 1 77 Arg C . 16580 7 49 2JCBCO . 1 1 78 78 VAL CB C 13 1 . 1 1 78 78 VAL C C 13 1 -0.06 . . 0.50 . . 1 78 Val Cb 1 78 Val C . 16580 7 50 2JCBCO . 1 1 79 79 VAL CB C 13 1 . 1 1 79 79 VAL C C 13 1 0.02 . . 0.50 . . 1 79 Val Cb 1 79 Val C . 16580 7 51 2JCBCO . 1 1 80 80 PHE CB C 13 1 . 1 1 80 80 PHE C C 13 1 -0.45 . . 0.50 . . 1 80 Phe Cb 1 80 Phe C . 16580 7 52 2JCBCO . 1 1 81 81 ASN CB C 13 1 . 1 1 81 81 ASN C C 13 1 -0.07 . . 0.50 . . 1 81 Asn Cb 1 81 Asn C . 16580 7 53 2JCBCO . 1 1 82 82 GLU CB C 13 1 . 1 1 82 82 GLU C C 13 1 -1.14 . . 0.50 . . 1 82 Glu Cb 1 82 Glu C . 16580 7 54 2JCBCO . 1 1 83 83 ASN CB C 13 1 . 1 1 83 83 ASN C C 13 1 0.59 . . 0.50 . . 1 83 Asn Cb 1 83 Asn C . 16580 7 55 2JCBCO . 1 1 84 84 ASN CB C 13 1 . 1 1 84 84 ASN C C 13 1 -0.22 . . 0.50 . . 1 84 Asn Cb 1 84 Asn C . 16580 7 56 2JCBCO . 1 1 85 85 GLN CB C 13 1 . 1 1 85 85 GLN C C 13 1 0.15 . . 0.50 . . 1 85 Gln Cb 1 85 Gln C . 16580 7 57 2JCBCO . 1 1 86 86 LEU CB C 13 1 . 1 1 86 86 LEU C C 13 1 -1.01 . . 0.50 . . 1 86 Leu Cb 1 86 Leu C . 16580 7 58 2JCBCO . 1 1 87 87 ALA CB C 13 1 . 1 1 87 87 ALA C C 13 1 0.09 . . 0.50 . . 1 87 Ala Cb 1 87 Ala C . 16580 7 59 2JCBCO . 1 1 89 89 VAL CB C 13 1 . 1 1 89 89 VAL C C 13 1 -0.20 . . 0.50 . . 1 89 Val Cb 1 89 Val C . 16580 7 60 2JCBCO . 1 1 90 90 ILE CB C 13 1 . 1 1 90 90 ILE C C 13 1 0.13 . . 0.50 . . 1 90 Ile Cb 1 90 Ile C . 16580 7 61 2JCBCO . 1 1 92 92 HIS CB C 13 1 . 1 1 92 92 HIS C C 13 1 0.16 . . 0.50 . . 1 92 His Cb 1 92 His C . 16580 7 62 2JCBCO . 1 1 95 95 ALA CB C 13 1 . 1 1 95 95 ALA C C 13 1 -0.37 . . 0.50 . . 1 95 Ala Cb 1 95 Ala C . 16580 7 63 2JCBCO . 1 1 98 98 ASN CB C 13 1 . 1 1 98 98 ASN C C 13 1 0.07 . . 0.50 . . 1 98 Asn Cb 1 98 Asn C . 16580 7 64 2JCBCO . 1 1 99 99 ASN CB C 13 1 . 1 1 99 99 ASN C C 13 1 0.03 . . 0.50 . . 1 99 Asn Cb 1 99 Asn C . 16580 7 65 2JCBCO . 1 1 100 100 PHE CB C 13 1 . 1 1 100 100 PHE C C 13 1 0.08 . . 0.50 . . 1 100 Phe Cb 1 100 Phe C . 16580 7 66 2JCBCO . 1 1 101 101 VAL CB C 13 1 . 1 1 101 101 VAL C C 13 1 0.01 . . 0.50 . . 1 101 Val Cb 1 101 Val C . 16580 7 67 2JCBCO . 1 1 102 102 GLU CB C 13 1 . 1 1 102 102 GLU C C 13 1 -0.66 . . 0.50 . . 1 102 Glu Cb 1 102 Glu C . 16580 7 68 2JCBCO . 1 1 103 103 CYS CB C 13 1 . 1 1 103 103 CYS C C 13 1 0.30 . . 0.50 . . 1 103 Cys Cb 1 103 Cys C . 16580 7 stop_ save_ save_2JN_HA _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JN_HA _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 8 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 4 '3D Ha-coupled ct-[15N,1H]-TROSY-iHNCA' . . . 16580 8 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JN_HA . 1 1 3 3 ASP N N 15 1 . 1 1 3 3 ASP HA H 1 1 0.25 . . 0.50 . . 1 3 Asp N 1 3 Asp HA . 16580 8 2 2JN_HA . 1 1 5 5 THR N N 15 1 . 1 1 5 5 THR HA H 1 1 0.89 . . 0.50 . . 1 5 Thr N 1 5 Thr HA . 16580 8 3 2JN_HA . 1 1 6 6 CYS N N 15 1 . 1 1 6 6 CYS HA H 1 1 0.44 . . 0.50 . . 1 6 Cys N 1 6 Cys HA . 16580 8 4 2JN_HA . 1 1 8 8 SER N N 15 1 . 1 1 8 8 SER HA H 1 1 1.11 . . 0.50 . . 1 8 Ser N 1 8 Ser HA . 16580 8 5 2JN_HA . 1 1 9 9 ASN N N 15 1 . 1 1 9 9 ASN HA H 1 1 0.27 . . 0.50 . . 1 9 Asn N 1 9 Asn HA . 16580 8 6 2JN_HA . 1 1 10 10 CYS N N 15 1 . 1 1 10 10 CYS HA H 1 1 0.52 . . 0.50 . . 1 10 Cys N 1 10 Cys HA . 16580 8 7 2JN_HA . 1 1 11 11 TYR N N 15 1 . 1 1 11 11 TYR HA H 1 1 0.47 . . 0.50 . . 1 11 Tyr N 1 11 Tyr HA . 16580 8 8 2JN_HA . 1 1 12 12 SER N N 15 1 . 1 1 12 12 SER HA H 1 1 0.46 . . 0.50 . . 1 12 Ser N 1 12 Ser HA . 16580 8 9 2JN_HA . 1 1 13 13 SER N N 15 1 . 1 1 13 13 SER HA H 1 1 2.16 . . 0.50 . . 1 13 Ser N 1 13 Ser HA . 16580 8 10 2JN_HA . 1 1 15 15 ASP N N 15 1 . 1 1 15 15 ASP HA H 1 1 -0.16 . . 0.50 . . 1 15 Asp N 1 15 Asp HA . 16580 8 11 2JN_HA . 1 1 16 16 VAL N N 15 1 . 1 1 16 16 VAL HA H 1 1 0.82 . . 0.50 . . 1 16 Val N 1 16 Val HA . 16580 8 12 2JN_HA . 1 1 17 17 SER N N 15 1 . 1 1 17 17 SER HA H 1 1 -0.95 . . 0.50 . . 1 17 Ser N 1 17 Ser HA . 16580 8 13 2JN_HA . 1 1 18 18 THR N N 15 1 . 1 1 18 18 THR HA H 1 1 0.33 . . 0.50 . . 1 18 Thr N 1 18 Thr HA . 16580 8 14 2JN_HA . 1 1 19 19 ALA N N 15 1 . 1 1 19 19 ALA HA H 1 1 0.35 . . 0.50 . . 1 19 Ala N 1 19 Ala HA . 16580 8 15 2JN_HA . 1 1 20 20 GLN N N 15 1 . 1 1 20 20 GLN HA H 1 1 0.81 . . 0.50 . . 1 20 Gln N 1 20 Gln HA . 16580 8 16 2JN_HA . 1 1 21 21 ALA N N 15 1 . 1 1 21 21 ALA HA H 1 1 0.43 . . 0.50 . . 1 21 Ala N 1 21 Ala HA . 16580 8 17 2JN_HA . 1 1 22 22 ALA N N 15 1 . 1 1 22 22 ALA HA H 1 1 0.40 . . 0.50 . . 1 22 Ala N 1 22 Ala HA . 16580 8 18 2JN_HA . 1 1 24 24 TYR N N 15 1 . 1 1 24 24 TYR HA H 1 1 1.05 . . 0.50 . . 1 24 Tyr N 1 24 Tyr HA . 16580 8 19 2JN_HA . 1 1 25 25 LYS N N 15 1 . 1 1 25 25 LYS HA H 1 1 1.01 . . 0.50 . . 1 25 Lys N 1 25 Lys HA . 16580 8 20 2JN_HA . 1 1 26 26 LEU N N 15 1 . 1 1 26 26 LEU HA H 1 1 0.32 . . 0.50 . . 1 26 Leu N 1 26 Leu HA . 16580 8 21 2JN_HA . 1 1 27 27 HIS N N 15 1 . 1 1 27 27 HIS HA H 1 1 0.64 . . 0.50 . . 1 27 His N 1 27 His HA . 16580 8 22 2JN_HA . 1 1 29 29 ASP N N 15 1 . 1 1 29 29 ASP HA H 1 1 0.75 . . 0.50 . . 1 29 Asp N 1 29 Asp HA . 16580 8 23 2JN_HA . 1 1 31 31 GLU N N 15 1 . 1 1 31 31 GLU HA H 1 1 0.46 . . 0.50 . . 1 31 Glu N 1 31 Glu HA . 16580 8 24 2JN_HA . 1 1 32 32 THR N N 15 1 . 1 1 32 32 THR HA H 1 1 0.83 . . 0.50 . . 1 32 Thr N 1 32 Thr HA . 16580 8 25 2JN_HA . 1 1 33 33 VAL N N 15 1 . 1 1 33 33 VAL HA H 1 1 0.56 . . 0.50 . . 1 33 Val N 1 33 Val HA . 16580 8 26 2JN_HA . 1 1 37 37 SER N N 15 1 . 1 1 37 37 SER HA H 1 1 -0.10 . . 0.50 . . 1 37 Ser N 1 37 Ser HA . 16580 8 27 2JN_HA . 1 1 38 38 TYR N N 15 1 . 1 1 38 38 TYR HA H 1 1 0.50 . . 0.50 . . 1 38 Tyr N 1 38 Tyr HA . 16580 8 28 2JN_HA . 1 1 40 40 HIS N N 15 1 . 1 1 40 40 HIS HA H 1 1 0.37 . . 0.50 . . 1 40 His N 1 40 His HA . 16580 8 29 2JN_HA . 1 1 42 42 TYR N N 15 1 . 1 1 42 42 TYR HA H 1 1 0.78 . . 0.50 . . 1 42 Tyr N 1 42 Tyr HA . 16580 8 30 2JN_HA . 1 1 43 43 ASN N N 15 1 . 1 1 43 43 ASN HA H 1 1 -0.60 . . 0.50 . . 1 43 Asn N 1 43 Asn HA . 16580 8 31 2JN_HA . 1 1 46 46 GLU N N 15 1 . 1 1 46 46 GLU HA H 1 1 0.44 . . 0.50 . . 1 46 Glu N 1 46 Glu HA . 16580 8 32 2JN_HA . 1 1 48 48 PHE N N 15 1 . 1 1 48 48 PHE HA H 1 1 -0.39 . . 0.50 . . 1 48 Phe N 1 48 Phe HA . 16580 8 33 2JN_HA . 1 1 49 49 ASP N N 15 1 . 1 1 49 49 ASP HA H 1 1 0.94 . . 0.50 . . 1 49 Asp N 1 49 Asp HA . 16580 8 34 2JN_HA . 1 1 50 50 PHE N N 15 1 . 1 1 50 50 PHE HA H 1 1 0.17 . . 0.50 . . 1 50 Phe N 1 50 Phe HA . 16580 8 35 2JN_HA . 1 1 51 51 SER N N 15 1 . 1 1 51 51 SER HA H 1 1 0.76 . . 0.50 . . 1 51 Ser N 1 51 Ser HA . 16580 8 36 2JN_HA . 1 1 52 52 VAL N N 15 1 . 1 1 52 52 VAL HA H 1 1 0.46 . . 0.50 . . 1 52 Val N 1 52 Val HA . 16580 8 37 2JN_HA . 1 1 53 53 SER N N 15 1 . 1 1 53 53 SER HA H 1 1 -0.31 . . 0.50 . . 1 53 Ser N 1 53 Ser HA . 16580 8 38 2JN_HA . 1 1 54 54 SER N N 15 1 . 1 1 54 54 SER HA H 1 1 0.71 . . 0.50 . . 1 54 Ser N 1 54 Ser HA . 16580 8 39 2JN_HA . 1 1 56 56 TYR N N 15 1 . 1 1 56 56 TYR HA H 1 1 0.35 . . 0.50 . . 1 56 Tyr N 1 56 Tyr HA . 16580 8 40 2JN_HA . 1 1 57 57 TYR N N 15 1 . 1 1 57 57 TYR HA H 1 1 -0.38 . . 0.50 . . 1 57 Tyr N 1 57 Tyr HA . 16580 8 41 2JN_HA . 1 1 58 58 GLU N N 15 1 . 1 1 58 58 GLU HA H 1 1 0.60 . . 0.50 . . 1 58 Glu N 1 58 Glu HA . 16580 8 42 2JN_HA . 1 1 59 59 TRP N N 15 1 . 1 1 59 59 TRP HA H 1 1 0.60 . . 0.50 . . 1 59 Trp N 1 59 Trp HA . 16580 8 43 2JN_HA . 1 1 61 61 ILE N N 15 1 . 1 1 61 61 ILE HA H 1 1 0.97 . . 0.50 . . 1 61 Ile N 1 61 Ile HA . 16580 8 44 2JN_HA . 1 1 62 62 LEU N N 15 1 . 1 1 62 62 LEU HA H 1 1 0.21 . . 0.50 . . 1 62 Leu N 1 62 Leu HA . 16580 8 45 2JN_HA . 1 1 63 63 SER N N 15 1 . 1 1 63 63 SER HA H 1 1 -0.79 . . 0.50 . . 1 63 Ser N 1 63 Ser HA . 16580 8 46 2JN_HA . 1 1 64 64 SER N N 15 1 . 1 1 64 64 SER HA H 1 1 0.32 . . 0.50 . . 1 64 Ser N 1 64 Ser HA . 16580 8 47 2JN_HA . 1 1 66 66 ASP N N 15 1 . 1 1 66 66 ASP HA H 1 1 0.37 . . 0.50 . . 1 66 Asp N 1 66 Asp HA . 16580 8 48 2JN_HA . 1 1 67 67 VAL N N 15 1 . 1 1 67 67 VAL HA H 1 1 0.83 . . 0.50 . . 1 67 Val N 1 67 Val HA . 16580 8 49 2JN_HA . 1 1 68 68 TYR N N 15 1 . 1 1 68 68 TYR HA H 1 1 0.83 . . 0.50 . . 1 68 Tyr N 1 68 Tyr HA . 16580 8 50 2JN_HA . 1 1 69 69 SER N N 15 1 . 1 1 69 69 SER HA H 1 1 0.84 . . 0.50 . . 1 69 Ser N 1 69 Ser HA . 16580 8 51 2JN_HA . 1 1 75 75 ALA N N 15 1 . 1 1 75 75 ALA HA H 1 1 0.19 . . 0.50 . . 1 75 Ala N 1 75 Ala HA . 16580 8 52 2JN_HA . 1 1 76 76 ASP N N 15 1 . 1 1 76 76 ASP HA H 1 1 0.61 . . 0.50 . . 1 76 Asp N 1 76 Asp HA . 16580 8 53 2JN_HA . 1 1 77 77 ARG N N 15 1 . 1 1 77 77 ARG HA H 1 1 0.10 . . 0.50 . . 1 77 Arg N 1 77 Arg HA . 16580 8 54 2JN_HA . 1 1 78 78 VAL N N 15 1 . 1 1 78 78 VAL HA H 1 1 0.36 . . 0.50 . . 1 78 Val N 1 78 Val HA . 16580 8 55 2JN_HA . 1 1 79 79 VAL N N 15 1 . 1 1 79 79 VAL HA H 1 1 1.17 . . 0.50 . . 1 79 Val N 1 79 Val HA . 16580 8 56 2JN_HA . 1 1 80 80 PHE N N 15 1 . 1 1 80 80 PHE HA H 1 1 0.10 . . 0.50 . . 1 80 Phe N 1 80 Phe HA . 16580 8 57 2JN_HA . 1 1 81 81 ASN N N 15 1 . 1 1 81 81 ASN HA H 1 1 0.40 . . 0.50 . . 1 81 Asn N 1 81 Asn HA . 16580 8 58 2JN_HA . 1 1 82 82 GLU N N 15 1 . 1 1 82 82 GLU HA H 1 1 0.70 . . 0.50 . . 1 82 Glu N 1 82 Glu HA . 16580 8 59 2JN_HA . 1 1 83 83 ASN N N 15 1 . 1 1 83 83 ASN HA H 1 1 0.72 . . 0.50 . . 1 83 Asn N 1 83 Asn HA . 16580 8 60 2JN_HA . 1 1 84 84 ASN N N 15 1 . 1 1 84 84 ASN HA H 1 1 1.16 . . 0.50 . . 1 84 Asn N 1 84 Asn HA . 16580 8 61 2JN_HA . 1 1 85 85 GLN N N 15 1 . 1 1 85 85 GLN HA H 1 1 0.57 . . 0.50 . . 1 85 Gln N 1 85 Gln HA . 16580 8 62 2JN_HA . 1 1 86 86 LEU N N 15 1 . 1 1 86 86 LEU HA H 1 1 0.45 . . 0.50 . . 1 86 Leu N 1 86 Leu HA . 16580 8 63 2JN_HA . 1 1 87 87 ALA N N 15 1 . 1 1 87 87 ALA HA H 1 1 0.67 . . 0.50 . . 1 87 Ala N 1 87 Ala HA . 16580 8 64 2JN_HA . 1 1 89 89 VAL N N 15 1 . 1 1 89 89 VAL HA H 1 1 0.39 . . 0.50 . . 1 89 Val N 1 89 Val HA . 16580 8 65 2JN_HA . 1 1 90 90 ILE N N 15 1 . 1 1 90 90 ILE HA H 1 1 0.54 . . 0.50 . . 1 90 Ile N 1 90 Ile HA . 16580 8 66 2JN_HA . 1 1 91 91 THR N N 15 1 . 1 1 91 91 THR HA H 1 1 0.82 . . 0.50 . . 1 91 Thr N 1 91 Thr HA . 16580 8 67 2JN_HA . 1 1 92 92 HIS N N 15 1 . 1 1 92 92 HIS HA H 1 1 0.04 . . 0.50 . . 1 92 His N 1 92 His HA . 16580 8 68 2JN_HA . 1 1 93 93 THR N N 15 1 . 1 1 93 93 THR HA H 1 1 0.75 . . 0.50 . . 1 93 Thr N 1 93 Thr HA . 16580 8 69 2JN_HA . 1 1 95 95 ALA N N 15 1 . 1 1 95 95 ALA HA H 1 1 0.62 . . 0.50 . . 1 95 Ala N 1 95 Ala HA . 16580 8 70 2JN_HA . 1 1 99 99 ASN N N 15 1 . 1 1 99 99 ASN HA H 1 1 0.76 . . 0.50 . . 1 99 Asn N 1 99 Asn HA . 16580 8 71 2JN_HA . 1 1 100 100 PHE N N 15 1 . 1 1 100 100 PHE HA H 1 1 -0.16 . . 0.50 . . 1 100 Phe N 1 100 Phe HA . 16580 8 72 2JN_HA . 1 1 101 101 VAL N N 15 1 . 1 1 101 101 VAL HA H 1 1 0.59 . . 0.50 . . 1 101 Val N 1 101 Val HA . 16580 8 73 2JN_HA . 1 1 102 102 GLU N N 15 1 . 1 1 102 102 GLU HA H 1 1 0.38 . . 0.50 . . 1 102 Glu N 1 102 Glu HA . 16580 8 74 2JN_HA . 1 1 104 104 THR N N 15 1 . 1 1 104 104 THR HA H 1 1 1.21 . . 0.50 . . 1 104 Thr N 1 104 Thr HA . 16580 8 stop_ save_ save_2JN_CB _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JN_CB _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 9 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 800 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 5 '3D Cb-coupled [15N,1H]-TROSY-HNCA' . . . 16580 9 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JN_CB . 1 1 3 3 ASP N N 15 1 . 1 1 3 3 ASP CB C 13 1 -0.96 . . 0.50 . . 1 3 Asp N 1 3 Asp Cb . 16580 9 2 2JN_CB . 1 1 4 4 TYR N N 15 1 . 1 1 4 4 TYR CB C 13 1 -0.33 . . 0.50 . . 1 4 Tyr N 1 4 Tyr Cb . 16580 9 3 2JN_CB . 1 1 6 6 CYS N N 15 1 . 1 1 6 6 CYS CB C 13 1 -0.93 . . 0.50 . . 1 6 Cys N 1 6 Cys Cb . 16580 9 4 2JN_CB . 1 1 9 9 ASN N N 15 1 . 1 1 9 9 ASN CB C 13 1 -0.76 . . 0.50 . . 1 9 Asn N 1 9 Asn Cb . 16580 9 5 2JN_CB . 1 1 10 10 CYS N N 15 1 . 1 1 10 10 CYS CB C 13 1 -1.28 . . 0.50 . . 1 10 Cys N 1 10 Cys Cb . 16580 9 6 2JN_CB . 1 1 11 11 TYR N N 15 1 . 1 1 11 11 TYR CB C 13 1 -0.52 . . 0.50 . . 1 11 Tyr N 1 11 Tyr Cb . 16580 9 7 2JN_CB . 1 1 15 15 ASP N N 15 1 . 1 1 15 15 ASP CB C 13 1 -0.89 . . 0.50 . . 1 15 Asp N 1 15 Asp Cb . 16580 9 8 2JN_CB . 1 1 16 16 VAL N N 15 1 . 1 1 16 16 VAL CB C 13 1 -0.89 . . 0.50 . . 1 16 Val N 1 16 Val Cb . 16580 9 9 2JN_CB . 1 1 19 19 ALA N N 15 1 . 1 1 19 19 ALA CB C 13 1 -1.08 . . 0.50 . . 1 19 Ala N 1 19 Ala Cb . 16580 9 10 2JN_CB . 1 1 20 20 GLN N N 15 1 . 1 1 20 20 GLN CB C 13 1 -1.22 . . 0.50 . . 1 20 Gln N 1 20 Gln Cb . 16580 9 11 2JN_CB . 1 1 21 21 ALA N N 15 1 . 1 1 21 21 ALA CB C 13 1 -0.71 . . 0.50 . . 1 21 Ala N 1 21 Ala Cb . 16580 9 12 2JN_CB . 1 1 22 22 ALA N N 15 1 . 1 1 22 22 ALA CB C 13 1 -0.57 . . 0.50 . . 1 22 Ala N 1 22 Ala Cb . 16580 9 13 2JN_CB . 1 1 24 24 TYR N N 15 1 . 1 1 24 24 TYR CB C 13 1 -0.84 . . 0.50 . . 1 24 Tyr N 1 24 Tyr Cb . 16580 9 14 2JN_CB . 1 1 25 25 LYS N N 15 1 . 1 1 25 25 LYS CB C 13 1 -0.82 . . 0.50 . . 1 25 Lys N 1 25 Lys Cb . 16580 9 15 2JN_CB . 1 1 27 27 HIS N N 15 1 . 1 1 27 27 HIS CB C 13 1 -1.38 . . 0.50 . . 1 27 His N 1 27 His Cb . 16580 9 16 2JN_CB . 1 1 28 28 GLU N N 15 1 . 1 1 28 28 GLU CB C 13 1 -0.72 . . 0.50 . . 1 28 Glu N 1 28 Glu Cb . 16580 9 17 2JN_CB . 1 1 29 29 ASP N N 15 1 . 1 1 29 29 ASP CB C 13 1 -0.77 . . 0.50 . . 1 29 Asp N 1 29 Asp Cb . 16580 9 18 2JN_CB . 1 1 31 31 GLU N N 15 1 . 1 1 31 31 GLU CB C 13 1 -0.43 . . 0.50 . . 1 31 Glu N 1 31 Glu Cb . 16580 9 19 2JN_CB . 1 1 33 33 VAL N N 15 1 . 1 1 33 33 VAL CB C 13 1 -0.41 . . 0.50 . . 1 33 Val N 1 33 Val Cb . 16580 9 20 2JN_CB . 1 1 36 36 ASN N N 15 1 . 1 1 36 36 ASN CB C 13 1 0.22 . . 0.50 . . 1 36 Asn N 1 36 Asn Cb . 16580 9 21 2JN_CB . 1 1 38 38 TYR N N 15 1 . 1 1 38 38 TYR CB C 13 1 -0.86 . . 0.50 . . 1 38 Tyr N 1 38 Tyr Cb . 16580 9 22 2JN_CB . 1 1 40 40 HIS N N 15 1 . 1 1 40 40 HIS CB C 13 1 -0.90 . . 0.50 . . 1 40 His N 1 40 His Cb . 16580 9 23 2JN_CB . 1 1 41 41 LYS N N 15 1 . 1 1 41 41 LYS CB C 13 1 -1.31 . . 0.50 . . 1 41 Lys N 1 41 Lys Cb . 16580 9 24 2JN_CB . 1 1 42 42 TYR N N 15 1 . 1 1 42 42 TYR CB C 13 1 -1.09 . . 0.50 . . 1 42 Tyr N 1 42 Tyr Cb . 16580 9 25 2JN_CB . 1 1 43 43 ASN N N 15 1 . 1 1 43 43 ASN CB C 13 1 -0.61 . . 0.50 . . 1 43 Asn N 1 43 Asn Cb . 16580 9 26 2JN_CB . 1 1 44 44 ASN N N 15 1 . 1 1 44 44 ASN CB C 13 1 -0.13 . . 0.50 . . 1 44 Asn N 1 44 Asn Cb . 16580 9 27 2JN_CB . 1 1 45 45 TYR N N 15 1 . 1 1 45 45 TYR CB C 13 1 -1.03 . . 0.50 . . 1 45 Tyr N 1 45 Tyr Cb . 16580 9 28 2JN_CB . 1 1 48 48 PHE N N 15 1 . 1 1 48 48 PHE CB C 13 1 -0.45 . . 0.50 . . 1 48 Phe N 1 48 Phe Cb . 16580 9 29 2JN_CB . 1 1 49 49 ASP N N 15 1 . 1 1 49 49 ASP CB C 13 1 -1.00 . . 0.50 . . 1 49 Asp N 1 49 Asp Cb . 16580 9 30 2JN_CB . 1 1 50 50 PHE N N 15 1 . 1 1 50 50 PHE CB C 13 1 -0.71 . . 0.50 . . 1 50 Phe N 1 50 Phe Cb . 16580 9 31 2JN_CB . 1 1 52 52 VAL N N 15 1 . 1 1 52 52 VAL CB C 13 1 -0.57 . . 0.50 . . 1 52 Val N 1 52 Val Cb . 16580 9 32 2JN_CB . 1 1 56 56 TYR N N 15 1 . 1 1 56 56 TYR CB C 13 1 -0.55 . . 0.50 . . 1 56 Tyr N 1 56 Tyr Cb . 16580 9 33 2JN_CB . 1 1 57 57 TYR N N 15 1 . 1 1 57 57 TYR CB C 13 1 -0.56 . . 0.50 . . 1 57 Tyr N 1 57 Tyr Cb . 16580 9 34 2JN_CB . 1 1 58 58 GLU N N 15 1 . 1 1 58 58 GLU CB C 13 1 -0.84 . . 0.50 . . 1 58 Glu N 1 58 Glu Cb . 16580 9 35 2JN_CB . 1 1 59 59 TRP N N 15 1 . 1 1 59 59 TRP CB C 13 1 -0.41 . . 0.50 . . 1 59 Trp N 1 59 Trp Cb . 16580 9 36 2JN_CB . 1 1 61 61 ILE N N 15 1 . 1 1 61 61 ILE CB C 13 1 -0.88 . . 0.50 . . 1 61 Ile N 1 61 Ile Cb . 16580 9 37 2JN_CB . 1 1 62 62 LEU N N 15 1 . 1 1 62 62 LEU CB C 13 1 -0.53 . . 0.50 . . 1 62 Leu N 1 62 Leu Cb . 16580 9 38 2JN_CB . 1 1 66 66 ASP N N 15 1 . 1 1 66 66 ASP CB C 13 1 -0.53 . . 0.50 . . 1 66 Asp N 1 66 Asp Cb . 16580 9 39 2JN_CB . 1 1 67 67 VAL N N 15 1 . 1 1 67 67 VAL CB C 13 1 -0.93 . . 0.50 . . 1 67 Val N 1 67 Val Cb . 16580 9 40 2JN_CB . 1 1 68 68 TYR N N 15 1 . 1 1 68 68 TYR CB C 13 1 -0.91 . . 0.50 . . 1 68 Tyr N 1 68 Tyr Cb . 16580 9 41 2JN_CB . 1 1 75 75 ALA N N 15 1 . 1 1 75 75 ALA CB C 13 1 0.29 . . 0.50 . . 1 75 Ala N 1 75 Ala Cb . 16580 9 42 2JN_CB . 1 1 76 76 ASP N N 15 1 . 1 1 76 76 ASP CB C 13 1 -0.69 . . 0.50 . . 1 76 Asp N 1 76 Asp Cb . 16580 9 43 2JN_CB . 1 1 77 77 ARG N N 15 1 . 1 1 77 77 ARG CB C 13 1 -0.23 . . 0.50 . . 1 77 Arg N 1 77 Arg Cb . 16580 9 44 2JN_CB . 1 1 78 78 VAL N N 15 1 . 1 1 78 78 VAL CB C 13 1 -1.16 . . 0.50 . . 1 78 Val N 1 78 Val Cb . 16580 9 45 2JN_CB . 1 1 79 79 VAL N N 15 1 . 1 1 79 79 VAL CB C 13 1 -0.41 . . 0.50 . . 1 79 Val N 1 79 Val Cb . 16580 9 46 2JN_CB . 1 1 80 80 PHE N N 15 1 . 1 1 80 80 PHE CB C 13 1 -0.50 . . 0.50 . . 1 80 Phe N 1 80 Phe Cb . 16580 9 47 2JN_CB . 1 1 81 81 ASN N N 15 1 . 1 1 81 81 ASN CB C 13 1 -0.27 . . 0.50 . . 1 81 Asn N 1 81 Asn Cb . 16580 9 48 2JN_CB . 1 1 82 82 GLU N N 15 1 . 1 1 82 82 GLU CB C 13 1 -1.11 . . 0.50 . . 1 82 Glu N 1 82 Glu Cb . 16580 9 49 2JN_CB . 1 1 83 83 ASN N N 15 1 . 1 1 83 83 ASN CB C 13 1 -0.97 . . 0.50 . . 1 83 Asn N 1 83 Asn Cb . 16580 9 50 2JN_CB . 1 1 84 84 ASN N N 15 1 . 1 1 84 84 ASN CB C 13 1 -0.32 . . 0.50 . . 1 84 Asn N 1 84 Asn Cb . 16580 9 51 2JN_CB . 1 1 85 85 GLN N N 15 1 . 1 1 85 85 GLN CB C 13 1 -0.63 . . 0.50 . . 1 85 Gln N 1 85 Gln Cb . 16580 9 52 2JN_CB . 1 1 86 86 LEU N N 15 1 . 1 1 86 86 LEU CB C 13 1 -1.02 . . 0.50 . . 1 86 Leu N 1 86 Leu Cb . 16580 9 53 2JN_CB . 1 1 87 87 ALA N N 15 1 . 1 1 87 87 ALA CB C 13 1 -0.68 . . 0.50 . . 1 87 Ala N 1 87 Ala Cb . 16580 9 54 2JN_CB . 1 1 89 89 VAL N N 15 1 . 1 1 89 89 VAL CB C 13 1 -0.14 . . 0.50 . . 1 89 Val N 1 89 Val Cb . 16580 9 55 2JN_CB . 1 1 90 90 ILE N N 15 1 . 1 1 90 90 ILE CB C 13 1 -0.41 . . 0.50 . . 1 90 Ile N 1 90 Ile Cb . 16580 9 56 2JN_CB . 1 1 92 92 HIS N N 15 1 . 1 1 92 92 HIS CB C 13 1 -0.83 . . 0.50 . . 1 92 His N 1 92 His Cb . 16580 9 57 2JN_CB . 1 1 95 95 ALA N N 15 1 . 1 1 95 95 ALA CB C 13 1 -0.54 . . 0.50 . . 1 95 Ala N 1 95 Ala Cb . 16580 9 58 2JN_CB . 1 1 98 98 ASN N N 15 1 . 1 1 98 98 ASN CB C 13 1 -1.31 . . 0.50 . . 1 98 Asn N 1 98 Asn Cb . 16580 9 59 2JN_CB . 1 1 99 99 ASN N N 15 1 . 1 1 99 99 ASN CB C 13 1 -0.73 . . 0.50 . . 1 99 Asn N 1 99 Asn Cb . 16580 9 60 2JN_CB . 1 1 100 100 PHE N N 15 1 . 1 1 100 100 PHE CB C 13 1 -0.47 . . 0.50 . . 1 100 Phe N 1 100 Phe Cb . 16580 9 61 2JN_CB . 1 1 101 101 VAL N N 15 1 . 1 1 101 101 VAL CB C 13 1 -0.71 . . 0.50 . . 1 101 Val N 1 101 Val Cb . 16580 9 62 2JN_CB . 1 1 102 102 GLU N N 15 1 . 1 1 102 102 GLU CB C 13 1 -0.77 . . 0.50 . . 1 102 Glu N 1 102 Glu Cb . 16580 9 63 2JN_CB . 1 1 103 103 CYS N N 15 1 . 1 1 103 103 CYS CB C 13 1 -0.37 . . 0.50 . . 1 103 Cys N 1 103 Cys Cb . 16580 9 stop_ save_ save_2JN_CO _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 2JN_CO _Coupling_constant_list.Entry_ID 16580 _Coupling_constant_list.ID 10 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 600 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 10 '3D CO-coupled ct-[15N,1H]-TROSY-HNCA' . . . 16580 10 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 2JN_CO . 1 1 3 3 ASP N N 15 1 . 1 1 3 3 ASP C C 13 1 -0.06 . . 0.50 . . 1 3 Asp N 1 3 Asp C . 16580 10 2 2JN_CO . 1 1 4 4 TYR N N 15 1 . 1 1 4 4 TYR C C 13 1 -0.38 . . 0.50 . . 1 4 Tyr N 1 4 Tyr C . 16580 10 3 2JN_CO . 1 1 5 5 THR N N 15 1 . 1 1 5 5 THR C C 13 1 -0.14 . . 0.50 . . 1 5 Thr N 1 5 Thr C . 16580 10 4 2JN_CO . 1 1 6 6 CYS N N 15 1 . 1 1 6 6 CYS C C 13 1 0.03 . . 0.50 . . 1 6 Cys N 1 6 Cys C . 16580 10 5 2JN_CO . 1 1 7 7 GLY N N 15 1 . 1 1 7 7 GLY C C 13 1 0.76 . . 0.50 . . 1 7 Gly N 1 7 Gly C . 16580 10 6 2JN_CO . 1 1 8 8 SER N N 15 1 . 1 1 8 8 SER C C 13 1 -0.55 . . 0.50 . . 1 8 Ser N 1 8 Ser C . 16580 10 7 2JN_CO . 1 1 9 9 ASN N N 15 1 . 1 1 9 9 ASN C C 13 1 0.16 . . 0.50 . . 1 9 Asn N 1 9 Asn C . 16580 10 8 2JN_CO . 1 1 10 10 CYS N N 15 1 . 1 1 10 10 CYS C C 13 1 -0.15 . . 0.50 . . 1 10 Cys N 1 10 Cys C . 16580 10 9 2JN_CO . 1 1 11 11 TYR N N 15 1 . 1 1 11 11 TYR C C 13 1 -0.17 . . 0.50 . . 1 11 Tyr N 1 11 Tyr C . 16580 10 10 2JN_CO . 1 1 12 12 SER N N 15 1 . 1 1 12 12 SER C C 13 1 -0.16 . . 0.50 . . 1 12 Ser N 1 12 Ser C . 16580 10 11 2JN_CO . 1 1 14 14 SER N N 15 1 . 1 1 14 14 SER C C 13 1 -0.30 . . 0.50 . . 1 14 Ser N 1 14 Ser C . 16580 10 12 2JN_CO . 1 1 15 15 ASP N N 15 1 . 1 1 15 15 ASP C C 13 1 0.19 . . 0.50 . . 1 15 Asp N 1 15 Asp C . 16580 10 13 2JN_CO . 1 1 16 16 VAL N N 15 1 . 1 1 16 16 VAL C C 13 1 -0.05 . . 0.50 . . 1 16 Val N 1 16 Val C . 16580 10 14 2JN_CO . 1 1 17 17 SER N N 15 1 . 1 1 17 17 SER C C 13 1 0.19 . . 0.50 . . 1 17 Ser N 1 17 Ser C . 16580 10 15 2JN_CO . 1 1 18 18 THR N N 15 1 . 1 1 18 18 THR C C 13 1 -0.10 . . 0.50 . . 1 18 Thr N 1 18 Thr C . 16580 10 16 2JN_CO . 1 1 19 19 ALA N N 15 1 . 1 1 19 19 ALA C C 13 1 0.10 . . 0.50 . . 1 19 Ala N 1 19 Ala C . 16580 10 17 2JN_CO . 1 1 20 20 GLN N N 15 1 . 1 1 20 20 GLN C C 13 1 0.07 . . 0.50 . . 1 20 Gln N 1 20 Gln C . 16580 10 18 2JN_CO . 1 1 21 21 ALA N N 15 1 . 1 1 21 21 ALA C C 13 1 -0.04 . . 0.50 . . 1 21 Ala N 1 21 Ala C . 16580 10 19 2JN_CO . 1 1 22 22 ALA N N 15 1 . 1 1 22 22 ALA C C 13 1 0.11 . . 0.50 . . 1 22 Ala N 1 22 Ala C . 16580 10 20 2JN_CO . 1 1 23 23 GLY N N 15 1 . 1 1 23 23 GLY C C 13 1 0.42 . . 0.50 . . 1 23 Gly N 1 23 Gly C . 16580 10 21 2JN_CO . 1 1 24 24 TYR N N 15 1 . 1 1 24 24 TYR C C 13 1 -0.26 . . 0.50 . . 1 24 Tyr N 1 24 Tyr C . 16580 10 22 2JN_CO . 1 1 25 25 LYS N N 15 1 . 1 1 25 25 LYS C C 13 1 0.04 . . 0.50 . . 1 25 Lys N 1 25 Lys C . 16580 10 23 2JN_CO . 1 1 26 26 LEU N N 15 1 . 1 1 26 26 LEU C C 13 1 0.06 . . 0.50 . . 1 26 Leu N 1 26 Leu C . 16580 10 24 2JN_CO . 1 1 27 27 HIS N N 15 1 . 1 1 27 27 HIS C C 13 1 0.12 . . 0.50 . . 1 27 His N 1 27 His C . 16580 10 25 2JN_CO . 1 1 28 28 GLU N N 15 1 . 1 1 28 28 GLU C C 13 1 0.01 . . 0.50 . . 1 28 Glu N 1 28 Glu C . 16580 10 26 2JN_CO . 1 1 29 29 ASP N N 15 1 . 1 1 29 29 ASP C C 13 1 -0.50 . . 0.50 . . 1 29 Asp N 1 29 Asp C . 16580 10 27 2JN_CO . 1 1 30 30 GLY N N 15 1 . 1 1 30 30 GLY C C 13 1 0.31 . . 0.50 . . 1 30 Gly N 1 30 Gly C . 16580 10 28 2JN_CO . 1 1 31 31 GLU N N 15 1 . 1 1 31 31 GLU C C 13 1 -0.20 . . 0.50 . . 1 31 Glu N 1 31 Glu C . 16580 10 29 2JN_CO . 1 1 32 32 THR N N 15 1 . 1 1 32 32 THR C C 13 1 -0.47 . . 0.50 . . 1 32 Thr N 1 32 Thr C . 16580 10 30 2JN_CO . 1 1 33 33 VAL N N 15 1 . 1 1 33 33 VAL C C 13 1 -0.60 . . 0.50 . . 1 33 Val N 1 33 Val C . 16580 10 31 2JN_CO . 1 1 34 34 GLY N N 15 1 . 1 1 34 34 GLY C C 13 1 0.24 . . 0.50 . . 1 34 Gly N 1 34 Gly C . 16580 10 32 2JN_CO . 1 1 37 37 SER N N 15 1 . 1 1 37 37 SER C C 13 1 0.18 . . 0.50 . . 1 37 Ser N 1 37 Ser C . 16580 10 33 2JN_CO . 1 1 38 38 TYR N N 15 1 . 1 1 38 38 TYR C C 13 1 0.19 . . 0.50 . . 1 38 Tyr N 1 38 Tyr C . 16580 10 34 2JN_CO . 1 1 40 40 HIS N N 15 1 . 1 1 40 40 HIS C C 13 1 -0.13 . . 0.50 . . 1 40 His N 1 40 His C . 16580 10 35 2JN_CO . 1 1 42 42 TYR N N 15 1 . 1 1 42 42 TYR C C 13 1 -0.04 . . 0.50 . . 1 42 Tyr N 1 42 Tyr C . 16580 10 36 2JN_CO . 1 1 43 43 ASN N N 15 1 . 1 1 43 43 ASN C C 13 1 0.03 . . 0.50 . . 1 43 Asn N 1 43 Asn C . 16580 10 37 2JN_CO . 1 1 45 45 TYR N N 15 1 . 1 1 45 45 TYR C C 13 1 0.07 . . 0.50 . . 1 45 Tyr N 1 45 Tyr C . 16580 10 38 2JN_CO . 1 1 46 46 GLU N N 15 1 . 1 1 46 46 GLU C C 13 1 -0.10 . . 0.50 . . 1 46 Glu N 1 46 Glu C . 16580 10 39 2JN_CO . 1 1 47 47 GLY N N 15 1 . 1 1 47 47 GLY C C 13 1 0.19 . . 0.50 . . 1 47 Gly N 1 47 Gly C . 16580 10 40 2JN_CO . 1 1 48 48 PHE N N 15 1 . 1 1 48 48 PHE C C 13 1 0.46 . . 0.50 . . 1 48 Phe N 1 48 Phe C . 16580 10 41 2JN_CO . 1 1 49 49 ASP N N 15 1 . 1 1 49 49 ASP C C 13 1 0.23 . . 0.50 . . 1 49 Asp N 1 49 Asp C . 16580 10 42 2JN_CO . 1 1 50 50 PHE N N 15 1 . 1 1 50 50 PHE C C 13 1 0.11 . . 0.50 . . 1 50 Phe N 1 50 Phe C . 16580 10 43 2JN_CO . 1 1 51 51 SER N N 15 1 . 1 1 51 51 SER C C 13 1 -0.40 . . 0.50 . . 1 51 Ser N 1 51 Ser C . 16580 10 44 2JN_CO . 1 1 52 52 VAL N N 15 1 . 1 1 52 52 VAL C C 13 1 -0.06 . . 0.50 . . 1 52 Val N 1 52 Val C . 16580 10 45 2JN_CO . 1 1 53 53 SER N N 15 1 . 1 1 53 53 SER C C 13 1 -0.18 . . 0.50 . . 1 53 Ser N 1 53 Ser C . 16580 10 46 2JN_CO . 1 1 54 54 SER N N 15 1 . 1 1 54 54 SER C C 13 1 0.18 . . 0.50 . . 1 54 Ser N 1 54 Ser C . 16580 10 47 2JN_CO . 1 1 56 56 TYR N N 15 1 . 1 1 56 56 TYR C C 13 1 -0.04 . . 0.50 . . 1 56 Tyr N 1 56 Tyr C . 16580 10 48 2JN_CO . 1 1 57 57 TYR N N 15 1 . 1 1 57 57 TYR C C 13 1 -0.48 . . 0.50 . . 1 57 Tyr N 1 57 Tyr C . 16580 10 49 2JN_CO . 1 1 58 58 GLU N N 15 1 . 1 1 58 58 GLU C C 13 1 -0.12 . . 0.50 . . 1 58 Glu N 1 58 Glu C . 16580 10 50 2JN_CO . 1 1 59 59 TRP N N 15 1 . 1 1 59 59 TRP C C 13 1 -1.04 . . 0.50 . . 1 59 Trp N 1 59 Trp C . 16580 10 51 2JN_CO . 1 1 61 61 ILE N N 15 1 . 1 1 61 61 ILE C C 13 1 0.14 . . 0.50 . . 1 61 Ile N 1 61 Ile C . 16580 10 52 2JN_CO . 1 1 62 62 LEU N N 15 1 . 1 1 62 62 LEU C C 13 1 -0.18 . . 0.50 . . 1 62 Leu N 1 62 Leu C . 16580 10 53 2JN_CO . 1 1 63 63 SER N N 15 1 . 1 1 63 63 SER C C 13 1 -0.23 . . 0.50 . . 1 63 Ser N 1 63 Ser C . 16580 10 54 2JN_CO . 1 1 64 64 SER N N 15 1 . 1 1 64 64 SER C C 13 1 -0.48 . . 0.50 . . 1 64 Ser N 1 64 Ser C . 16580 10 55 2JN_CO . 1 1 65 65 GLY N N 15 1 . 1 1 65 65 GLY C C 13 1 -0.09 . . 0.50 . . 1 65 Gly N 1 65 Gly C . 16580 10 56 2JN_CO . 1 1 66 66 ASP N N 15 1 . 1 1 66 66 ASP C C 13 1 0.31 . . 0.50 . . 1 66 Asp N 1 66 Asp C . 16580 10 57 2JN_CO . 1 1 67 67 VAL N N 15 1 . 1 1 67 67 VAL C C 13 1 0.17 . . 0.50 . . 1 67 Val N 1 67 Val C . 16580 10 58 2JN_CO . 1 1 68 68 TYR N N 15 1 . 1 1 68 68 TYR C C 13 1 0.17 . . 0.50 . . 1 68 Tyr N 1 68 Tyr C . 16580 10 59 2JN_CO . 1 1 69 69 SER N N 15 1 . 1 1 69 69 SER C C 13 1 -1.49 . . 0.50 . . 1 69 Ser N 1 69 Ser C . 16580 10 60 2JN_CO . 1 1 74 74 GLY N N 15 1 . 1 1 74 74 GLY C C 13 1 0.58 . . 0.50 . . 1 74 Gly N 1 74 Gly C . 16580 10 61 2JN_CO . 1 1 75 75 ALA N N 15 1 . 1 1 75 75 ALA C C 13 1 -1.54 . . 0.50 . . 1 75 Ala N 1 75 Ala C . 16580 10 62 2JN_CO . 1 1 76 76 ASP N N 15 1 . 1 1 76 76 ASP C C 13 1 -0.39 . . 0.50 . . 1 76 Asp N 1 76 Asp C . 16580 10 63 2JN_CO . 1 1 77 77 ARG N N 15 1 . 1 1 77 77 ARG C C 13 1 -0.65 . . 0.50 . . 1 77 Arg N 1 77 Arg C . 16580 10 64 2JN_CO . 1 1 78 78 VAL N N 15 1 . 1 1 78 78 VAL C C 13 1 0.47 . . 0.50 . . 1 78 Val N 1 78 Val C . 16580 10 65 2JN_CO . 1 1 79 79 VAL N N 15 1 . 1 1 79 79 VAL C C 13 1 -0.09 . . 0.50 . . 1 79 Val N 1 79 Val C . 16580 10 66 2JN_CO . 1 1 80 80 PHE N N 15 1 . 1 1 80 80 PHE C C 13 1 -0.25 . . 0.50 . . 1 80 Phe N 1 80 Phe C . 16580 10 67 2JN_CO . 1 1 81 81 ASN N N 15 1 . 1 1 81 81 ASN C C 13 1 -0.72 . . 0.50 . . 1 81 Asn N 1 81 Asn C . 16580 10 68 2JN_CO . 1 1 82 82 GLU N N 15 1 . 1 1 82 82 GLU C C 13 1 -1.03 . . 0.50 . . 1 82 Glu N 1 82 Glu C . 16580 10 69 2JN_CO . 1 1 83 83 ASN N N 15 1 . 1 1 83 83 ASN C C 13 1 -0.15 . . 0.50 . . 1 83 Asn N 1 83 Asn C . 16580 10 70 2JN_CO . 1 1 84 84 ASN N N 15 1 . 1 1 84 84 ASN C C 13 1 0.30 . . 0.50 . . 1 84 Asn N 1 84 Asn C . 16580 10 71 2JN_CO . 1 1 85 85 GLN N N 15 1 . 1 1 85 85 GLN C C 13 1 0.07 . . 0.50 . . 1 85 Gln N 1 85 Gln C . 16580 10 72 2JN_CO . 1 1 86 86 LEU N N 15 1 . 1 1 86 86 LEU C C 13 1 0.27 . . 0.50 . . 1 86 Leu N 1 86 Leu C . 16580 10 73 2JN_CO . 1 1 87 87 ALA N N 15 1 . 1 1 87 87 ALA C C 13 1 -0.18 . . 0.50 . . 1 87 Ala N 1 87 Ala C . 16580 10 74 2JN_CO . 1 1 88 88 GLY N N 15 1 . 1 1 88 88 GLY C C 13 1 -0.15 . . 0.50 . . 1 88 Gly N 1 88 Gly C . 16580 10 75 2JN_CO . 1 1 89 89 VAL N N 15 1 . 1 1 89 89 VAL C C 13 1 -0.07 . . 0.50 . . 1 89 Val N 1 89 Val C . 16580 10 76 2JN_CO . 1 1 90 90 ILE N N 15 1 . 1 1 90 90 ILE C C 13 1 -0.39 . . 0.50 . . 1 90 Ile N 1 90 Ile C . 16580 10 77 2JN_CO . 1 1 91 91 THR N N 15 1 . 1 1 91 91 THR C C 13 1 -0.97 . . 0.50 . . 1 91 Thr N 1 91 Thr C . 16580 10 78 2JN_CO . 1 1 92 92 HIS N N 15 1 . 1 1 92 92 HIS C C 13 1 -0.28 . . 0.50 . . 1 92 His N 1 92 His C . 16580 10 79 2JN_CO . 1 1 93 93 THR N N 15 1 . 1 1 93 93 THR C C 13 1 0.53 . . 0.50 . . 1 93 Thr N 1 93 Thr C . 16580 10 80 2JN_CO . 1 1 94 94 GLY N N 15 1 . 1 1 94 94 GLY C C 13 1 0.08 . . 0.50 . . 1 94 Gly N 1 94 Gly C . 16580 10 81 2JN_CO . 1 1 95 95 ALA N N 15 1 . 1 1 95 95 ALA C C 13 1 -0.07 . . 0.50 . . 1 95 Ala N 1 95 Ala C . 16580 10 82 2JN_CO . 1 1 96 96 SER N N 15 1 . 1 1 96 96 SER C C 13 1 -0.45 . . 0.50 . . 1 96 Ser N 1 96 Ser C . 16580 10 83 2JN_CO . 1 1 97 97 GLY N N 15 1 . 1 1 97 97 GLY C C 13 1 0.31 . . 0.50 . . 1 97 Gly N 1 97 Gly C . 16580 10 84 2JN_CO . 1 1 99 99 ASN N N 15 1 . 1 1 99 99 ASN C C 13 1 -0.01 . . 0.50 . . 1 99 Asn N 1 99 Asn C . 16580 10 85 2JN_CO . 1 1 100 100 PHE N N 15 1 . 1 1 100 100 PHE C C 13 1 -0.51 . . 0.50 . . 1 100 Phe N 1 100 Phe C . 16580 10 86 2JN_CO . 1 1 101 101 VAL N N 15 1 . 1 1 101 101 VAL C C 13 1 -0.35 . . 0.50 . . 1 101 Val N 1 101 Val C . 16580 10 87 2JN_CO . 1 1 102 102 GLU N N 15 1 . 1 1 102 102 GLU C C 13 1 0.24 . . 0.50 . . 1 102 Glu N 1 102 Glu C . 16580 10 88 2JN_CO . 1 1 103 103 CYS N N 15 1 . 1 1 103 103 CYS C C 13 1 0.27 . . 0.50 . . 1 103 Cys N 1 103 Cys C . 16580 10 89 2JN_CO . 1 1 104 104 THR N N 15 1 . 1 1 104 104 THR C C 13 1 -0.37 . . 0.50 . . 1 104 Thr N 1 104 Thr C . 16580 10 stop_ save_