data_15909 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15909 _Entry.Title ; 1J coupling constants related to the Ca carbons in DFPase from Loligo vulgaris ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-08-04 _Entry.Accession_date 2008-08-04 _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. . 15909 2 Frank Lohr . . . 15909 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID coupling_constants 4 15909 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'coupling constants' 780 15909 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 . . 2009-01-29 2008-08-04 update author 'complete entry citation' 15909 1 . . 2008-11-19 2008-08-04 original author 'original release' 15909 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 15904 '1J coupling constants related to the Ca carbons in oxidised Flavodxin' 15909 BMRB 15905 '1J coupling constants related to the Ca carbons in Ribonuclease T1' 15909 BMRB 15906 '1J coupling constants related to the Ca carbons in Frataxin C-terminal domain' 15909 BMRB 15907 '1J coupling constants related to the Ca carbons in Ubiquitin' 15909 BMRB 15908 '1J coupling constants related to the Ca carbons in Xylanase' 15909 BMRB 5618 'Backbone 1H, 13C, 15N and Side Chain 13C Chemical Shift Assignments for DFPase from Loligo vulgaris' 15909 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15909 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18853398 _Citation.Full_citation . _Citation.Title 'Variation in protein C(alpha)-related one-bond J couplings' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Magn. Reson. Chem.' _Citation.Journal_name_full 'Magnetic Resonance in Chemistry' _Citation.Journal_volume 47 _Citation.Journal_issue 1 _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 16 _Citation.Page_last 30 _Citation.Year 2009 _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. . 15909 1 2 Mark Howard . J. . 15909 1 3 Mitcheell Maestre-Martinez . . . 15909 1 4 Carlos Perez . S. . 15909 1 5 Frank Lohr . . . 15909 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'data mining' 15909 1 'one-bond coupling' 15909 1 statistics 15909 1 'torsion angles' 15909 1 stop_ save_ save_Salzmann_et_al_1998 _Citation.Sf_category citations _Citation.Sf_framecode Salzmann_et_al_1998 _Citation.Entry_ID 15909 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 9811843 _Citation.Full_citation . _Citation.Title 'TROSY in triple-resonance experiments: New perspectives for sequential NMR assignment of large proteins' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 95 _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 13585 _Citation.Page_last 13590 _Citation.Year 1998 _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 . . . 15909 2 2 K. Pervushin . . . 15909 2 3 G. Wider . . . 15909 2 4 H. Senn . . . 15909 2 5 K. Wuthrich . . . 15909 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCACO measurement' 15909 2 '1JCAHA measurement' 15909 2 'TROSY method' 15909 2 stop_ save_ save_Lohr_et_al_1999 _Citation.Sf_category citations _Citation.Sf_framecode Lohr_et_al_1999 _Citation.Entry_ID 15909 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Recording heteronuclear quantitative J-correlation spectra with internal reference peaks' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Bull. Magn. Reson.' _Citation.Journal_name_full . _Citation.Journal_volume 20 _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 9 _Citation.Page_last 14 _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 F. Lohr . . . 15909 3 2 C. Perez . . . 15909 3 3 J. Schmidt . M. . 15909 3 4 H. Ruterjans . . . 15909 3 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCAN measurement' 15909 3 'quantitative J-correlation' 15909 3 stop_ save_ save_Salzmann_et_al_1999 _Citation.Sf_category citations _Citation.Sf_framecode Salzmann_et_al_1999 _Citation.Entry_ID 15909 _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 'TROSY-type triple-resonance experiments for sequential NMR assignments of large proteins' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 121 _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 844 _Citation.Page_last 848 _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 . . . 15909 4 2 G. Wider . . . 15909 4 3 K. Pervushin . . . 15909 4 4 H. Senn . . . 15909 4 5 K. Wuthrich . . . 15909 4 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCACB measurement' 15909 4 'TROSY method' 15909 4 stop_ save_ save_Yang_et_al_1999 _Citation.Sf_category citations _Citation.Sf_framecode Yang_et_al_1999 _Citation.Entry_ID 15909 _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 'TROSY-based HNCO pulse sequence for the measurement of 1HN-15N, 15N-13CO, 1HN-13CO, 13CO-13Ca and 1HN-13Ca dipolar couplings in 15N, 13C, 2H-labeled 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 333 _Citation.Page_last 343 _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 D. Yang . . . 15909 5 2 R. Venters . A. . 15909 5 3 G. Mueller . A. . 15909 5 4 W. Choy . Y. . 15909 5 5 L. Kay . E. . 15909 5 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCACO measurement' 15909 5 stop_ save_ save_Permi_&_Annila_2000 _Citation.Sf_category citations _Citation.Sf_framecode Permi_&_Annila_2000 _Citation.Entry_ID 15909 _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 . . . 15909 6 2 A. Annila . . . 15909 6 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCAN measurement' 15909 6 stop_ save_ save_Evenas_et_al_2001 _Citation.Sf_category citations _Citation.Sf_framecode Evenas_et_al_2001 _Citation.Entry_ID 15909 _Citation.ID 7 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11456973 _Citation.Full_citation . _Citation.Title 'Measurement of 13Ca-13Cb dipolar couplings in 15N,13C,2H-labeled proteins: Application to domain orientation in maltose binding protein' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. 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Wienk . L.J. . 15909 13 2 M. Martinez . M. . 15909 13 3 G. Yalloway . N. . 15909 13 4 J. Schmidt . M. . 15909 13 5 C. Perez . . . 15909 13 6 H. Ruterjans . . . 15909 13 7 F. Lohr . . . 15909 13 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCAN measurement' 15909 13 stop_ save_ save_Ball_et_al_2006 _Citation.Sf_category citations _Citation.Sf_framecode Ball_et_al_2006 _Citation.Entry_ID 15909 _Citation.ID 14 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16495100 _Citation.Full_citation . _Citation.Title 'Measurement of one-bond 13Ca-1Ha residual dipolar coupling constants in proteins by selective manipulation of CaHa spins' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Magn. Reson.' _Citation.Journal_name_full . _Citation.Journal_volume 180 _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 127 _Citation.Page_last 136 _Citation.Year 2006 _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. Ball . . . 15909 14 2 N. Meenan . . . 15909 14 3 K. Bromek . . . 15909 14 4 B. Smith . O. . 15909 14 5 J. Bella . . . 15909 14 6 D. Uhrin . . . 15909 14 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '1JCAHA measurement' 15909 14 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15909 _Assembly.ID 1 _Assembly.Name Diisopropylfluorophosphatase _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 35161.4 _Assembly.Enzyme_commission_number 3.1.8.2 _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 $DFPase A . yes native no no . . . 15909 1 2 'CALCIUM ION, 1' 2 $CA B . no native no no . . . 15909 1 3 'CALCIUM ION, 2' 2 $CA C . no native no no . . . 15909 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 1E1A . . X-ray 1.8 'X-ray structure of Diisopropylfluorophosphatase' . 15909 1 yes PDB 1PJX . . X-ray 0.85 'X-ray structure of Diisopropylfluorophosphatase' . 15909 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID hydrolase 15909 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DFPase _Entity.Sf_category entity _Entity.Sf_framecode DFPase _Entity.Entry_ID 15909 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name DFPase _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 ; GSMEIPVIEPLFTKVTEDIP GAEGPVFDKNGDFYIVAPEV EVNGKPAGEILRIDLKTGKK TVICKPEVNGYGGIPAGCQC DRDANQLFVADMRLGLLVVQ TDGTFEEIAKKDSEGRRMQG CNDCAFDYEGNLWITAPAGE VAPADYTRSMQEKFGSIYCF TTDGQMIQVDTAFQFPNGIA VRHMNDGRPYQLIVAETPTK KLWSYDIKGPAKIENKKVWG HIPGTHEGGADGMDFDEDNN LLVANWGSSHIEVFGPDGGQ PKMRIRCPFEKPSNLHFKPQ TKTIFVTEHENNAVWKFEWQ RNGKKQYCETLKFGIF ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 1 -2 GLY 2 -1 SER 3 1 MET 4 2 GLU ... 316 314 PHE ; _Entity.Polymer_author_seq_details 'Leading residues Gly(-2) and Ser(-1) are cloning artefacts and do not give NMR signals.' _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 316 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 3.1.8.2 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 35081.3 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 16584 . DFPase . . . . . 100.00 316 100.00 100.00 0.00e+00 . . . . 15909 1 2 no PDB 1E1A . "Crystal Structure Of Dfpase From Loligo Vulgaris" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 3 no PDB 1PJX . "0.85 Angstrom Structure Of Squid Ganglion Dfpase" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 4 no PDB 2GVU . "Crystal Structure Of Diisopropyl Fluorophosphatase (Dfpase), Mutant D229n N120D" . . . . . 99.37 314 99.36 100.00 0.00e+00 . . . . 15909 1 5 no PDB 2GVV . "Structure Of Diisopropyl Fluorophosphatase (Dfpase) In Complex With Dicyclopentylphosphoroamidate (Dcppa)" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 6 no PDB 2GVW . "Structure Of Diisopropyl Fluorophosphatase (Dfpase) Holoenzyme (Rt)" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 7 no PDB 2GVX . "Structure Of Diisopropyl Fluorophosphatase (Dfpase), Mutant D229n N175D" . . . . . 99.37 314 99.36 100.00 0.00e+00 . . . . 15909 1 8 no PDB 2IAO . "Crystal Structure Of Squid Ganglion Dfpase E37q Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 9 no PDB 2IAP . "Crystal Structure Of Squid Ganglion Dfpase E21q Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 10 no PDB 2IAQ . "Crystal Structure Of Squid Ganglion Dfpase S271a Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 11 no PDB 2IAR . "Crystal Structure Of Squid Ganglion Dfpase W244h Mutant" . . . . . 98.73 312 99.68 99.68 0.00e+00 . . . . 15909 1 12 no PDB 2IAS . "Crystal Structure Of Squid Ganglion Dfpase W244f Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 13 no PDB 2IAT . "Crystal Structure Of Squid Ganglion Dfpase W244l Mutant" . . . . . 98.73 312 99.68 99.68 0.00e+00 . . . . 15909 1 14 no PDB 2IAU . "Crystal Structure Of Squid Ganglion Dfpase W244y Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 15 no PDB 2IAV . "Crystal Structure Of Squid Ganglion Dfpase H287a Mutant" . . . . . 98.73 312 99.68 99.68 0.00e+00 . . . . 15909 1 16 no PDB 2IAW . "Crystal Structure Of Squid Ganglion Dfpase N175d Mutant" . . . . . 98.73 312 99.68 100.00 0.00e+00 . . . . 15909 1 17 no PDB 2IAX . "Crystal Structure Of Squid Ganglion Dfpase D232s Mutant" . . . . . 98.73 312 99.68 99.68 0.00e+00 . . . . 15909 1 18 no PDB 3BYC . "Joint Neutron And X-Ray Structure Of Diisopropyl Fluorophosphatase. Deuterium Occupancies Are 1-Q, Where Q Is Occupancy Of H" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 19 no PDB 3HLH . "Diisopropyl Fluorophosphatase (Dfpase), Active Site Mutants" . . . . . 99.37 314 98.73 98.73 0.00e+00 . . . . 15909 1 20 no PDB 3HLI . "Diisopropyl Fluorophosphatase (Dfpase), Active Site Mutants" . . . . . 99.37 314 98.73 99.04 0.00e+00 . . . . 15909 1 21 no PDB 3KGG . "X-Ray Structure Of Perdeuterated Diisopropyl Fluorophosphata (Dfpase): Perdeuteration Of Proteins For Neutron Diffractio" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 22 no PDB 3LI3 . "Diisopropyl Fluorophosphatase (Dfpase), D121e Mutant" . . . . . 99.37 314 99.68 100.00 0.00e+00 . . . . 15909 1 23 no PDB 3LI4 . "Diisopropyl Fluorophosphatase (Dfpase), N120d,N175d,D229n Mutant" . . . . . 99.37 314 99.04 100.00 0.00e+00 . . . . 15909 1 24 no PDB 3LI5 . "Diisopropyl Fluorophosphatase (Dfpase), E21q,N120d,N175d,D229n Mutant" . . . . . 99.37 314 98.73 100.00 0.00e+00 . . . . 15909 1 25 no PDB 3O4P . "Dfpase At 0.85 Angstrom Resolution (h Atoms Included)" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 26 no SP Q7SIG4 . "RecName: Full=Diisopropyl-fluorophosphatase; Short=DFPase" . . . . . 99.37 314 100.00 100.00 0.00e+00 . . . . 15909 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID hydrolase 15909 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -2 GLY . 15909 1 2 -1 SER . 15909 1 3 1 MET . 15909 1 4 2 GLU . 15909 1 5 3 ILE . 15909 1 6 4 PRO . 15909 1 7 5 VAL . 15909 1 8 6 ILE . 15909 1 9 7 GLU . 15909 1 10 8 PRO . 15909 1 11 9 LEU . 15909 1 12 10 PHE . 15909 1 13 11 THR . 15909 1 14 12 LYS . 15909 1 15 13 VAL . 15909 1 16 14 THR . 15909 1 17 15 GLU . 15909 1 18 16 ASP . 15909 1 19 17 ILE . 15909 1 20 18 PRO . 15909 1 21 19 GLY . 15909 1 22 20 ALA . 15909 1 23 21 GLU . 15909 1 24 22 GLY . 15909 1 25 23 PRO . 15909 1 26 24 VAL . 15909 1 27 25 PHE . 15909 1 28 26 ASP . 15909 1 29 27 LYS . 15909 1 30 28 ASN . 15909 1 31 29 GLY . 15909 1 32 30 ASP . 15909 1 33 31 PHE . 15909 1 34 32 TYR . 15909 1 35 33 ILE . 15909 1 36 34 VAL . 15909 1 37 35 ALA . 15909 1 38 36 PRO . 15909 1 39 37 GLU . 15909 1 40 38 VAL . 15909 1 41 39 GLU . 15909 1 42 40 VAL . 15909 1 43 41 ASN . 15909 1 44 42 GLY . 15909 1 45 43 LYS . 15909 1 46 44 PRO . 15909 1 47 45 ALA . 15909 1 48 46 GLY . 15909 1 49 47 GLU . 15909 1 50 48 ILE . 15909 1 51 49 LEU . 15909 1 52 50 ARG . 15909 1 53 51 ILE . 15909 1 54 52 ASP . 15909 1 55 53 LEU . 15909 1 56 54 LYS . 15909 1 57 55 THR . 15909 1 58 56 GLY . 15909 1 59 57 LYS . 15909 1 60 58 LYS . 15909 1 61 59 THR . 15909 1 62 60 VAL . 15909 1 63 61 ILE . 15909 1 64 62 CYS . 15909 1 65 63 LYS . 15909 1 66 64 PRO . 15909 1 67 65 GLU . 15909 1 68 66 VAL . 15909 1 69 67 ASN . 15909 1 70 68 GLY . 15909 1 71 69 TYR . 15909 1 72 70 GLY . 15909 1 73 71 GLY . 15909 1 74 72 ILE . 15909 1 75 73 PRO . 15909 1 76 74 ALA . 15909 1 77 75 GLY . 15909 1 78 76 CYS . 15909 1 79 77 GLN . 15909 1 80 78 CYS . 15909 1 81 79 ASP . 15909 1 82 80 ARG . 15909 1 83 81 ASP . 15909 1 84 82 ALA . 15909 1 85 83 ASN . 15909 1 86 84 GLN . 15909 1 87 85 LEU . 15909 1 88 86 PHE . 15909 1 89 87 VAL . 15909 1 90 88 ALA . 15909 1 91 89 ASP . 15909 1 92 90 MET . 15909 1 93 91 ARG . 15909 1 94 92 LEU . 15909 1 95 93 GLY . 15909 1 96 94 LEU . 15909 1 97 95 LEU . 15909 1 98 96 VAL . 15909 1 99 97 VAL . 15909 1 100 98 GLN . 15909 1 101 99 THR . 15909 1 102 100 ASP . 15909 1 103 101 GLY . 15909 1 104 102 THR . 15909 1 105 103 PHE . 15909 1 106 104 GLU . 15909 1 107 105 GLU . 15909 1 108 106 ILE . 15909 1 109 107 ALA . 15909 1 110 108 LYS . 15909 1 111 109 LYS . 15909 1 112 110 ASP . 15909 1 113 111 SER . 15909 1 114 112 GLU . 15909 1 115 113 GLY . 15909 1 116 114 ARG . 15909 1 117 115 ARG . 15909 1 118 116 MET . 15909 1 119 117 GLN . 15909 1 120 118 GLY . 15909 1 121 119 CYS . 15909 1 122 120 ASN . 15909 1 123 121 ASP . 15909 1 124 122 CYS . 15909 1 125 123 ALA . 15909 1 126 124 PHE . 15909 1 127 125 ASP . 15909 1 128 126 TYR . 15909 1 129 127 GLU . 15909 1 130 128 GLY . 15909 1 131 129 ASN . 15909 1 132 130 LEU . 15909 1 133 131 TRP . 15909 1 134 132 ILE . 15909 1 135 133 THR . 15909 1 136 134 ALA . 15909 1 137 135 PRO . 15909 1 138 136 ALA . 15909 1 139 137 GLY . 15909 1 140 138 GLU . 15909 1 141 139 VAL . 15909 1 142 140 ALA . 15909 1 143 141 PRO . 15909 1 144 142 ALA . 15909 1 145 143 ASP . 15909 1 146 144 TYR . 15909 1 147 145 THR . 15909 1 148 146 ARG . 15909 1 149 147 SER . 15909 1 150 148 MET . 15909 1 151 149 GLN . 15909 1 152 150 GLU . 15909 1 153 151 LYS . 15909 1 154 152 PHE . 15909 1 155 153 GLY . 15909 1 156 154 SER . 15909 1 157 155 ILE . 15909 1 158 156 TYR . 15909 1 159 157 CYS . 15909 1 160 158 PHE . 15909 1 161 159 THR . 15909 1 162 160 THR . 15909 1 163 161 ASP . 15909 1 164 162 GLY . 15909 1 165 163 GLN . 15909 1 166 164 MET . 15909 1 167 165 ILE . 15909 1 168 166 GLN . 15909 1 169 167 VAL . 15909 1 170 168 ASP . 15909 1 171 169 THR . 15909 1 172 170 ALA . 15909 1 173 171 PHE . 15909 1 174 172 GLN . 15909 1 175 173 PHE . 15909 1 176 174 PRO . 15909 1 177 175 ASN . 15909 1 178 176 GLY . 15909 1 179 177 ILE . 15909 1 180 178 ALA . 15909 1 181 179 VAL . 15909 1 182 180 ARG . 15909 1 183 181 HIS . 15909 1 184 182 MET . 15909 1 185 183 ASN . 15909 1 186 184 ASP . 15909 1 187 185 GLY . 15909 1 188 186 ARG . 15909 1 189 187 PRO . 15909 1 190 188 TYR . 15909 1 191 189 GLN . 15909 1 192 190 LEU . 15909 1 193 191 ILE . 15909 1 194 192 VAL . 15909 1 195 193 ALA . 15909 1 196 194 GLU . 15909 1 197 195 THR . 15909 1 198 196 PRO . 15909 1 199 197 THR . 15909 1 200 198 LYS . 15909 1 201 199 LYS . 15909 1 202 200 LEU . 15909 1 203 201 TRP . 15909 1 204 202 SER . 15909 1 205 203 TYR . 15909 1 206 204 ASP . 15909 1 207 205 ILE . 15909 1 208 206 LYS . 15909 1 209 207 GLY . 15909 1 210 208 PRO . 15909 1 211 209 ALA . 15909 1 212 210 LYS . 15909 1 213 211 ILE . 15909 1 214 212 GLU . 15909 1 215 213 ASN . 15909 1 216 214 LYS . 15909 1 217 215 LYS . 15909 1 218 216 VAL . 15909 1 219 217 TRP . 15909 1 220 218 GLY . 15909 1 221 219 HIS . 15909 1 222 220 ILE . 15909 1 223 221 PRO . 15909 1 224 222 GLY . 15909 1 225 223 THR . 15909 1 226 224 HIS . 15909 1 227 225 GLU . 15909 1 228 226 GLY . 15909 1 229 227 GLY . 15909 1 230 228 ALA . 15909 1 231 229 ASP . 15909 1 232 230 GLY . 15909 1 233 231 MET . 15909 1 234 232 ASP . 15909 1 235 233 PHE . 15909 1 236 234 ASP . 15909 1 237 235 GLU . 15909 1 238 236 ASP . 15909 1 239 237 ASN . 15909 1 240 238 ASN . 15909 1 241 239 LEU . 15909 1 242 240 LEU . 15909 1 243 241 VAL . 15909 1 244 242 ALA . 15909 1 245 243 ASN . 15909 1 246 244 TRP . 15909 1 247 245 GLY . 15909 1 248 246 SER . 15909 1 249 247 SER . 15909 1 250 248 HIS . 15909 1 251 249 ILE . 15909 1 252 250 GLU . 15909 1 253 251 VAL . 15909 1 254 252 PHE . 15909 1 255 253 GLY . 15909 1 256 254 PRO . 15909 1 257 255 ASP . 15909 1 258 256 GLY . 15909 1 259 257 GLY . 15909 1 260 258 GLN . 15909 1 261 259 PRO . 15909 1 262 260 LYS . 15909 1 263 261 MET . 15909 1 264 262 ARG . 15909 1 265 263 ILE . 15909 1 266 264 ARG . 15909 1 267 265 CYS . 15909 1 268 266 PRO . 15909 1 269 267 PHE . 15909 1 270 268 GLU . 15909 1 271 269 LYS . 15909 1 272 270 PRO . 15909 1 273 271 SER . 15909 1 274 272 ASN . 15909 1 275 273 LEU . 15909 1 276 274 HIS . 15909 1 277 275 PHE . 15909 1 278 276 LYS . 15909 1 279 277 PRO . 15909 1 280 278 GLN . 15909 1 281 279 THR . 15909 1 282 280 LYS . 15909 1 283 281 THR . 15909 1 284 282 ILE . 15909 1 285 283 PHE . 15909 1 286 284 VAL . 15909 1 287 285 THR . 15909 1 288 286 GLU . 15909 1 289 287 HIS . 15909 1 290 288 GLU . 15909 1 291 289 ASN . 15909 1 292 290 ASN . 15909 1 293 291 ALA . 15909 1 294 292 VAL . 15909 1 295 293 TRP . 15909 1 296 294 LYS . 15909 1 297 295 PHE . 15909 1 298 296 GLU . 15909 1 299 297 TRP . 15909 1 300 298 GLN . 15909 1 301 299 ARG . 15909 1 302 300 ASN . 15909 1 303 301 GLY . 15909 1 304 302 LYS . 15909 1 305 303 LYS . 15909 1 306 304 GLN . 15909 1 307 305 TYR . 15909 1 308 306 CYS . 15909 1 309 307 GLU . 15909 1 310 308 THR . 15909 1 311 309 LEU . 15909 1 312 310 LYS . 15909 1 313 311 PHE . 15909 1 314 312 GLY . 15909 1 315 313 ILE . 15909 1 316 314 PHE . 15909 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 15909 1 . SER 2 2 15909 1 . MET 3 3 15909 1 . GLU 4 4 15909 1 . ILE 5 5 15909 1 . PRO 6 6 15909 1 . VAL 7 7 15909 1 . ILE 8 8 15909 1 . GLU 9 9 15909 1 . PRO 10 10 15909 1 . LEU 11 11 15909 1 . PHE 12 12 15909 1 . THR 13 13 15909 1 . LYS 14 14 15909 1 . VAL 15 15 15909 1 . THR 16 16 15909 1 . GLU 17 17 15909 1 . ASP 18 18 15909 1 . ILE 19 19 15909 1 . PRO 20 20 15909 1 . GLY 21 21 15909 1 . ALA 22 22 15909 1 . GLU 23 23 15909 1 . GLY 24 24 15909 1 . PRO 25 25 15909 1 . VAL 26 26 15909 1 . PHE 27 27 15909 1 . ASP 28 28 15909 1 . LYS 29 29 15909 1 . ASN 30 30 15909 1 . GLY 31 31 15909 1 . ASP 32 32 15909 1 . PHE 33 33 15909 1 . TYR 34 34 15909 1 . ILE 35 35 15909 1 . VAL 36 36 15909 1 . ALA 37 37 15909 1 . PRO 38 38 15909 1 . GLU 39 39 15909 1 . VAL 40 40 15909 1 . GLU 41 41 15909 1 . VAL 42 42 15909 1 . ASN 43 43 15909 1 . GLY 44 44 15909 1 . LYS 45 45 15909 1 . PRO 46 46 15909 1 . ALA 47 47 15909 1 . GLY 48 48 15909 1 . GLU 49 49 15909 1 . ILE 50 50 15909 1 . LEU 51 51 15909 1 . ARG 52 52 15909 1 . ILE 53 53 15909 1 . ASP 54 54 15909 1 . LEU 55 55 15909 1 . LYS 56 56 15909 1 . THR 57 57 15909 1 . GLY 58 58 15909 1 . LYS 59 59 15909 1 . LYS 60 60 15909 1 . THR 61 61 15909 1 . VAL 62 62 15909 1 . ILE 63 63 15909 1 . CYS 64 64 15909 1 . LYS 65 65 15909 1 . PRO 66 66 15909 1 . GLU 67 67 15909 1 . VAL 68 68 15909 1 . ASN 69 69 15909 1 . GLY 70 70 15909 1 . TYR 71 71 15909 1 . GLY 72 72 15909 1 . GLY 73 73 15909 1 . ILE 74 74 15909 1 . PRO 75 75 15909 1 . ALA 76 76 15909 1 . GLY 77 77 15909 1 . CYS 78 78 15909 1 . GLN 79 79 15909 1 . CYS 80 80 15909 1 . ASP 81 81 15909 1 . ARG 82 82 15909 1 . ASP 83 83 15909 1 . ALA 84 84 15909 1 . ASN 85 85 15909 1 . GLN 86 86 15909 1 . LEU 87 87 15909 1 . PHE 88 88 15909 1 . VAL 89 89 15909 1 . ALA 90 90 15909 1 . ASP 91 91 15909 1 . MET 92 92 15909 1 . ARG 93 93 15909 1 . LEU 94 94 15909 1 . GLY 95 95 15909 1 . LEU 96 96 15909 1 . LEU 97 97 15909 1 . VAL 98 98 15909 1 . VAL 99 99 15909 1 . GLN 100 100 15909 1 . THR 101 101 15909 1 . ASP 102 102 15909 1 . GLY 103 103 15909 1 . THR 104 104 15909 1 . PHE 105 105 15909 1 . GLU 106 106 15909 1 . GLU 107 107 15909 1 . ILE 108 108 15909 1 . ALA 109 109 15909 1 . LYS 110 110 15909 1 . LYS 111 111 15909 1 . ASP 112 112 15909 1 . SER 113 113 15909 1 . GLU 114 114 15909 1 . GLY 115 115 15909 1 . ARG 116 116 15909 1 . ARG 117 117 15909 1 . MET 118 118 15909 1 . GLN 119 119 15909 1 . GLY 120 120 15909 1 . CYS 121 121 15909 1 . ASN 122 122 15909 1 . ASP 123 123 15909 1 . CYS 124 124 15909 1 . ALA 125 125 15909 1 . PHE 126 126 15909 1 . ASP 127 127 15909 1 . TYR 128 128 15909 1 . GLU 129 129 15909 1 . GLY 130 130 15909 1 . ASN 131 131 15909 1 . LEU 132 132 15909 1 . TRP 133 133 15909 1 . ILE 134 134 15909 1 . THR 135 135 15909 1 . ALA 136 136 15909 1 . PRO 137 137 15909 1 . ALA 138 138 15909 1 . GLY 139 139 15909 1 . GLU 140 140 15909 1 . VAL 141 141 15909 1 . ALA 142 142 15909 1 . PRO 143 143 15909 1 . ALA 144 144 15909 1 . ASP 145 145 15909 1 . TYR 146 146 15909 1 . THR 147 147 15909 1 . ARG 148 148 15909 1 . SER 149 149 15909 1 . MET 150 150 15909 1 . GLN 151 151 15909 1 . GLU 152 152 15909 1 . LYS 153 153 15909 1 . PHE 154 154 15909 1 . GLY 155 155 15909 1 . SER 156 156 15909 1 . ILE 157 157 15909 1 . TYR 158 158 15909 1 . CYS 159 159 15909 1 . PHE 160 160 15909 1 . THR 161 161 15909 1 . THR 162 162 15909 1 . ASP 163 163 15909 1 . GLY 164 164 15909 1 . GLN 165 165 15909 1 . MET 166 166 15909 1 . ILE 167 167 15909 1 . GLN 168 168 15909 1 . VAL 169 169 15909 1 . ASP 170 170 15909 1 . THR 171 171 15909 1 . ALA 172 172 15909 1 . PHE 173 173 15909 1 . GLN 174 174 15909 1 . PHE 175 175 15909 1 . PRO 176 176 15909 1 . ASN 177 177 15909 1 . GLY 178 178 15909 1 . ILE 179 179 15909 1 . ALA 180 180 15909 1 . VAL 181 181 15909 1 . ARG 182 182 15909 1 . HIS 183 183 15909 1 . MET 184 184 15909 1 . ASN 185 185 15909 1 . ASP 186 186 15909 1 . GLY 187 187 15909 1 . ARG 188 188 15909 1 . PRO 189 189 15909 1 . TYR 190 190 15909 1 . GLN 191 191 15909 1 . LEU 192 192 15909 1 . ILE 193 193 15909 1 . VAL 194 194 15909 1 . ALA 195 195 15909 1 . GLU 196 196 15909 1 . THR 197 197 15909 1 . PRO 198 198 15909 1 . THR 199 199 15909 1 . LYS 200 200 15909 1 . LYS 201 201 15909 1 . LEU 202 202 15909 1 . TRP 203 203 15909 1 . SER 204 204 15909 1 . TYR 205 205 15909 1 . ASP 206 206 15909 1 . ILE 207 207 15909 1 . LYS 208 208 15909 1 . GLY 209 209 15909 1 . PRO 210 210 15909 1 . ALA 211 211 15909 1 . LYS 212 212 15909 1 . ILE 213 213 15909 1 . GLU 214 214 15909 1 . ASN 215 215 15909 1 . LYS 216 216 15909 1 . LYS 217 217 15909 1 . VAL 218 218 15909 1 . TRP 219 219 15909 1 . GLY 220 220 15909 1 . HIS 221 221 15909 1 . ILE 222 222 15909 1 . PRO 223 223 15909 1 . GLY 224 224 15909 1 . THR 225 225 15909 1 . HIS 226 226 15909 1 . GLU 227 227 15909 1 . GLY 228 228 15909 1 . GLY 229 229 15909 1 . ALA 230 230 15909 1 . ASP 231 231 15909 1 . GLY 232 232 15909 1 . MET 233 233 15909 1 . ASP 234 234 15909 1 . PHE 235 235 15909 1 . ASP 236 236 15909 1 . GLU 237 237 15909 1 . ASP 238 238 15909 1 . ASN 239 239 15909 1 . ASN 240 240 15909 1 . LEU 241 241 15909 1 . LEU 242 242 15909 1 . VAL 243 243 15909 1 . ALA 244 244 15909 1 . ASN 245 245 15909 1 . TRP 246 246 15909 1 . GLY 247 247 15909 1 . SER 248 248 15909 1 . SER 249 249 15909 1 . HIS 250 250 15909 1 . ILE 251 251 15909 1 . GLU 252 252 15909 1 . VAL 253 253 15909 1 . PHE 254 254 15909 1 . GLY 255 255 15909 1 . PRO 256 256 15909 1 . ASP 257 257 15909 1 . GLY 258 258 15909 1 . GLY 259 259 15909 1 . GLN 260 260 15909 1 . PRO 261 261 15909 1 . LYS 262 262 15909 1 . MET 263 263 15909 1 . ARG 264 264 15909 1 . ILE 265 265 15909 1 . ARG 266 266 15909 1 . CYS 267 267 15909 1 . PRO 268 268 15909 1 . PHE 269 269 15909 1 . GLU 270 270 15909 1 . LYS 271 271 15909 1 . PRO 272 272 15909 1 . SER 273 273 15909 1 . ASN 274 274 15909 1 . LEU 275 275 15909 1 . HIS 276 276 15909 1 . PHE 277 277 15909 1 . LYS 278 278 15909 1 . PRO 279 279 15909 1 . GLN 280 280 15909 1 . THR 281 281 15909 1 . LYS 282 282 15909 1 . THR 283 283 15909 1 . ILE 284 284 15909 1 . PHE 285 285 15909 1 . VAL 286 286 15909 1 . THR 287 287 15909 1 . GLU 288 288 15909 1 . HIS 289 289 15909 1 . GLU 290 290 15909 1 . ASN 291 291 15909 1 . ASN 292 292 15909 1 . ALA 293 293 15909 1 . VAL 294 294 15909 1 . TRP 295 295 15909 1 . LYS 296 296 15909 1 . PHE 297 297 15909 1 . GLU 298 298 15909 1 . TRP 299 299 15909 1 . GLN 300 300 15909 1 . ARG 301 301 15909 1 . ASN 302 302 15909 1 . GLY 303 303 15909 1 . LYS 304 304 15909 1 . LYS 305 305 15909 1 . GLN 306 306 15909 1 . TYR 307 307 15909 1 . CYS 308 308 15909 1 . GLU 309 309 15909 1 . THR 310 310 15909 1 . LEU 311 311 15909 1 . LYS 312 312 15909 1 . PHE 313 313 15909 1 . GLY 314 314 15909 1 . ILE 315 315 15909 1 . PHE 316 316 15909 1 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID 15909 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . CA . 15909 2 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 15909 _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 $DFPase . 6622 organism . 'Loligo vulgaris' 'Loligo vulgaris' . . Eukaryota Metazoa Loligo vulgaris . . . . . . . . . . . . . . . . . . . . . 15909 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 15909 _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 $DFPase . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pKKHisND . . . . . . 15909 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 15909 _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Oct 14 16:24:00 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 15909 CA [Ca++] SMILES CACTVS 3.341 15909 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 15909 CA [Ca+2] SMILES ACDLabs 10.04 15909 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 15909 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 15909 CA InChI=1S/Ca/q+2 InChI InChI 1.03 15909 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 15909 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 15909 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 15909 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_doubly_labeled _Sample.Sf_category sample _Sample.Sf_framecode doubly_labeled _Sample.Entry_ID 15909 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DFPase '[U-95% 13C; U-95% 15N]' . . 1 $DFPase . . 1.6 . . mM . . . . 15909 1 2 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 15909 1 3 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 15909 1 4 'Pefabloc protease inhibitor' 'natural abundance' . . . . . . 50 . . ug/ml . . . . 15909 1 5 D2O [U-2H] . . . . . . 5 . . % . . . . 15909 1 6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 15909 1 stop_ save_ save_triply_labeled _Sample.Sf_category sample _Sample.Sf_framecode triply_labeled _Sample.Entry_ID 15909 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DFPase '[U-95% 13C; U-95% 15N; 90% 2H]' . . 1 $DFPase . . 0.75 . . mM . . . . 15909 2 2 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 15909 2 3 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 15909 2 4 'Pefabloc protease inhibitor' 'natural abundance' . . . . . . 50 . . ug/ml . . . . 15909 2 5 D2O [U-2H] . . . . . . 5 . . % . . . . 15909 2 6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 15909 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 15909 _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 6.5 . pH 15909 1 pressure 1 . atm 15909 1 temperature 301 . K 15909 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 15909 _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' . . 15909 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15909 1 processing 15909 1 stop_ save_ save_jeval _Software.Sf_category software _Software.Sf_framecode jeval _Software.Entry_ID 15909 _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 15909 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'coupling constant extraction' 15909 2 'data analysis' 15909 2 'multiplet simulation' 15909 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 15909 _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 15909 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details '1H{13C,15N}-triple-resonance three-axis PFG probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 15909 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details '1H{13C,15N}-triple-resonance z-gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 15909 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details 'cryogenically cooled triple-resonance z-gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_5 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_5 _NMR_spectrometer.Entry_ID 15909 _NMR_spectrometer.ID 5 _NMR_spectrometer.Details 'room-temperature and cryogenic triple-resonance z-gradient probes' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15909 _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' . . 15909 1 2 spectrometer_2 Bruker DMX . 600 '1H{13C,15N}-triple-resonance three-axis PFG probe' . . 15909 1 3 spectrometer_3 Bruker Avance . 700 '1H{13C,15N}-triple-resonance z-gradient probe' . . 15909 1 4 spectrometer_4 Bruker DRX . 600 'cryogenically cooled triple-resonance z-gradient probe' . . 15909 1 5 spectrometer_5 Bruker DRX . 800 'room-temperature and cryogenic triple-resonance z-gradient probes' . . 15909 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 15909 _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 . . . . . . . . . . 2 $triply_labeled isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15909 1 2 '3D Cb-coupled [15N,1H]-TROSY-HN(CO)CA' no . . . . . . . . . . 2 $triply_labeled isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 15909 1 3 '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' no . . . . . . . . . . 2 $triply_labeled isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 15909 1 4 '3D quantitative J-correlated [15N,1H]-TROSY-HNC' no . . . . . . . . . . 2 $triply_labeled isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 15909 1 5 '3D Ca-coupled HA(CACO)NH' no . . . . . . . . . . 1 $doubly_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15909 1 6 '3D Ha-coupled [15N,1H]-TROSY-HNCA' no . . . . . . . . . . 1 $doubly_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15909 1 7 '3D Ha-coupled [15N,1H]-TROSY-iHNCA' no . . . . . . . . . . 1 $doubly_labeled isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15909 1 8 '3D Ha-coupled [15N,1H]-TROSY-HN(CO)CA' no . . . . . . . . . . 1 $doubly_labeled isotropic . . 1 $sample_conditions_1 . . . 5 $spectrometer_5 . . . . . . . . . . . . . . . . 15909 1 stop_ save_ ######################## # Coupling constants # ######################## save_1JCaCO _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 1JCaCO _Coupling_constant_list.Entry_ID 15909 _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' . . . 15909 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 1JCACO . 1 1 3 3 MET CA C 13 . . 1 1 3 3 MET C C 13 . 52.45 . . 0.50 . . . 1 MET CA . 1 MET C . 15909 1 2 1JCACO . 1 1 4 4 GLU CA C 13 . . 1 1 4 4 GLU C C 13 . 52.37 . . 0.50 . . . 2 GLU CA . 2 GLU C . 15909 1 3 1JCACO . 1 1 6 6 PRO CA C 13 . . 1 1 6 6 PRO C C 13 . 54.21 . . 0.50 . . . 4 PRO CA . 4 PRO C . 15909 1 4 1JCACO . 1 1 7 7 VAL CA C 13 . . 1 1 7 7 VAL C C 13 . 53.31 . . 0.50 . . . 5 VAL CA . 5 VAL C . 15909 1 5 1JCACO . 1 1 10 10 PRO CA C 13 . . 1 1 10 10 PRO C C 13 . 51.51 . . 0.50 . . . 8 PRO CA . 8 PRO C . 15909 1 6 1JCACO . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU C C 13 . 52.11 . . 0.50 . . . 9 LEU CA . 9 LEU C . 15909 1 7 1JCACO . 1 1 12 12 PHE CA C 13 . . 1 1 12 12 PHE C C 13 . 52.19 . . 0.50 . . . 10 PHE CA . 10 PHE C . 15909 1 8 1JCACO . 1 1 13 13 THR CA C 13 . . 1 1 13 13 THR C C 13 . 51.84 . . 0.50 . . . 11 THR CA . 11 THR C . 15909 1 9 1JCACO . 1 1 14 14 LYS CA C 13 . . 1 1 14 14 LYS C C 13 . 52.64 . . 0.50 . . . 12 LYS CA . 12 LYS C . 15909 1 10 1JCACO . 1 1 15 15 VAL CA C 13 . . 1 1 15 15 VAL C C 13 . 53.50 . . 0.50 . . . 13 VAL CA . 13 VAL C . 15909 1 11 1JCACO . 1 1 16 16 THR CA C 13 . . 1 1 16 16 THR C C 13 . 50.44 . . 0.50 . . . 14 THR CA . 14 THR C . 15909 1 12 1JCACO . 1 1 17 17 GLU CA C 13 . . 1 1 17 17 GLU C C 13 . 51.43 . . 0.50 . . . 15 GLU CA . 15 GLU C . 15909 1 13 1JCACO . 1 1 18 18 ASP CA C 13 . . 1 1 18 18 ASP C C 13 . 52.59 . . 0.50 . . . 16 ASP CA . 16 ASP C . 15909 1 14 1JCACO . 1 1 20 20 PRO CA C 13 . . 1 1 20 20 PRO C C 13 . 55.06 . . 0.50 . . . 18 PRO CA . 18 PRO C . 15909 1 15 1JCACO . 1 1 21 21 GLY CA C 13 . . 1 1 21 21 GLY C C 13 . 51.09 . . 0.50 . . . 19 GLY CA . 19 GLY C . 15909 1 16 1JCACO . 1 1 23 23 GLU CA C 13 . . 1 1 23 23 GLU C C 13 . 50.46 . . 0.50 . . . 21 GLU CA . 21 GLU C . 15909 1 17 1JCACO . 1 1 26 26 VAL CA C 13 . . 1 1 26 26 VAL C C 13 . 52.30 . . 0.50 . . . 24 VAL CA . 24 VAL C . 15909 1 18 1JCACO . 1 1 28 28 ASP CA C 13 . . 1 1 28 28 ASP C C 13 . 51.91 . . 0.50 . . . 26 ASP CA . 26 ASP C . 15909 1 19 1JCACO . 1 1 29 29 LYS CA C 13 . . 1 1 29 29 LYS C C 13 . 51.76 . . 0.50 . . . 27 LYS CA . 27 LYS C . 15909 1 20 1JCACO . 1 1 30 30 ASN CA C 13 . . 1 1 30 30 ASN C C 13 . 52.39 . . 0.50 . . . 28 ASN CA . 28 ASN C . 15909 1 21 1JCACO . 1 1 31 31 GLY CA C 13 . . 1 1 31 31 GLY C C 13 . 50.42 . . 0.50 . . . 29 GLY CA . 29 GLY C . 15909 1 22 1JCACO . 1 1 32 32 ASP CA C 13 . . 1 1 32 32 ASP C C 13 . 51.44 . . 0.50 . . . 30 ASP CA . 30 ASP C . 15909 1 23 1JCACO . 1 1 39 39 GLU CA C 13 . . 1 1 39 39 GLU C C 13 . 51.92 . . 0.50 . . . 37 GLU CA . 37 GLU C . 15909 1 24 1JCACO . 1 1 40 40 VAL CA C 13 . . 1 1 40 40 VAL C C 13 . 52.86 . . 0.50 . . . 38 VAL CA . 38 VAL C . 15909 1 25 1JCACO . 1 1 41 41 GLU CA C 13 . . 1 1 41 41 GLU C C 13 . 52.29 . . 0.50 . . . 39 GLU CA . 39 GLU C . 15909 1 26 1JCACO . 1 1 43 43 ASN CA C 13 . . 1 1 43 43 ASN C C 13 . 53.12 . . 0.50 . . . 41 ASN CA . 41 ASN C . 15909 1 27 1JCACO . 1 1 46 46 PRO CA C 13 . . 1 1 46 46 PRO C C 13 . 54.64 . . 0.50 . . . 44 PRO CA . 44 PRO C . 15909 1 28 1JCACO . 1 1 47 47 ALA CA C 13 . . 1 1 47 47 ALA C C 13 . 52.09 . . 0.50 . . . 45 ALA CA . 45 ALA C . 15909 1 29 1JCACO . 1 1 48 48 GLY CA C 13 . . 1 1 48 48 GLY C C 13 . 51.57 . . 0.50 . . . 46 GLY CA . 46 GLY C . 15909 1 30 1JCACO . 1 1 53 53 ILE CA C 13 . . 1 1 53 53 ILE C C 13 . 52.93 . . 0.50 . . . 51 ILE CA . 51 ILE C . 15909 1 31 1JCACO . 1 1 54 54 ASP CA C 13 . . 1 1 54 54 ASP C C 13 . 53.17 . . 0.50 . . . 52 ASP CA . 52 ASP C . 15909 1 32 1JCACO . 1 1 55 55 LEU CA C 13 . . 1 1 55 55 LEU C C 13 . 52.83 . . 0.50 . . . 53 LEU CA . 53 LEU C . 15909 1 33 1JCACO . 1 1 56 56 LYS CA C 13 . . 1 1 56 56 LYS C C 13 . 52.33 . . 0.50 . . . 54 LYS CA . 54 LYS C . 15909 1 34 1JCACO . 1 1 57 57 THR CA C 13 . . 1 1 57 57 THR C C 13 . 53.99 . . 0.50 . . . 55 THR CA . 55 THR C . 15909 1 35 1JCACO . 1 1 59 59 LYS CA C 13 . . 1 1 59 59 LYS C C 13 . 52.47 . . 0.50 . . . 57 LYS CA . 57 LYS C . 15909 1 36 1JCACO . 1 1 60 60 LYS CA C 13 . . 1 1 60 60 LYS C C 13 . 53.09 . . 0.50 . . . 58 LYS CA . 58 LYS C . 15909 1 37 1JCACO . 1 1 61 61 THR CA C 13 . . 1 1 61 61 THR C C 13 . 51.66 . . 0.50 . . . 59 THR CA . 59 THR C . 15909 1 38 1JCACO . 1 1 62 62 VAL CA C 13 . . 1 1 62 62 VAL C C 13 . 52.86 . . 0.50 . . . 60 VAL CA . 60 VAL C . 15909 1 39 1JCACO . 1 1 63 63 ILE CA C 13 . . 1 1 63 63 ILE C C 13 . 54.18 . . 0.50 . . . 61 ILE CA . 61 ILE C . 15909 1 40 1JCACO . 1 1 64 64 CYS CA C 13 . . 1 1 64 64 CYS C C 13 . 53.74 . . 0.50 . . . 62 CYS CA . 62 CYS C . 15909 1 41 1JCACO . 1 1 66 66 PRO CA C 13 . . 1 1 66 66 PRO C C 13 . 53.83 . . 0.50 . . . 64 PRO CA . 64 PRO C . 15909 1 42 1JCACO . 1 1 67 67 GLU CA C 13 . . 1 1 67 67 GLU C C 13 . 52.27 . . 0.50 . . . 65 GLU CA . 65 GLU C . 15909 1 43 1JCACO . 1 1 68 68 VAL CA C 13 . . 1 1 68 68 VAL C C 13 . 53.01 . . 0.50 . . . 66 VAL CA . 66 VAL C . 15909 1 44 1JCACO . 1 1 69 69 ASN CA C 13 . . 1 1 69 69 ASN C C 13 . 52.84 . . 0.50 . . . 67 ASN CA . 67 ASN C . 15909 1 45 1JCACO . 1 1 71 71 TYR CA C 13 . . 1 1 71 71 TYR C C 13 . 53.15 . . 0.50 . . . 69 TYR CA . 69 TYR C . 15909 1 46 1JCACO . 1 1 72 72 GLY CA C 13 . . 1 1 72 72 GLY C C 13 . 51.02 . . 0.50 . . . 70 GLY CA . 70 GLY C . 15909 1 47 1JCACO . 1 1 79 79 GLN CA C 13 . . 1 1 79 79 GLN C C 13 . 51.68 . . 0.50 . . . 77 GLN CA . 77 GLN C . 15909 1 48 1JCACO . 1 1 80 80 CYS CA C 13 . . 1 1 80 80 CYS C C 13 . 52.44 . . 0.50 . . . 78 CYS CA . 78 CYS C . 15909 1 49 1JCACO . 1 1 81 81 ASP CA C 13 . . 1 1 81 81 ASP C C 13 . 51.21 . . 0.50 . . . 79 ASP CA . 79 ASP C . 15909 1 50 1JCACO . 1 1 82 82 ARG CA C 13 . . 1 1 82 82 ARG C C 13 . 52.45 . . 0.50 . . . 80 ARG CA . 80 ARG C . 15909 1 51 1JCACO . 1 1 83 83 ASP CA C 13 . . 1 1 83 83 ASP C C 13 . 53.24 . . 0.50 . . . 81 ASP CA . 81 ASP C . 15909 1 52 1JCACO . 1 1 84 84 ALA CA C 13 . . 1 1 84 84 ALA C C 13 . 50.75 . . 0.50 . . . 82 ALA CA . 82 ALA C . 15909 1 53 1JCACO . 1 1 85 85 ASN CA C 13 . . 1 1 85 85 ASN C C 13 . 53.04 . . 0.50 . . . 83 ASN CA . 83 ASN C . 15909 1 54 1JCACO . 1 1 86 86 GLN CA C 13 . . 1 1 86 86 GLN C C 13 . 50.98 . . 0.50 . . . 84 GLN CA . 84 GLN C . 15909 1 55 1JCACO . 1 1 95 95 GLY CA C 13 . . 1 1 95 95 GLY C C 13 . 53.71 . . 0.50 . . . 93 GLY CA . 93 GLY C . 15909 1 56 1JCACO . 1 1 99 99 VAL CA C 13 . . 1 1 99 99 VAL C C 13 . 53.27 . . 0.50 . . . 97 VAL CA . 97 VAL C . 15909 1 57 1JCACO . 1 1 100 100 GLN CA C 13 . . 1 1 100 100 GLN C C 13 . 51.16 . . 0.50 . . . 98 GLN CA . 98 GLN C . 15909 1 58 1JCACO . 1 1 101 101 THR CA C 13 . . 1 1 101 101 THR C C 13 . 52.98 . . 0.50 . . . 99 THR CA . 99 THR C . 15909 1 59 1JCACO . 1 1 102 102 ASP CA C 13 . . 1 1 102 102 ASP C C 13 . 53.53 . . 0.50 . . . 100 ASP CA . 100 ASP C . 15909 1 60 1JCACO . 1 1 103 103 GLY CA C 13 . . 1 1 103 103 GLY C C 13 . 51.75 . . 0.50 . . . 101 GLY CA . 101 GLY C . 15909 1 61 1JCACO . 1 1 104 104 THR CA C 13 . . 1 1 104 104 THR C C 13 . 52.14 . . 0.50 . . . 102 THR CA . 102 THR C . 15909 1 62 1JCACO . 1 1 105 105 PHE CA C 13 . . 1 1 105 105 PHE C C 13 . 53.35 . . 0.50 . . . 103 PHE CA . 103 PHE C . 15909 1 63 1JCACO . 1 1 106 106 GLU CA C 13 . . 1 1 106 106 GLU C C 13 . 51.42 . . 0.50 . . . 104 GLU CA . 104 GLU C . 15909 1 64 1JCACO . 1 1 107 107 GLU CA C 13 . . 1 1 107 107 GLU C C 13 . 51.74 . . 0.50 . . . 105 GLU CA . 105 GLU C . 15909 1 65 1JCACO . 1 1 108 108 ILE CA C 13 . . 1 1 108 108 ILE C C 13 . 53.59 . . 0.50 . . . 106 ILE CA . 106 ILE C . 15909 1 66 1JCACO . 1 1 110 110 LYS CA C 13 . . 1 1 110 110 LYS C C 13 . 52.26 . . 0.50 . . . 108 LYS CA . 108 LYS C . 15909 1 67 1JCACO . 1 1 111 111 LYS CA C 13 . . 1 1 111 111 LYS C C 13 . 51.19 . . 0.50 . . . 109 LYS CA . 109 LYS C . 15909 1 68 1JCACO . 1 1 112 112 ASP CA C 13 . . 1 1 112 112 ASP C C 13 . 51.80 . . 0.50 . . . 110 ASP CA . 110 ASP C . 15909 1 69 1JCACO . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU C C 13 . 51.93 . . 0.50 . . . 112 GLU CA . 112 GLU C . 15909 1 70 1JCACO . 1 1 115 115 GLY CA C 13 . . 1 1 115 115 GLY C C 13 . 52.18 . . 0.50 . . . 113 GLY CA . 113 GLY C . 15909 1 71 1JCACO . 1 1 116 116 ARG CA C 13 . . 1 1 116 116 ARG C C 13 . 51.46 . . 0.50 . . . 114 ARG CA . 114 ARG C . 15909 1 72 1JCACO . 1 1 117 117 ARG CA C 13 . . 1 1 117 117 ARG C C 13 . 51.85 . . 0.50 . . . 115 ARG CA . 115 ARG C . 15909 1 73 1JCACO . 1 1 119 119 GLN CA C 13 . . 1 1 119 119 GLN C C 13 . 51.45 . . 0.50 . . . 117 GLN CA . 117 GLN C . 15909 1 74 1JCACO . 1 1 125 125 ALA CA C 13 . . 1 1 125 125 ALA C C 13 . 52.97 . . 0.50 . . . 123 ALA CA . 123 ALA C . 15909 1 75 1JCACO . 1 1 127 127 ASP CA C 13 . . 1 1 127 127 ASP C C 13 . 51.13 . . 0.50 . . . 125 ASP CA . 125 ASP C . 15909 1 76 1JCACO . 1 1 128 128 TYR CA C 13 . . 1 1 128 128 TYR C C 13 . 52.87 . . 0.50 . . . 126 TYR CA . 126 TYR C . 15909 1 77 1JCACO . 1 1 129 129 GLU CA C 13 . . 1 1 129 129 GLU C C 13 . 52.12 . . 0.50 . . . 127 GLU CA . 127 GLU C . 15909 1 78 1JCACO . 1 1 137 137 PRO CA C 13 . . 1 1 137 137 PRO C C 13 . 52.23 . . 0.50 . . . 135 PRO CA . 135 PRO C . 15909 1 79 1JCACO . 1 1 138 138 ALA CA C 13 . . 1 1 138 138 ALA C C 13 . 50.54 . . 0.50 . . . 136 ALA CA . 136 ALA C . 15909 1 80 1JCACO . 1 1 139 139 GLY CA C 13 . . 1 1 139 139 GLY C C 13 . 50.34 . . 0.50 . . . 137 GLY CA . 137 GLY C . 15909 1 81 1JCACO . 1 1 140 140 GLU CA C 13 . . 1 1 140 140 GLU C C 13 . 52.00 . . 0.50 . . . 138 GLU CA . 138 GLU C . 15909 1 82 1JCACO . 1 1 141 141 VAL CA C 13 . . 1 1 141 141 VAL C C 13 . 52.88 . . 0.50 . . . 139 VAL CA . 139 VAL C . 15909 1 83 1JCACO . 1 1 143 143 PRO CA C 13 . . 1 1 143 143 PRO C C 13 . 52.38 . . 0.50 . . . 141 PRO CA . 141 PRO C . 15909 1 84 1JCACO . 1 1 144 144 ALA CA C 13 . . 1 1 144 144 ALA C C 13 . 51.08 . . 0.50 . . . 142 ALA CA . 142 ALA C . 15909 1 85 1JCACO . 1 1 145 145 ASP CA C 13 . . 1 1 145 145 ASP C C 13 . 51.73 . . 0.50 . . . 143 ASP CA . 143 ASP C . 15909 1 86 1JCACO . 1 1 146 146 TYR CA C 13 . . 1 1 146 146 TYR C C 13 . 53.72 . . 0.50 . . . 144 TYR CA . 144 TYR C . 15909 1 87 1JCACO . 1 1 147 147 THR CA C 13 . . 1 1 147 147 THR C C 13 . 52.57 . . 0.50 . . . 145 THR CA . 145 THR C . 15909 1 88 1JCACO . 1 1 150 150 MET CA C 13 . . 1 1 150 150 MET C C 13 . 52.81 . . 0.50 . . . 148 MET CA . 148 MET C . 15909 1 89 1JCACO . 1 1 151 151 GLN CA C 13 . . 1 1 151 151 GLN C C 13 . 53.22 . . 0.50 . . . 149 GLN CA . 149 GLN C . 15909 1 90 1JCACO . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU C C 13 . 52.03 . . 0.50 . . . 150 GLU CA . 150 GLU C . 15909 1 91 1JCACO . 1 1 154 154 PHE CA C 13 . . 1 1 154 154 PHE C C 13 . 53.06 . . 0.50 . . . 152 PHE CA . 152 PHE C . 15909 1 92 1JCACO . 1 1 160 160 PHE CA C 13 . . 1 1 160 160 PHE C C 13 . 52.36 . . 0.50 . . . 158 PHE CA . 158 PHE C . 15909 1 93 1JCACO . 1 1 161 161 THR CA C 13 . . 1 1 161 161 THR C C 13 . 52.39 . . 0.50 . . . 159 THR CA . 159 THR C . 15909 1 94 1JCACO . 1 1 162 162 THR CA C 13 . . 1 1 162 162 THR C C 13 . 52.92 . . 0.50 . . . 160 THR CA . 160 THR C . 15909 1 95 1JCACO . 1 1 163 163 ASP CA C 13 . . 1 1 163 163 ASP C C 13 . 52.41 . . 0.50 . . . 161 ASP CA . 161 ASP C . 15909 1 96 1JCACO . 1 1 164 164 GLY CA C 13 . . 1 1 164 164 GLY C C 13 . 52.61 . . 0.50 . . . 162 GLY CA . 162 GLY C . 15909 1 97 1JCACO . 1 1 165 165 GLN CA C 13 . . 1 1 165 165 GLN C C 13 . 52.54 . . 0.50 . . . 163 GLN CA . 163 GLN C . 15909 1 98 1JCACO . 1 1 167 167 ILE CA C 13 . . 1 1 167 167 ILE C C 13 . 53.30 . . 0.50 . . . 165 ILE CA . 165 ILE C . 15909 1 99 1JCACO . 1 1 169 169 VAL CA C 13 . . 1 1 169 169 VAL C C 13 . 52.98 . . 0.50 . . . 167 VAL CA . 167 VAL C . 15909 1 100 1JCACO . 1 1 171 171 THR CA C 13 . . 1 1 171 171 THR C C 13 . 50.43 . . 0.50 . . . 169 THR CA . 169 THR C . 15909 1 101 1JCACO . 1 1 172 172 ALA CA C 13 . . 1 1 172 172 ALA C C 13 . 52.03 . . 0.50 . . . 170 ALA CA . 170 ALA C . 15909 1 102 1JCACO . 1 1 173 173 PHE CA C 13 . . 1 1 173 173 PHE C C 13 . 51.02 . . 0.50 . . . 171 PHE CA . 171 PHE C . 15909 1 103 1JCACO . 1 1 174 174 GLN CA C 13 . . 1 1 174 174 GLN C C 13 . 51.31 . . 0.50 . . . 172 GLN CA . 172 GLN C . 15909 1 104 1JCACO . 1 1 182 182 ARG CA C 13 . . 1 1 182 182 ARG C C 13 . 51.21 . . 0.50 . . . 180 ARG CA . 180 ARG C . 15909 1 105 1JCACO . 1 1 183 183 HIS CA C 13 . . 1 1 183 183 HIS C C 13 . 51.75 . . 0.50 . . . 181 HIS CA . 181 HIS C . 15909 1 106 1JCACO . 1 1 186 186 ASP CA C 13 . . 1 1 186 186 ASP C C 13 . 53.24 . . 0.50 . . . 184 ASP CA . 184 ASP C . 15909 1 107 1JCACO . 1 1 189 189 PRO CA C 13 . . 1 1 189 189 PRO C C 13 . 55.24 . . 0.50 . . . 187 PRO CA . 187 PRO C . 15909 1 108 1JCACO . 1 1 190 190 TYR CA C 13 . . 1 1 190 190 TYR C C 13 . 54.86 . . 0.50 . . . 188 TYR CA . 188 TYR C . 15909 1 109 1JCACO . 1 1 195 195 ALA CA C 13 . . 1 1 195 195 ALA C C 13 . 52.47 . . 0.50 . . . 193 ALA CA . 193 ALA C . 15909 1 110 1JCACO . 1 1 196 196 GLU CA C 13 . . 1 1 196 196 GLU C C 13 . 52.23 . . 0.50 . . . 194 GLU CA . 194 GLU C . 15909 1 111 1JCACO . 1 1 198 198 PRO CA C 13 . . 1 1 198 198 PRO C C 13 . 53.36 . . 0.50 . . . 196 PRO CA . 196 PRO C . 15909 1 112 1JCACO . 1 1 199 199 THR CA C 13 . . 1 1 199 199 THR C C 13 . 51.89 . . 0.50 . . . 197 THR CA . 197 THR C . 15909 1 113 1JCACO . 1 1 200 200 LYS CA C 13 . . 1 1 200 200 LYS C C 13 . 52.28 . . 0.50 . . . 198 LYS CA . 198 LYS C . 15909 1 114 1JCACO . 1 1 201 201 LYS CA C 13 . . 1 1 201 201 LYS C C 13 . 53.68 . . 0.50 . . . 199 LYS CA . 199 LYS C . 15909 1 115 1JCACO . 1 1 205 205 TYR CA C 13 . . 1 1 205 205 TYR C C 13 . 51.02 . . 0.50 . . . 203 TYR CA . 203 TYR C . 15909 1 116 1JCACO . 1 1 206 206 ASP CA C 13 . . 1 1 206 206 ASP C C 13 . 51.52 . . 0.50 . . . 204 ASP CA . 204 ASP C . 15909 1 117 1JCACO . 1 1 207 207 ILE CA C 13 . . 1 1 207 207 ILE C C 13 . 52.89 . . 0.50 . . . 205 ILE CA . 205 ILE C . 15909 1 118 1JCACO . 1 1 208 208 LYS CA C 13 . . 1 1 208 208 LYS C C 13 . 52.59 . . 0.50 . . . 206 LYS CA . 206 LYS C . 15909 1 119 1JCACO . 1 1 210 210 PRO CA C 13 . . 1 1 210 210 PRO C C 13 . 53.93 . . 0.50 . . . 208 PRO CA . 208 PRO C . 15909 1 120 1JCACO . 1 1 211 211 ALA CA C 13 . . 1 1 211 211 ALA C C 13 . 53.00 . . 0.50 . . . 209 ALA CA . 209 ALA C . 15909 1 121 1JCACO . 1 1 212 212 LYS CA C 13 . . 1 1 212 212 LYS C C 13 . 54.25 . . 0.50 . . . 210 LYS CA . 210 LYS C . 15909 1 122 1JCACO . 1 1 213 213 ILE CA C 13 . . 1 1 213 213 ILE C C 13 . 52.70 . . 0.50 . . . 211 ILE CA . 211 ILE C . 15909 1 123 1JCACO . 1 1 214 214 GLU CA C 13 . . 1 1 214 214 GLU C C 13 . 51.20 . . 0.50 . . . 212 GLU CA . 212 GLU C . 15909 1 124 1JCACO . 1 1 215 215 ASN CA C 13 . . 1 1 215 215 ASN C C 13 . 52.35 . . 0.50 . . . 213 ASN CA . 213 ASN C . 15909 1 125 1JCACO . 1 1 216 216 LYS CA C 13 . . 1 1 216 216 LYS C C 13 . 51.85 . . 0.50 . . . 214 LYS CA . 214 LYS C . 15909 1 126 1JCACO . 1 1 217 217 LYS CA C 13 . . 1 1 217 217 LYS C C 13 . 51.96 . . 0.50 . . . 215 LYS CA . 215 LYS C . 15909 1 127 1JCACO . 1 1 218 218 VAL CA C 13 . . 1 1 218 218 VAL C C 13 . 52.39 . . 0.50 . . . 216 VAL CA . 216 VAL C . 15909 1 128 1JCACO . 1 1 219 219 TRP CA C 13 . . 1 1 219 219 TRP C C 13 . 53.64 . . 0.50 . . . 217 TRP CA . 217 TRP C . 15909 1 129 1JCACO . 1 1 220 220 GLY CA C 13 . . 1 1 220 220 GLY C C 13 . 51.61 . . 0.50 . . . 218 GLY CA . 218 GLY C . 15909 1 130 1JCACO . 1 1 221 221 HIS CA C 13 . . 1 1 221 221 HIS C C 13 . 53.27 . . 0.50 . . . 219 HIS CA . 219 HIS C . 15909 1 131 1JCACO . 1 1 223 223 PRO CA C 13 . . 1 1 223 223 PRO C C 13 . 54.02 . . 0.50 . . . 221 PRO CA . 221 PRO C . 15909 1 132 1JCACO . 1 1 225 225 THR CA C 13 . . 1 1 225 225 THR C C 13 . 52.19 . . 0.50 . . . 223 THR CA . 223 THR C . 15909 1 133 1JCACO . 1 1 226 226 HIS CA C 13 . . 1 1 226 226 HIS C C 13 . 51.02 . . 0.50 . . . 224 HIS CA . 224 HIS C . 15909 1 134 1JCACO . 1 1 227 227 GLU CA C 13 . . 1 1 227 227 GLU C C 13 . 52.09 . . 0.50 . . . 225 GLU CA . 225 GLU C . 15909 1 135 1JCACO . 1 1 228 228 GLY CA C 13 . . 1 1 228 228 GLY C C 13 . 51.57 . . 0.50 . . . 226 GLY CA . 226 GLY C . 15909 1 136 1JCACO . 1 1 229 229 GLY CA C 13 . . 1 1 229 229 GLY C C 13 . 50.71 . . 0.50 . . . 227 GLY CA . 227 GLY C . 15909 1 137 1JCACO . 1 1 230 230 ALA CA C 13 . . 1 1 230 230 ALA C C 13 . 53.44 . . 0.50 . . . 228 ALA CA . 228 ALA C . 15909 1 138 1JCACO . 1 1 232 232 GLY CA C 13 . . 1 1 232 232 GLY C C 13 . 53.04 . . 0.50 . . . 230 GLY CA . 230 GLY C . 15909 1 139 1JCACO . 1 1 234 234 ASP CA C 13 . . 1 1 234 234 ASP C C 13 . 52.09 . . 0.50 . . . 232 ASP CA . 232 ASP C . 15909 1 140 1JCACO . 1 1 236 236 ASP CA C 13 . . 1 1 236 236 ASP C C 13 . 51.93 . . 0.50 . . . 234 ASP CA . 234 ASP C . 15909 1 141 1JCACO . 1 1 237 237 GLU CA C 13 . . 1 1 237 237 GLU C C 13 . 53.24 . . 0.50 . . . 235 GLU CA . 235 GLU C . 15909 1 142 1JCACO . 1 1 238 238 ASP CA C 13 . . 1 1 238 238 ASP C C 13 . 50.23 . . 0.50 . . . 236 ASP CA . 236 ASP C . 15909 1 143 1JCACO . 1 1 239 239 ASN CA C 13 . . 1 1 239 239 ASN C C 13 . 53.42 . . 0.50 . . . 237 ASN CA . 237 ASN C . 15909 1 144 1JCACO . 1 1 240 240 ASN CA C 13 . . 1 1 240 240 ASN C C 13 . 52.20 . . 0.50 . . . 238 ASN CA . 238 ASN C . 15909 1 145 1JCACO . 1 1 246 246 TRP CA C 13 . . 1 1 246 246 TRP C C 13 . 52.83 . . 0.50 . . . 244 TRP CA . 244 TRP C . 15909 1 146 1JCACO . 1 1 247 247 GLY CA C 13 . . 1 1 247 247 GLY C C 13 . 52.60 . . 0.50 . . . 245 GLY CA . 245 GLY C . 15909 1 147 1JCACO . 1 1 248 248 SER CA C 13 . . 1 1 248 248 SER C C 13 . 52.69 . . 0.50 . . . 246 SER CA . 246 SER C . 15909 1 148 1JCACO . 1 1 249 249 SER CA C 13 . . 1 1 249 249 SER C C 13 . 51.11 . . 0.50 . . . 247 SER CA . 247 SER C . 15909 1 149 1JCACO . 1 1 254 254 PHE CA C 13 . . 1 1 254 254 PHE C C 13 . 51.99 . . 0.50 . . . 252 PHE CA . 252 PHE C . 15909 1 150 1JCACO . 1 1 256 256 PRO CA C 13 . . 1 1 256 256 PRO C C 13 . 54.49 . . 0.50 . . . 254 PRO CA . 254 PRO C . 15909 1 151 1JCACO . 1 1 257 257 ASP CA C 13 . . 1 1 257 257 ASP C C 13 . 52.31 . . 0.50 . . . 255 ASP CA . 255 ASP C . 15909 1 152 1JCACO . 1 1 259 259 GLY CA C 13 . . 1 1 259 259 GLY C C 13 . 53.38 . . 0.50 . . . 257 GLY CA . 257 GLY C . 15909 1 153 1JCACO . 1 1 261 261 PRO CA C 13 . . 1 1 261 261 PRO C C 13 . 53.81 . . 0.50 . . . 259 PRO CA . 259 PRO C . 15909 1 154 1JCACO . 1 1 262 262 LYS CA C 13 . . 1 1 262 262 LYS C C 13 . 51.22 . . 0.50 . . . 260 LYS CA . 260 LYS C . 15909 1 155 1JCACO . 1 1 263 263 MET CA C 13 . . 1 1 263 263 MET C C 13 . 50.83 . . 0.50 . . . 261 MET CA . 261 MET C . 15909 1 156 1JCACO . 1 1 265 265 ILE CA C 13 . . 1 1 265 265 ILE C C 13 . 52.34 . . 0.50 . . . 263 ILE CA . 263 ILE C . 15909 1 157 1JCACO . 1 1 268 268 PRO CA C 13 . . 1 1 268 268 PRO C C 13 . 52.05 . . 0.50 . . . 266 PRO CA . 266 PRO C . 15909 1 158 1JCACO . 1 1 269 269 PHE CA C 13 . . 1 1 269 269 PHE C C 13 . 52.38 . . 0.50 . . . 267 PHE CA . 267 PHE C . 15909 1 159 1JCACO . 1 1 270 270 GLU CA C 13 . . 1 1 270 270 GLU C C 13 . 52.98 . . 0.50 . . . 268 GLU CA . 268 GLU C . 15909 1 160 1JCACO . 1 1 274 274 ASN CA C 13 . . 1 1 274 274 ASN C C 13 . 52.03 . . 0.50 . . . 272 ASN CA . 272 ASN C . 15909 1 161 1JCACO . 1 1 276 276 HIS CA C 13 . . 1 1 276 276 HIS C C 13 . 52.52 . . 0.50 . . . 274 HIS CA . 274 HIS C . 15909 1 162 1JCACO . 1 1 280 280 GLN CA C 13 . . 1 1 280 280 GLN C C 13 . 52.12 . . 0.50 . . . 278 GLN CA . 278 GLN C . 15909 1 163 1JCACO . 1 1 281 281 THR CA C 13 . . 1 1 281 281 THR C C 13 . 51.86 . . 0.50 . . . 279 THR CA . 279 THR C . 15909 1 164 1JCACO . 1 1 282 282 LYS CA C 13 . . 1 1 282 282 LYS C C 13 . 51.43 . . 0.50 . . . 280 LYS CA . 280 LYS C . 15909 1 165 1JCACO . 1 1 289 289 HIS CA C 13 . . 1 1 289 289 HIS C C 13 . 53.16 . . 0.50 . . . 287 HIS CA . 287 HIS C . 15909 1 166 1JCACO . 1 1 290 290 GLU CA C 13 . . 1 1 290 290 GLU C C 13 . 51.92 . . 0.50 . . . 288 GLU CA . 288 GLU C . 15909 1 167 1JCACO . 1 1 292 292 ASN CA C 13 . . 1 1 292 292 ASN C C 13 . 53.74 . . 0.50 . . . 290 ASN CA . 290 ASN C . 15909 1 168 1JCACO . 1 1 297 297 PHE CA C 13 . . 1 1 297 297 PHE C C 13 . 52.16 . . 0.50 . . . 295 PHE CA . 295 PHE C . 15909 1 169 1JCACO . 1 1 299 299 TRP CA C 13 . . 1 1 299 299 TRP C C 13 . 50.47 . . 0.50 . . . 297 TRP CA . 297 TRP C . 15909 1 170 1JCACO . 1 1 300 300 GLN CA C 13 . . 1 1 300 300 GLN C C 13 . 52.65 . . 0.50 . . . 298 GLN CA . 298 GLN C . 15909 1 171 1JCACO . 1 1 301 301 ARG CA C 13 . . 1 1 301 301 ARG C C 13 . 50.49 . . 0.50 . . . 299 ARG CA . 299 ARG C . 15909 1 172 1JCACO . 1 1 302 302 ASN CA C 13 . . 1 1 302 302 ASN C C 13 . 52.01 . . 0.50 . . . 300 ASN CA . 300 ASN C . 15909 1 173 1JCACO . 1 1 303 303 GLY CA C 13 . . 1 1 303 303 GLY C C 13 . 50.98 . . 0.50 . . . 301 GLY CA . 301 GLY C . 15909 1 174 1JCACO . 1 1 304 304 LYS CA C 13 . . 1 1 304 304 LYS C C 13 . 50.65 . . 0.50 . . . 302 LYS CA . 302 LYS C . 15909 1 175 1JCACO . 1 1 305 305 LYS CA C 13 . . 1 1 305 305 LYS C C 13 . 52.44 . . 0.50 . . . 303 LYS CA . 303 LYS C . 15909 1 176 1JCACO . 1 1 306 306 GLN CA C 13 . . 1 1 306 306 GLN C C 13 . 50.20 . . 0.50 . . . 304 GLN CA . 304 GLN C . 15909 1 177 1JCACO . 1 1 307 307 TYR CA C 13 . . 1 1 307 307 TYR C C 13 . 52.63 . . 0.50 . . . 305 TYR CA . 305 TYR C . 15909 1 178 1JCACO . 1 1 309 309 GLU CA C 13 . . 1 1 309 309 GLU C C 13 . 52.04 . . 0.50 . . . 307 GLU CA . 307 GLU C . 15909 1 179 1JCACO . 1 1 311 311 LEU CA C 13 . . 1 1 311 311 LEU C C 13 . 52.41 . . 0.50 . . . 309 LEU CA . 309 LEU C . 15909 1 stop_ save_ save_1JCaN_ _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 1JCaN_ _Coupling_constant_list.Entry_ID 15909 _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 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 2 '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' . . . 15909 2 3 '3D quantitative J-correlated [15N,1H]-TROSY-HNC' . . . 15909 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 1JCAN . 1 1 4 4 GLU CA C 13 . . 1 1 4 4 GLU N N 15 . 10.60 . . 0.50 . . . 2 GLU CA . 2 GLU N . 15909 2 2 1JCAN . 1 1 5 5 ILE CA C 13 . . 1 1 5 5 ILE N N 15 . 10.79 . . 0.50 . . . 3 ILE CA . 3 ILE N . 15909 2 3 1JCAN . 1 1 7 7 VAL CA C 13 . . 1 1 7 7 VAL N N 15 . 11.32 . . 0.50 . . . 5 VAL CA . 5 VAL N . 15909 2 4 1JCAN . 1 1 8 8 ILE CA C 13 . . 1 1 8 8 ILE N N 15 . 11.01 . . 0.50 . . . 6 ILE CA . 6 ILE N . 15909 2 5 1JCAN . 1 1 9 9 GLU CA C 13 . . 1 1 9 9 GLU N N 15 . 9.06 . . 0.50 . . . 7 GLU CA . 7 GLU N . 15909 2 6 1JCAN . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU N N 15 . 10.71 . . 0.50 . . . 9 LEU CA . 9 LEU N . 15909 2 7 1JCAN . 1 1 12 12 PHE CA C 13 . . 1 1 12 12 PHE N N 15 . 11.42 . . 0.50 . . . 10 PHE CA . 10 PHE N . 15909 2 8 1JCAN . 1 1 13 13 THR CA C 13 . . 1 1 13 13 THR N N 15 . 11.53 . . 0.50 . . . 11 THR CA . 11 THR N . 15909 2 9 1JCAN . 1 1 14 14 LYS CA C 13 . . 1 1 14 14 LYS N N 15 . 11.06 . . 0.50 . . . 12 LYS CA . 12 LYS N . 15909 2 10 1JCAN . 1 1 15 15 VAL CA C 13 . . 1 1 15 15 VAL N N 15 . 9.12 . . 0.50 . . . 13 VAL CA . 13 VAL N . 15909 2 11 1JCAN . 1 1 16 16 THR CA C 13 . . 1 1 16 16 THR N N 15 . 12.37 . . 0.50 . . . 14 THR CA . 14 THR N . 15909 2 12 1JCAN . 1 1 17 17 GLU CA C 13 . . 1 1 17 17 GLU N N 15 . 12.62 . . 0.50 . . . 15 GLU CA . 15 GLU N . 15909 2 13 1JCAN . 1 1 18 18 ASP CA C 13 . . 1 1 18 18 ASP N N 15 . 9.51 . . 0.50 . . . 16 ASP CA . 16 ASP N . 15909 2 14 1JCAN . 1 1 19 19 ILE CA C 13 . . 1 1 19 19 ILE N N 15 . 9.87 . . 0.50 . . . 17 ILE CA . 17 ILE N . 15909 2 15 1JCAN . 1 1 21 21 GLY CA C 13 . . 1 1 21 21 GLY N N 15 . 9.54 . . 0.50 . . . 19 GLY CA . 19 GLY N . 15909 2 16 1JCAN . 1 1 22 22 ALA CA C 13 . . 1 1 22 22 ALA N N 15 . 10.57 . . 0.50 . . . 20 ALA CA . 20 ALA N . 15909 2 17 1JCAN . 1 1 24 24 GLY CA C 13 . . 1 1 24 24 GLY N N 15 . 10.39 . . 0.50 . . . 22 GLY CA . 22 GLY N . 15909 2 18 1JCAN . 1 1 29 29 LYS CA C 13 . . 1 1 29 29 LYS N N 15 . 10.12 . . 0.50 . . . 27 LYS CA . 27 LYS N . 15909 2 19 1JCAN . 1 1 30 30 ASN CA C 13 . . 1 1 30 30 ASN N N 15 . 10.15 . . 0.50 . . . 28 ASN CA . 28 ASN N . 15909 2 20 1JCAN . 1 1 31 31 GLY CA C 13 . . 1 1 31 31 GLY N N 15 . 10.70 . . 0.50 . . . 29 GLY CA . 29 GLY N . 15909 2 21 1JCAN . 1 1 32 32 ASP CA C 13 . . 1 1 32 32 ASP N N 15 . 11.45 . . 0.50 . . . 30 ASP CA . 30 ASP N . 15909 2 22 1JCAN . 1 1 33 33 PHE CA C 13 . . 1 1 33 33 PHE N N 15 . 11.02 . . 0.50 . . . 31 PHE CA . 31 PHE N . 15909 2 23 1JCAN . 1 1 40 40 VAL CA C 13 . . 1 1 40 40 VAL N N 15 . 10.49 . . 0.50 . . . 38 VAL CA . 38 VAL N . 15909 2 24 1JCAN . 1 1 41 41 GLU CA C 13 . . 1 1 41 41 GLU N N 15 . 11.74 . . 0.50 . . . 39 GLU CA . 39 GLU N . 15909 2 25 1JCAN . 1 1 42 42 VAL CA C 13 . . 1 1 42 42 VAL N N 15 . 10.53 . . 0.50 . . . 40 VAL CA . 40 VAL N . 15909 2 26 1JCAN . 1 1 44 44 GLY CA C 13 . . 1 1 44 44 GLY N N 15 . 10.70 . . 0.50 . . . 42 GLY CA . 42 GLY N . 15909 2 27 1JCAN . 1 1 45 45 LYS CA C 13 . . 1 1 45 45 LYS N N 15 . 12.15 . . 0.50 . . . 43 LYS CA . 43 LYS N . 15909 2 28 1JCAN . 1 1 47 47 ALA CA C 13 . . 1 1 47 47 ALA N N 15 . 9.47 . . 0.50 . . . 45 ALA CA . 45 ALA N . 15909 2 29 1JCAN . 1 1 48 48 GLY CA C 13 . . 1 1 48 48 GLY N N 15 . 13.03 . . 0.50 . . . 46 GLY CA . 46 GLY N . 15909 2 30 1JCAN . 1 1 54 54 ASP CA C 13 . . 1 1 54 54 ASP N N 15 . 10.03 . . 0.50 . . . 52 ASP CA . 52 ASP N . 15909 2 31 1JCAN . 1 1 55 55 LEU CA C 13 . . 1 1 55 55 LEU N N 15 . 9.75 . . 0.50 . . . 53 LEU CA . 53 LEU N . 15909 2 32 1JCAN . 1 1 56 56 LYS CA C 13 . . 1 1 56 56 LYS N N 15 . 9.75 . . 0.50 . . . 54 LYS CA . 54 LYS N . 15909 2 33 1JCAN . 1 1 57 57 THR CA C 13 . . 1 1 57 57 THR N N 15 . 10.73 . . 0.50 . . . 55 THR CA . 55 THR N . 15909 2 34 1JCAN . 1 1 58 58 GLY CA C 13 . . 1 1 58 58 GLY N N 15 . 10.14 . . 0.50 . . . 56 GLY CA . 56 GLY N . 15909 2 35 1JCAN . 1 1 59 59 LYS CA C 13 . . 1 1 59 59 LYS N N 15 . 11.86 . . 0.50 . . . 57 LYS CA . 57 LYS N . 15909 2 36 1JCAN . 1 1 60 60 LYS CA C 13 . . 1 1 60 60 LYS N N 15 . 11.48 . . 0.50 . . . 58 LYS CA . 58 LYS N . 15909 2 37 1JCAN . 1 1 61 61 THR CA C 13 . . 1 1 61 61 THR N N 15 . 11.41 . . 0.50 . . . 59 THR CA . 59 THR N . 15909 2 38 1JCAN . 1 1 62 62 VAL CA C 13 . . 1 1 62 62 VAL N N 15 . 10.18 . . 0.50 . . . 60 VAL CA . 60 VAL N . 15909 2 39 1JCAN . 1 1 63 63 ILE CA C 13 . . 1 1 63 63 ILE N N 15 . 9.51 . . 0.50 . . . 61 ILE CA . 61 ILE N . 15909 2 40 1JCAN . 1 1 64 64 CYS CA C 13 . . 1 1 64 64 CYS N N 15 . 12.66 . . 0.50 . . . 62 CYS CA . 62 CYS N . 15909 2 41 1JCAN . 1 1 65 65 LYS CA C 13 . . 1 1 65 65 LYS N N 15 . 8.92 . . 0.50 . . . 63 LYS CA . 63 LYS N . 15909 2 42 1JCAN . 1 1 67 67 GLU CA C 13 . . 1 1 67 67 GLU N N 15 . 11.64 . . 0.50 . . . 65 GLU CA . 65 GLU N . 15909 2 43 1JCAN . 1 1 68 68 VAL CA C 13 . . 1 1 68 68 VAL N N 15 . 10.45 . . 0.50 . . . 66 VAL CA . 66 VAL N . 15909 2 44 1JCAN . 1 1 69 69 ASN CA C 13 . . 1 1 69 69 ASN N N 15 . 9.41 . . 0.50 . . . 67 ASN CA . 67 ASN N . 15909 2 45 1JCAN . 1 1 70 70 GLY CA C 13 . . 1 1 70 70 GLY N N 15 . 10.75 . . 0.50 . . . 68 GLY CA . 68 GLY N . 15909 2 46 1JCAN . 1 1 71 71 TYR CA C 13 . . 1 1 71 71 TYR N N 15 . 10.98 . . 0.50 . . . 69 TYR CA . 69 TYR N . 15909 2 47 1JCAN . 1 1 72 72 GLY CA C 13 . . 1 1 72 72 GLY N N 15 . 12.29 . . 0.50 . . . 70 GLY CA . 70 GLY N . 15909 2 48 1JCAN . 1 1 78 78 CYS CA C 13 . . 1 1 78 78 CYS N N 15 . 13.77 . . 0.50 . . . 76 CYS CA . 76 CYS N . 15909 2 49 1JCAN . 1 1 80 80 CYS CA C 13 . . 1 1 80 80 CYS N N 15 . 10.79 . . 0.50 . . . 78 CYS CA . 78 CYS N . 15909 2 50 1JCAN . 1 1 81 81 ASP CA C 13 . . 1 1 81 81 ASP N N 15 . 12.03 . . 0.50 . . . 79 ASP CA . 79 ASP N . 15909 2 51 1JCAN . 1 1 82 82 ARG CA C 13 . . 1 1 82 82 ARG N N 15 . 10.04 . . 0.50 . . . 80 ARG CA . 80 ARG N . 15909 2 52 1JCAN . 1 1 83 83 ASP CA C 13 . . 1 1 83 83 ASP N N 15 . 9.63 . . 0.50 . . . 81 ASP CA . 81 ASP N . 15909 2 53 1JCAN . 1 1 84 84 ALA CA C 13 . . 1 1 84 84 ALA N N 15 . 12.04 . . 0.50 . . . 82 ALA CA . 82 ALA N . 15909 2 54 1JCAN . 1 1 85 85 ASN CA C 13 . . 1 1 85 85 ASN N N 15 . 10.32 . . 0.50 . . . 83 ASN CA . 83 ASN N . 15909 2 55 1JCAN . 1 1 86 86 GLN CA C 13 . . 1 1 86 86 GLN N N 15 . 12.17 . . 0.50 . . . 84 GLN CA . 84 GLN N . 15909 2 56 1JCAN . 1 1 96 96 LEU CA C 13 . . 1 1 96 96 LEU N N 15 . 10.68 . . 0.50 . . . 94 LEU CA . 94 LEU N . 15909 2 57 1JCAN . 1 1 100 100 GLN CA C 13 . . 1 1 100 100 GLN N N 15 . 11.74 . . 0.50 . . . 98 GLN CA . 98 GLN N . 15909 2 58 1JCAN . 1 1 101 101 THR CA C 13 . . 1 1 101 101 THR N N 15 . 10.73 . . 0.50 . . . 99 THR CA . 99 THR N . 15909 2 59 1JCAN . 1 1 102 102 ASP CA C 13 . . 1 1 102 102 ASP N N 15 . 10.76 . . 0.50 . . . 100 ASP CA . 100 ASP N . 15909 2 60 1JCAN . 1 1 103 103 GLY CA C 13 . . 1 1 103 103 GLY N N 15 . 10.51 . . 0.50 . . . 101 GLY CA . 101 GLY N . 15909 2 61 1JCAN . 1 1 104 104 THR CA C 13 . . 1 1 104 104 THR N N 15 . 12.50 . . 0.50 . . . 102 THR CA . 102 THR N . 15909 2 62 1JCAN . 1 1 105 105 PHE CA C 13 . . 1 1 105 105 PHE N N 15 . 13.00 . . 0.50 . . . 103 PHE CA . 103 PHE N . 15909 2 63 1JCAN . 1 1 106 106 GLU CA C 13 . . 1 1 106 106 GLU N N 15 . 11.86 . . 0.50 . . . 104 GLU CA . 104 GLU N . 15909 2 64 1JCAN . 1 1 107 107 GLU CA C 13 . . 1 1 107 107 GLU N N 15 . 10.69 . . 0.50 . . . 105 GLU CA . 105 GLU N . 15909 2 65 1JCAN . 1 1 108 108 ILE CA C 13 . . 1 1 108 108 ILE N N 15 . 9.81 . . 0.50 . . . 106 ILE CA . 106 ILE N . 15909 2 66 1JCAN . 1 1 109 109 ALA CA C 13 . . 1 1 109 109 ALA N N 15 . 11.19 . . 0.50 . . . 107 ALA CA . 107 ALA N . 15909 2 67 1JCAN . 1 1 110 110 LYS CA C 13 . . 1 1 110 110 LYS N N 15 . 10.25 . . 0.50 . . . 108 LYS CA . 108 LYS N . 15909 2 68 1JCAN . 1 1 112 112 ASP CA C 13 . . 1 1 112 112 ASP N N 15 . 12.60 . . 0.50 . . . 110 ASP CA . 110 ASP N . 15909 2 69 1JCAN . 1 1 113 113 SER CA C 13 . . 1 1 113 113 SER N N 15 . 10.38 . . 0.50 . . . 111 SER CA . 111 SER N . 15909 2 70 1JCAN . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU N N 15 . 10.05 . . 0.50 . . . 112 GLU CA . 112 GLU N . 15909 2 71 1JCAN . 1 1 115 115 GLY CA C 13 . . 1 1 115 115 GLY N N 15 . 10.83 . . 0.50 . . . 113 GLY CA . 113 GLY N . 15909 2 72 1JCAN . 1 1 116 116 ARG CA C 13 . . 1 1 116 116 ARG N N 15 . 11.59 . . 0.50 . . . 114 ARG CA . 114 ARG N . 15909 2 73 1JCAN . 1 1 117 117 ARG CA C 13 . . 1 1 117 117 ARG N N 15 . 11.25 . . 0.50 . . . 115 ARG CA . 115 ARG N . 15909 2 74 1JCAN . 1 1 118 118 MET CA C 13 . . 1 1 118 118 MET N N 15 . 12.00 . . 0.50 . . . 116 MET CA . 116 MET N . 15909 2 75 1JCAN . 1 1 119 119 GLN CA C 13 . . 1 1 119 119 GLN N N 15 . 11.86 . . 0.50 . . . 117 GLN CA . 117 GLN N . 15909 2 76 1JCAN . 1 1 120 120 GLY CA C 13 . . 1 1 120 120 GLY N N 15 . 12.53 . . 0.50 . . . 118 GLY CA . 118 GLY N . 15909 2 77 1JCAN . 1 1 126 126 PHE CA C 13 . . 1 1 126 126 PHE N N 15 . 11.34 . . 0.50 . . . 124 PHE CA . 124 PHE N . 15909 2 78 1JCAN . 1 1 138 138 ALA CA C 13 . . 1 1 138 138 ALA N N 15 . 11.59 . . 0.50 . . . 136 ALA CA . 136 ALA N . 15909 2 79 1JCAN . 1 1 139 139 GLY CA C 13 . . 1 1 139 139 GLY N N 15 . 12.90 . . 0.50 . . . 137 GLY CA . 137 GLY N . 15909 2 80 1JCAN . 1 1 140 140 GLU CA C 13 . . 1 1 140 140 GLU N N 15 . 11.74 . . 0.50 . . . 138 GLU CA . 138 GLU N . 15909 2 81 1JCAN . 1 1 141 141 VAL CA C 13 . . 1 1 141 141 VAL N N 15 . 12.10 . . 0.50 . . . 139 VAL CA . 139 VAL N . 15909 2 82 1JCAN . 1 1 142 142 ALA CA C 13 . . 1 1 142 142 ALA N N 15 . 11.78 . . 0.50 . . . 140 ALA CA . 140 ALA N . 15909 2 83 1JCAN . 1 1 144 144 ALA CA C 13 . . 1 1 144 144 ALA N N 15 . 11.63 . . 0.50 . . . 142 ALA CA . 142 ALA N . 15909 2 84 1JCAN . 1 1 145 145 ASP CA C 13 . . 1 1 145 145 ASP N N 15 . 11.81 . . 0.50 . . . 143 ASP CA . 143 ASP N . 15909 2 85 1JCAN . 1 1 146 146 TYR CA C 13 . . 1 1 146 146 TYR N N 15 . 10.94 . . 0.50 . . . 144 TYR CA . 144 TYR N . 15909 2 86 1JCAN . 1 1 147 147 THR CA C 13 . . 1 1 147 147 THR N N 15 . 12.14 . . 0.50 . . . 145 THR CA . 145 THR N . 15909 2 87 1JCAN . 1 1 148 148 ARG CA C 13 . . 1 1 148 148 ARG N N 15 . 11.80 . . 0.50 . . . 146 ARG CA . 146 ARG N . 15909 2 88 1JCAN . 1 1 149 149 SER CA C 13 . . 1 1 149 149 SER N N 15 . 9.72 . . 0.50 . . . 147 SER CA . 147 SER N . 15909 2 89 1JCAN . 1 1 151 151 GLN CA C 13 . . 1 1 151 151 GLN N N 15 . 9.53 . . 0.50 . . . 149 GLN CA . 149 GLN N . 15909 2 90 1JCAN . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU N N 15 . 11.59 . . 0.50 . . . 150 GLU CA . 150 GLU N . 15909 2 91 1JCAN . 1 1 153 153 LYS CA C 13 . . 1 1 153 153 LYS N N 15 . 9.23 . . 0.50 . . . 151 LYS CA . 151 LYS N . 15909 2 92 1JCAN . 1 1 154 154 PHE CA C 13 . . 1 1 154 154 PHE N N 15 . 10.41 . . 0.50 . . . 152 PHE CA . 152 PHE N . 15909 2 93 1JCAN . 1 1 155 155 GLY CA C 13 . . 1 1 155 155 GLY N N 15 . 12.07 . . 0.50 . . . 153 GLY CA . 153 GLY N . 15909 2 94 1JCAN . 1 1 161 161 THR CA C 13 . . 1 1 161 161 THR N N 15 . 12.81 . . 0.50 . . . 159 THR CA . 159 THR N . 15909 2 95 1JCAN . 1 1 162 162 THR CA C 13 . . 1 1 162 162 THR N N 15 . 10.29 . . 0.50 . . . 160 THR CA . 160 THR N . 15909 2 96 1JCAN . 1 1 164 164 GLY CA C 13 . . 1 1 164 164 GLY N N 15 . 10.51 . . 0.50 . . . 162 GLY CA . 162 GLY N . 15909 2 97 1JCAN . 1 1 165 165 GLN CA C 13 . . 1 1 165 165 GLN N N 15 . 11.55 . . 0.50 . . . 163 GLN CA . 163 GLN N . 15909 2 98 1JCAN . 1 1 166 166 MET CA C 13 . . 1 1 166 166 MET N N 15 . 9.97 . . 0.50 . . . 164 MET CA . 164 MET N . 15909 2 99 1JCAN . 1 1 168 168 GLN CA C 13 . . 1 1 168 168 GLN N N 15 . 10.08 . . 0.50 . . . 166 GLN CA . 166 GLN N . 15909 2 100 1JCAN . 1 1 170 170 ASP CA C 13 . . 1 1 170 170 ASP N N 15 . 13.21 . . 0.50 . . . 168 ASP CA . 168 ASP N . 15909 2 101 1JCAN . 1 1 171 171 THR CA C 13 . . 1 1 171 171 THR N N 15 . 12.62 . . 0.50 . . . 169 THR CA . 169 THR N . 15909 2 102 1JCAN . 1 1 172 172 ALA CA C 13 . . 1 1 172 172 ALA N N 15 . 10.09 . . 0.50 . . . 170 ALA CA . 170 ALA N . 15909 2 103 1JCAN . 1 1 173 173 PHE CA C 13 . . 1 1 173 173 PHE N N 15 . 12.26 . . 0.50 . . . 171 PHE CA . 171 PHE N . 15909 2 104 1JCAN . 1 1 174 174 GLN CA C 13 . . 1 1 174 174 GLN N N 15 . 8.77 . . 0.50 . . . 172 GLN CA . 172 GLN N . 15909 2 105 1JCAN . 1 1 175 175 PHE CA C 13 . . 1 1 175 175 PHE N N 15 . 8.89 . . 0.50 . . . 173 PHE CA . 173 PHE N . 15909 2 106 1JCAN . 1 1 181 181 VAL CA C 13 . . 1 1 181 181 VAL N N 15 . 11.36 . . 0.50 . . . 179 VAL CA . 179 VAL N . 15909 2 107 1JCAN . 1 1 183 183 HIS CA C 13 . . 1 1 183 183 HIS N N 15 . 11.56 . . 0.50 . . . 181 HIS CA . 181 HIS N . 15909 2 108 1JCAN . 1 1 184 184 MET CA C 13 . . 1 1 184 184 MET N N 15 . 11.49 . . 0.50 . . . 182 MET CA . 182 MET N . 15909 2 109 1JCAN . 1 1 186 186 ASP CA C 13 . . 1 1 186 186 ASP N N 15 . 11.03 . . 0.50 . . . 184 ASP CA . 184 ASP N . 15909 2 110 1JCAN . 1 1 187 187 GLY CA C 13 . . 1 1 187 187 GLY N N 15 . 10.68 . . 0.50 . . . 185 GLY CA . 185 GLY N . 15909 2 111 1JCAN . 1 1 188 188 ARG CA C 13 . . 1 1 188 188 ARG N N 15 . 11.42 . . 0.50 . . . 186 ARG CA . 186 ARG N . 15909 2 112 1JCAN . 1 1 190 190 TYR CA C 13 . . 1 1 190 190 TYR N N 15 . 9.57 . . 0.50 . . . 188 TYR CA . 188 TYR N . 15909 2 113 1JCAN . 1 1 191 191 GLN CA C 13 . . 1 1 191 191 GLN N N 15 . 11.80 . . 0.50 . . . 189 GLN CA . 189 GLN N . 15909 2 114 1JCAN . 1 1 196 196 GLU CA C 13 . . 1 1 196 196 GLU N N 15 . 9.48 . . 0.50 . . . 194 GLU CA . 194 GLU N . 15909 2 115 1JCAN . 1 1 199 199 THR CA C 13 . . 1 1 199 199 THR N N 15 . 10.48 . . 0.50 . . . 197 THR CA . 197 THR N . 15909 2 116 1JCAN . 1 1 200 200 LYS CA C 13 . . 1 1 200 200 LYS N N 15 . 9.50 . . 0.50 . . . 198 LYS CA . 198 LYS N . 15909 2 117 1JCAN . 1 1 206 206 ASP CA C 13 . . 1 1 206 206 ASP N N 15 . 10.69 . . 0.50 . . . 204 ASP CA . 204 ASP N . 15909 2 118 1JCAN . 1 1 207 207 ILE CA C 13 . . 1 1 207 207 ILE N N 15 . 10.83 . . 0.50 . . . 205 ILE CA . 205 ILE N . 15909 2 119 1JCAN . 1 1 208 208 LYS CA C 13 . . 1 1 208 208 LYS N N 15 . 9.61 . . 0.50 . . . 206 LYS CA . 206 LYS N . 15909 2 120 1JCAN . 1 1 209 209 GLY CA C 13 . . 1 1 209 209 GLY N N 15 . 14.00 . . 0.50 . . . 207 GLY CA . 207 GLY N . 15909 2 121 1JCAN . 1 1 211 211 ALA CA C 13 . . 1 1 211 211 ALA N N 15 . 10.19 . . 0.50 . . . 209 ALA CA . 209 ALA N . 15909 2 122 1JCAN . 1 1 212 212 LYS CA C 13 . . 1 1 212 212 LYS N N 15 . 9.80 . . 0.50 . . . 210 LYS CA . 210 LYS N . 15909 2 123 1JCAN . 1 1 213 213 ILE CA C 13 . . 1 1 213 213 ILE N N 15 . 11.25 . . 0.50 . . . 211 ILE CA . 211 ILE N . 15909 2 124 1JCAN . 1 1 214 214 GLU CA C 13 . . 1 1 214 214 GLU N N 15 . 12.46 . . 0.50 . . . 212 GLU CA . 212 GLU N . 15909 2 125 1JCAN . 1 1 215 215 ASN CA C 13 . . 1 1 215 215 ASN N N 15 . 9.82 . . 0.50 . . . 213 ASN CA . 213 ASN N . 15909 2 126 1JCAN . 1 1 216 216 LYS CA C 13 . . 1 1 216 216 LYS N N 15 . 11.27 . . 0.50 . . . 214 LYS CA . 214 LYS N . 15909 2 127 1JCAN . 1 1 217 217 LYS CA C 13 . . 1 1 217 217 LYS N N 15 . 12.50 . . 0.50 . . . 215 LYS CA . 215 LYS N . 15909 2 128 1JCAN . 1 1 219 219 TRP CA C 13 . . 1 1 219 219 TRP N N 15 . 9.72 . . 0.50 . . . 217 TRP CA . 217 TRP N . 15909 2 129 1JCAN . 1 1 220 220 GLY CA C 13 . . 1 1 220 220 GLY N N 15 . 13.47 . . 0.50 . . . 218 GLY CA . 218 GLY N . 15909 2 130 1JCAN . 1 1 221 221 HIS CA C 13 . . 1 1 221 221 HIS N N 15 . 11.45 . . 0.50 . . . 219 HIS CA . 219 HIS N . 15909 2 131 1JCAN . 1 1 222 222 ILE CA C 13 . . 1 1 222 222 ILE N N 15 . 10.64 . . 0.50 . . . 220 ILE CA . 220 ILE N . 15909 2 132 1JCAN . 1 1 224 224 GLY CA C 13 . . 1 1 224 224 GLY N N 15 . 13.09 . . 0.50 . . . 222 GLY CA . 222 GLY N . 15909 2 133 1JCAN . 1 1 225 225 THR CA C 13 . . 1 1 225 225 THR N N 15 . 10.84 . . 0.50 . . . 223 THR CA . 223 THR N . 15909 2 134 1JCAN . 1 1 226 226 HIS CA C 13 . . 1 1 226 226 HIS N N 15 . 12.34 . . 0.50 . . . 224 HIS CA . 224 HIS N . 15909 2 135 1JCAN . 1 1 227 227 GLU CA C 13 . . 1 1 227 227 GLU N N 15 . 10.76 . . 0.50 . . . 225 GLU CA . 225 GLU N . 15909 2 136 1JCAN . 1 1 228 228 GLY CA C 13 . . 1 1 228 228 GLY N N 15 . 12.64 . . 0.50 . . . 226 GLY CA . 226 GLY N . 15909 2 137 1JCAN . 1 1 229 229 GLY CA C 13 . . 1 1 229 229 GLY N N 15 . 13.17 . . 0.50 . . . 227 GLY CA . 227 GLY N . 15909 2 138 1JCAN . 1 1 230 230 ALA CA C 13 . . 1 1 230 230 ALA N N 15 . 11.08 . . 0.50 . . . 228 ALA CA . 228 ALA N . 15909 2 139 1JCAN . 1 1 235 235 PHE CA C 13 . . 1 1 235 235 PHE N N 15 . 11.89 . . 0.50 . . . 233 PHE CA . 233 PHE N . 15909 2 140 1JCAN . 1 1 237 237 GLU CA C 13 . . 1 1 237 237 GLU N N 15 . 9.70 . . 0.50 . . . 235 GLU CA . 235 GLU N . 15909 2 141 1JCAN . 1 1 238 238 ASP CA C 13 . . 1 1 238 238 ASP N N 15 . 9.73 . . 0.50 . . . 236 ASP CA . 236 ASP N . 15909 2 142 1JCAN . 1 1 239 239 ASN CA C 13 . . 1 1 239 239 ASN N N 15 . 10.17 . . 0.50 . . . 237 ASN CA . 237 ASN N . 15909 2 143 1JCAN . 1 1 240 240 ASN CA C 13 . . 1 1 240 240 ASN N N 15 . 11.83 . . 0.50 . . . 238 ASN CA . 238 ASN N . 15909 2 144 1JCAN . 1 1 247 247 GLY CA C 13 . . 1 1 247 247 GLY N N 15 . 10.12 . . 0.50 . . . 245 GLY CA . 245 GLY N . 15909 2 145 1JCAN . 1 1 248 248 SER CA C 13 . . 1 1 248 248 SER N N 15 . 10.61 . . 0.50 . . . 246 SER CA . 246 SER N . 15909 2 146 1JCAN . 1 1 249 249 SER CA C 13 . . 1 1 249 249 SER N N 15 . 9.24 . . 0.50 . . . 247 SER CA . 247 SER N . 15909 2 147 1JCAN . 1 1 250 250 HIS CA C 13 . . 1 1 250 250 HIS N N 15 . 12.47 . . 0.50 . . . 248 HIS CA . 248 HIS N . 15909 2 148 1JCAN . 1 1 255 255 GLY CA C 13 . . 1 1 255 255 GLY N N 15 . 11.87 . . 0.50 . . . 253 GLY CA . 253 GLY N . 15909 2 149 1JCAN . 1 1 257 257 ASP CA C 13 . . 1 1 257 257 ASP N N 15 . 10.59 . . 0.50 . . . 255 ASP CA . 255 ASP N . 15909 2 150 1JCAN . 1 1 258 258 GLY CA C 13 . . 1 1 258 258 GLY N N 15 . 12.93 . . 0.50 . . . 256 GLY CA . 256 GLY N . 15909 2 151 1JCAN . 1 1 259 259 GLY CA C 13 . . 1 1 259 259 GLY N N 15 . 11.13 . . 0.50 . . . 257 GLY CA . 257 GLY N . 15909 2 152 1JCAN . 1 1 260 260 GLN CA C 13 . . 1 1 260 260 GLN N N 15 . 11.88 . . 0.50 . . . 258 GLN CA . 258 GLN N . 15909 2 153 1JCAN . 1 1 262 262 LYS CA C 13 . . 1 1 262 262 LYS N N 15 . 10.23 . . 0.50 . . . 260 LYS CA . 260 LYS N . 15909 2 154 1JCAN . 1 1 264 264 ARG CA C 13 . . 1 1 264 264 ARG N N 15 . 11.86 . . 0.50 . . . 262 ARG CA . 262 ARG N . 15909 2 155 1JCAN . 1 1 266 266 ARG CA C 13 . . 1 1 266 266 ARG N N 15 . 10.66 . . 0.50 . . . 264 ARG CA . 264 ARG N . 15909 2 156 1JCAN . 1 1 269 269 PHE CA C 13 . . 1 1 269 269 PHE N N 15 . 13.33 . . 0.50 . . . 267 PHE CA . 267 PHE N . 15909 2 157 1JCAN . 1 1 270 270 GLU CA C 13 . . 1 1 270 270 GLU N N 15 . 9.64 . . 0.50 . . . 268 GLU CA . 268 GLU N . 15909 2 158 1JCAN . 1 1 271 271 LYS CA C 13 . . 1 1 271 271 LYS N N 15 . 9.62 . . 0.50 . . . 269 LYS CA . 269 LYS N . 15909 2 159 1JCAN . 1 1 275 275 LEU CA C 13 . . 1 1 275 275 LEU N N 15 . 12.49 . . 0.50 . . . 273 LEU CA . 273 LEU N . 15909 2 160 1JCAN . 1 1 277 277 PHE CA C 13 . . 1 1 277 277 PHE N N 15 . 11.18 . . 0.50 . . . 275 PHE CA . 275 PHE N . 15909 2 161 1JCAN . 1 1 280 280 GLN CA C 13 . . 1 1 280 280 GLN N N 15 . 9.61 . . 0.50 . . . 278 GLN CA . 278 GLN N . 15909 2 162 1JCAN . 1 1 281 281 THR CA C 13 . . 1 1 281 281 THR N N 15 . 13.33 . . 0.50 . . . 279 THR CA . 279 THR N . 15909 2 163 1JCAN . 1 1 282 282 LYS CA C 13 . . 1 1 282 282 LYS N N 15 . 10.24 . . 0.50 . . . 280 LYS CA . 280 LYS N . 15909 2 164 1JCAN . 1 1 283 283 THR CA C 13 . . 1 1 283 283 THR N N 15 . 12.07 . . 0.50 . . . 281 THR CA . 281 THR N . 15909 2 165 1JCAN . 1 1 289 289 HIS CA C 13 . . 1 1 289 289 HIS N N 15 . 9.99 . . 0.50 . . . 287 HIS CA . 287 HIS N . 15909 2 166 1JCAN . 1 1 290 290 GLU CA C 13 . . 1 1 290 290 GLU N N 15 . 8.45 . . 0.50 . . . 288 GLU CA . 288 GLU N . 15909 2 167 1JCAN . 1 1 291 291 ASN CA C 13 . . 1 1 291 291 ASN N N 15 . 10.50 . . 0.50 . . . 289 ASN CA . 289 ASN N . 15909 2 168 1JCAN . 1 1 292 292 ASN CA C 13 . . 1 1 292 292 ASN N N 15 . 9.18 . . 0.50 . . . 290 ASN CA . 290 ASN N . 15909 2 169 1JCAN . 1 1 293 293 ALA CA C 13 . . 1 1 293 293 ALA N N 15 . 13.46 . . 0.50 . . . 291 ALA CA . 291 ALA N . 15909 2 170 1JCAN . 1 1 298 298 GLU CA C 13 . . 1 1 298 298 GLU N N 15 . 11.00 . . 0.50 . . . 296 GLU CA . 296 GLU N . 15909 2 171 1JCAN . 1 1 300 300 GLN CA C 13 . . 1 1 300 300 GLN N N 15 . 9.99 . . 0.50 . . . 298 GLN CA . 298 GLN N . 15909 2 172 1JCAN . 1 1 301 301 ARG CA C 13 . . 1 1 301 301 ARG N N 15 . 12.62 . . 0.50 . . . 299 ARG CA . 299 ARG N . 15909 2 173 1JCAN . 1 1 302 302 ASN CA C 13 . . 1 1 302 302 ASN N N 15 . 12.57 . . 0.50 . . . 300 ASN CA . 300 ASN N . 15909 2 174 1JCAN . 1 1 303 303 GLY CA C 13 . . 1 1 303 303 GLY N N 15 . 13.32 . . 0.50 . . . 301 GLY CA . 301 GLY N . 15909 2 175 1JCAN . 1 1 304 304 LYS CA C 13 . . 1 1 304 304 LYS N N 15 . 10.94 . . 0.50 . . . 302 LYS CA . 302 LYS N . 15909 2 176 1JCAN . 1 1 305 305 LYS CA C 13 . . 1 1 305 305 LYS N N 15 . 11.18 . . 0.50 . . . 303 LYS CA . 303 LYS N . 15909 2 177 1JCAN . 1 1 306 306 GLN CA C 13 . . 1 1 306 306 GLN N N 15 . 12.06 . . 0.50 . . . 304 GLN CA . 304 GLN N . 15909 2 178 1JCAN . 1 1 307 307 TYR CA C 13 . . 1 1 307 307 TYR N N 15 . 9.84 . . 0.50 . . . 305 TYR CA . 305 TYR N . 15909 2 179 1JCAN . 1 1 308 308 CYS CA C 13 . . 1 1 308 308 CYS N N 15 . 10.93 . . 0.50 . . . 306 CYS CA . 306 CYS N . 15909 2 180 1JCAN . 1 1 309 309 GLU CA C 13 . . 1 1 309 309 GLU N N 15 . 9.73 . . 0.50 . . . 307 GLU CA . 307 GLU N . 15909 2 181 1JCAN . 1 1 310 310 THR CA C 13 . . 1 1 310 310 THR N N 15 . 12.13 . . 0.50 . . . 308 THR CA . 308 THR N . 15909 2 182 1JCAN . 1 1 311 311 LEU CA C 13 . . 1 1 311 311 LEU N N 15 . 11.06 . . 0.50 . . . 309 LEU CA . 309 LEU N . 15909 2 183 1JCAN . 1 1 312 312 LYS CA C 13 . . 1 1 312 312 LYS N N 15 . 10.49 . . 0.50 . . . 310 LYS CA . 310 LYS N . 15909 2 184 1JCAN . 1 1 313 313 PHE CA C 13 . . 1 1 313 313 PHE N N 15 . 10.69 . . 0.50 . . . 311 PHE CA . 311 PHE N . 15909 2 185 1JCAN . 1 1 314 314 GLY CA C 13 . . 1 1 314 314 GLY N N 15 . 11.62 . . 0.50 . . . 312 GLY CA . 312 GLY N . 15909 2 186 1JCAN . 1 1 315 315 ILE CA C 13 . . 1 1 315 315 ILE N N 15 . 10.34 . . 0.50 . . . 313 ILE CA . 313 ILE N . 15909 2 187 1JCAN . 1 1 316 316 PHE CA C 13 . . 1 1 316 316 PHE N N 15 . 10.65 . . 0.50 . . . 314 PHE CA . 314 PHE N . 15909 2 stop_ save_ save_1JCaHa _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 1JCaHa _Coupling_constant_list.Entry_ID 15909 _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 '14-ms variable-time Ca evolution in 3D TROSY experiments' _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 Ca-coupled HA(CACO)NH' . . . 15909 3 6 '3D Ha-coupled [15N,1H]-TROSY-HNCA' . . . 15909 3 7 '3D Ha-coupled [15N,1H]-TROSY-iHNCA' . . . 15909 3 8 '3D Ha-coupled [15N,1H]-TROSY-HN(CO)CA' . . . 15909 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 1JCAHA . 1 1 3 3 MET CA C 13 . . 1 1 3 3 MET HA H 1 . 143.52 . . 0.50 . . . 1 MET CA . 1 MET HA . 15909 3 2 1JCAHA . 1 1 4 4 GLU CA C 13 . . 1 1 4 4 GLU HA H 1 . 142.75 . . 0.50 . . . 2 GLU CA . 2 GLU HA . 15909 3 3 1JCAHA . 1 1 5 5 ILE CA C 13 . . 1 1 5 5 ILE HA H 1 . 140.05 . . 0.50 . . . 3 ILE CA . 3 ILE HA . 15909 3 4 1JCAHA . 1 1 6 6 PRO CA C 13 . . 1 1 6 6 PRO HA H 1 . 145.93 . . 0.50 . . . 4 PRO CA . 4 PRO HA . 15909 3 5 1JCAHA . 1 1 7 7 VAL CA C 13 . . 1 1 7 7 VAL HA H 1 . 141.89 . . 0.50 . . . 5 VAL CA . 5 VAL HA . 15909 3 6 1JCAHA . 1 1 8 8 ILE CA C 13 . . 1 1 8 8 ILE HA H 1 . 139.95 . . 0.50 . . . 6 ILE CA . 6 ILE HA . 15909 3 7 1JCAHA . 1 1 9 9 GLU CA C 13 . . 1 1 9 9 GLU HA H 1 . 139.87 . . 0.50 . . . 7 GLU CA . 7 GLU HA . 15909 3 8 1JCAHA . 1 1 10 10 PRO CA C 13 . . 1 1 10 10 PRO HA H 1 . 145.76 . . 0.50 . . . 8 PRO CA . 8 PRO HA . 15909 3 9 1JCAHA . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU HA H 1 . 143.89 . . 0.50 . . . 9 LEU CA . 9 LEU HA . 15909 3 10 1JCAHA . 1 1 12 12 PHE CA C 13 . . 1 1 12 12 PHE HA H 1 . 143.04 . . 0.50 . . . 10 PHE CA . 10 PHE HA . 15909 3 11 1JCAHA . 1 1 13 13 THR CA C 13 . . 1 1 13 13 THR HA H 1 . 141.47 . . 0.50 . . . 11 THR CA . 11 THR HA . 15909 3 12 1JCAHA . 1 1 14 14 LYS CA C 13 . . 1 1 14 14 LYS HA H 1 . 139.85 . . 0.50 . . . 12 LYS CA . 12 LYS HA . 15909 3 13 1JCAHA . 1 1 15 15 VAL CA C 13 . . 1 1 15 15 VAL HA H 1 . 144.26 . . 0.50 . . . 13 VAL CA . 13 VAL HA . 15909 3 14 1JCAHA . 1 1 16 16 THR CA C 13 . . 1 1 16 16 THR HA H 1 . 143.51 . . 0.50 . . . 14 THR CA . 14 THR HA . 15909 3 15 1JCAHA . 1 1 17 17 GLU CA C 13 . . 1 1 17 17 GLU HA H 1 . 140.20 . . 0.50 . . . 15 GLU CA . 15 GLU HA . 15909 3 16 1JCAHA . 1 1 18 18 ASP CA C 13 . . 1 1 18 18 ASP HA H 1 . 141.53 . . 0.50 . . . 16 ASP CA . 16 ASP HA . 15909 3 17 1JCAHA . 1 1 19 19 ILE CA C 13 . . 1 1 19 19 ILE HA H 1 . 137.97 . . 0.50 . . . 17 ILE CA . 17 ILE HA . 15909 3 18 1JCAHA . 1 1 20 20 PRO CA C 13 . . 1 1 20 20 PRO HA H 1 . 144.65 . . 0.50 . . . 18 PRO CA . 18 PRO HA . 15909 3 19 1JCAHA . 1 1 22 22 ALA CA C 13 . . 1 1 22 22 ALA HA H 1 . 141.28 . . 0.50 . . . 20 ALA CA . 20 ALA HA . 15909 3 20 1JCAHA . 1 1 23 23 GLU CA C 13 . . 1 1 23 23 GLU HA H 1 . 140.16 . . 0.50 . . . 21 GLU CA . 21 GLU HA . 15909 3 21 1JCAHA . 1 1 26 26 VAL CA C 13 . . 1 1 26 26 VAL HA H 1 . 145.06 . . 0.50 . . . 24 VAL CA . 24 VAL HA . 15909 3 22 1JCAHA . 1 1 27 27 PHE CA C 13 . . 1 1 27 27 PHE HA H 1 . 147.13 . . 0.50 . . . 25 PHE CA . 25 PHE HA . 15909 3 23 1JCAHA . 1 1 28 28 ASP CA C 13 . . 1 1 28 28 ASP HA H 1 . 140.35 . . 0.50 . . . 26 ASP CA . 26 ASP HA . 15909 3 24 1JCAHA . 1 1 29 29 LYS CA C 13 . . 1 1 29 29 LYS HA H 1 . 144.44 . . 0.50 . . . 27 LYS CA . 27 LYS HA . 15909 3 25 1JCAHA . 1 1 30 30 ASN CA C 13 . . 1 1 30 30 ASN HA H 1 . 146.07 . . 0.50 . . . 28 ASN CA . 28 ASN HA . 15909 3 26 1JCAHA . 1 1 32 32 ASP CA C 13 . . 1 1 32 32 ASP HA H 1 . 142.72 . . 0.50 . . . 30 ASP CA . 30 ASP HA . 15909 3 27 1JCAHA . 1 1 33 33 PHE CA C 13 . . 1 1 33 33 PHE HA H 1 . 139.00 . . 0.50 . . . 31 PHE CA . 31 PHE HA . 15909 3 28 1JCAHA . 1 1 34 34 TYR CA C 13 . . 1 1 34 34 TYR HA H 1 . 142.88 . . 0.50 . . . 32 TYR CA . 32 TYR HA . 15909 3 29 1JCAHA . 1 1 35 35 ILE CA C 13 . . 1 1 35 35 ILE HA H 1 . 146.28 . . 0.50 . . . 33 ILE CA . 33 ILE HA . 15909 3 30 1JCAHA . 1 1 39 39 GLU CA C 13 . . 1 1 39 39 GLU HA H 1 . 141.63 . . 0.50 . . . 37 GLU CA . 37 GLU HA . 15909 3 31 1JCAHA . 1 1 40 40 VAL CA C 13 . . 1 1 40 40 VAL HA H 1 . 141.32 . . 0.50 . . . 38 VAL CA . 38 VAL HA . 15909 3 32 1JCAHA . 1 1 41 41 GLU CA C 13 . . 1 1 41 41 GLU HA H 1 . 142.65 . . 0.50 . . . 39 GLU CA . 39 GLU HA . 15909 3 33 1JCAHA . 1 1 42 42 VAL CA C 13 . . 1 1 42 42 VAL HA H 1 . 139.82 . . 0.50 . . . 40 VAL CA . 40 VAL HA . 15909 3 34 1JCAHA . 1 1 45 45 LYS CA C 13 . . 1 1 45 45 LYS HA H 1 . 139.54 . . 0.50 . . . 43 LYS CA . 43 LYS HA . 15909 3 35 1JCAHA . 1 1 46 46 PRO CA C 13 . . 1 1 46 46 PRO HA H 1 . 145.99 . . 0.50 . . . 44 PRO CA . 44 PRO HA . 15909 3 36 1JCAHA . 1 1 47 47 ALA CA C 13 . . 1 1 47 47 ALA HA H 1 . 140.75 . . 0.50 . . . 45 ALA CA . 45 ALA HA . 15909 3 37 1JCAHA . 1 1 49 49 GLU CA C 13 . . 1 1 49 49 GLU HA H 1 . 141.06 . . 0.50 . . . 47 GLU CA . 47 GLU HA . 15909 3 38 1JCAHA . 1 1 50 50 ILE CA C 13 . . 1 1 50 50 ILE HA H 1 . 139.85 . . 0.50 . . . 48 ILE CA . 48 ILE HA . 15909 3 39 1JCAHA . 1 1 51 51 LEU CA C 13 . . 1 1 51 51 LEU HA H 1 . 143.72 . . 0.50 . . . 49 LEU CA . 49 LEU HA . 15909 3 40 1JCAHA . 1 1 52 52 ARG CA C 13 . . 1 1 52 52 ARG HA H 1 . 142.38 . . 0.50 . . . 50 ARG CA . 50 ARG HA . 15909 3 41 1JCAHA . 1 1 53 53 ILE CA C 13 . . 1 1 53 53 ILE HA H 1 . 139.56 . . 0.50 . . . 51 ILE CA . 51 ILE HA . 15909 3 42 1JCAHA . 1 1 54 54 ASP CA C 13 . . 1 1 54 54 ASP HA H 1 . 141.82 . . 0.50 . . . 52 ASP CA . 52 ASP HA . 15909 3 43 1JCAHA . 1 1 55 55 LEU CA C 13 . . 1 1 55 55 LEU HA H 1 . 145.05 . . 0.50 . . . 53 LEU CA . 53 LEU HA . 15909 3 44 1JCAHA . 1 1 56 56 LYS CA C 13 . . 1 1 56 56 LYS HA H 1 . 144.96 . . 0.50 . . . 54 LYS CA . 54 LYS HA . 15909 3 45 1JCAHA . 1 1 57 57 THR CA C 13 . . 1 1 57 57 THR HA H 1 . 143.21 . . 0.50 . . . 55 THR CA . 55 THR HA . 15909 3 46 1JCAHA . 1 1 59 59 LYS CA C 13 . . 1 1 59 59 LYS HA H 1 . 142.74 . . 0.50 . . . 57 LYS CA . 57 LYS HA . 15909 3 47 1JCAHA . 1 1 60 60 LYS CA C 13 . . 1 1 60 60 LYS HA H 1 . 140.45 . . 0.50 . . . 58 LYS CA . 58 LYS HA . 15909 3 48 1JCAHA . 1 1 61 61 THR CA C 13 . . 1 1 61 61 THR HA H 1 . 140.52 . . 0.50 . . . 59 THR CA . 59 THR HA . 15909 3 49 1JCAHA . 1 1 62 62 VAL CA C 13 . . 1 1 62 62 VAL HA H 1 . 140.31 . . 0.50 . . . 60 VAL CA . 60 VAL HA . 15909 3 50 1JCAHA . 1 1 63 63 ILE CA C 13 . . 1 1 63 63 ILE HA H 1 . 140.19 . . 0.50 . . . 61 ILE CA . 61 ILE HA . 15909 3 51 1JCAHA . 1 1 64 64 CYS CA C 13 . . 1 1 64 64 CYS HA H 1 . 146.52 . . 0.50 . . . 62 CYS CA . 62 CYS HA . 15909 3 52 1JCAHA . 1 1 65 65 LYS CA C 13 . . 1 1 65 65 LYS HA H 1 . 141.53 . . 0.50 . . . 63 LYS CA . 63 LYS HA . 15909 3 53 1JCAHA . 1 1 66 66 PRO CA C 13 . . 1 1 66 66 PRO HA H 1 . 147.49 . . 0.50 . . . 64 PRO CA . 64 PRO HA . 15909 3 54 1JCAHA . 1 1 67 67 GLU CA C 13 . . 1 1 67 67 GLU HA H 1 . 143.32 . . 0.50 . . . 65 GLU CA . 65 GLU HA . 15909 3 55 1JCAHA . 1 1 68 68 VAL CA C 13 . . 1 1 68 68 VAL HA H 1 . 141.06 . . 0.50 . . . 66 VAL CA . 66 VAL HA . 15909 3 56 1JCAHA . 1 1 71 71 TYR CA C 13 . . 1 1 71 71 TYR HA H 1 . 144.44 . . 0.50 . . . 69 TYR CA . 69 TYR HA . 15909 3 57 1JCAHA . 1 1 75 75 PRO CA C 13 . . 1 1 75 75 PRO HA H 1 . 145.99 . . 0.50 . . . 73 PRO CA . 73 PRO HA . 15909 3 58 1JCAHA . 1 1 76 76 ALA CA C 13 . . 1 1 76 76 ALA HA H 1 . 141.11 . . 0.50 . . . 74 ALA CA . 74 ALA HA . 15909 3 59 1JCAHA . 1 1 78 78 CYS CA C 13 . . 1 1 78 78 CYS HA H 1 . 145.53 . . 0.50 . . . 76 CYS CA . 76 CYS HA . 15909 3 60 1JCAHA . 1 1 79 79 GLN CA C 13 . . 1 1 79 79 GLN HA H 1 . 146.20 . . 0.50 . . . 77 GLN CA . 77 GLN HA . 15909 3 61 1JCAHA . 1 1 80 80 CYS CA C 13 . . 1 1 80 80 CYS HA H 1 . 142.18 . . 0.50 . . . 78 CYS CA . 78 CYS HA . 15909 3 62 1JCAHA . 1 1 81 81 ASP CA C 13 . . 1 1 81 81 ASP HA H 1 . 142.71 . . 0.50 . . . 79 ASP CA . 79 ASP HA . 15909 3 63 1JCAHA . 1 1 82 82 ARG CA C 13 . . 1 1 82 82 ARG HA H 1 . 143.34 . . 0.50 . . . 80 ARG CA . 80 ARG HA . 15909 3 64 1JCAHA . 1 1 83 83 ASP CA C 13 . . 1 1 83 83 ASP HA H 1 . 144.82 . . 0.50 . . . 81 ASP CA . 81 ASP HA . 15909 3 65 1JCAHA . 1 1 84 84 ALA CA C 13 . . 1 1 84 84 ALA HA H 1 . 143.62 . . 0.50 . . . 82 ALA CA . 82 ALA HA . 15909 3 66 1JCAHA . 1 1 85 85 ASN CA C 13 . . 1 1 85 85 ASN HA H 1 . 145.30 . . 0.50 . . . 83 ASN CA . 83 ASN HA . 15909 3 67 1JCAHA . 1 1 86 86 GLN CA C 13 . . 1 1 86 86 GLN HA H 1 . 140.26 . . 0.50 . . . 84 GLN CA . 84 GLN HA . 15909 3 68 1JCAHA . 1 1 87 87 LEU CA C 13 . . 1 1 87 87 LEU HA H 1 . 142.47 . . 0.50 . . . 85 LEU CA . 85 LEU HA . 15909 3 69 1JCAHA . 1 1 88 88 PHE CA C 13 . . 1 1 88 88 PHE HA H 1 . 142.20 . . 0.50 . . . 86 PHE CA . 86 PHE HA . 15909 3 70 1JCAHA . 1 1 89 89 VAL CA C 13 . . 1 1 89 89 VAL HA H 1 . 144.16 . . 0.50 . . . 87 VAL CA . 87 VAL HA . 15909 3 71 1JCAHA . 1 1 90 90 ALA CA C 13 . . 1 1 90 90 ALA HA H 1 . 145.87 . . 0.50 . . . 88 ALA CA . 88 ALA HA . 15909 3 72 1JCAHA . 1 1 91 91 ASP CA C 13 . . 1 1 91 91 ASP HA H 1 . 138.49 . . 0.50 . . . 89 ASP CA . 89 ASP HA . 15909 3 73 1JCAHA . 1 1 92 92 MET CA C 13 . . 1 1 92 92 MET HA H 1 . 147.69 . . 0.50 . . . 90 MET CA . 90 MET HA . 15909 3 74 1JCAHA . 1 1 93 93 ARG CA C 13 . . 1 1 93 93 ARG HA H 1 . 139.52 . . 0.50 . . . 91 ARG CA . 91 ARG HA . 15909 3 75 1JCAHA . 1 1 94 94 LEU CA C 13 . . 1 1 94 94 LEU HA H 1 . 141.06 . . 0.50 . . . 92 LEU CA . 92 LEU HA . 15909 3 76 1JCAHA . 1 1 96 96 LEU CA C 13 . . 1 1 96 96 LEU HA H 1 . 143.01 . . 0.50 . . . 94 LEU CA . 94 LEU HA . 15909 3 77 1JCAHA . 1 1 97 97 LEU CA C 13 . . 1 1 97 97 LEU HA H 1 . 140.34 . . 0.50 . . . 95 LEU CA . 95 LEU HA . 15909 3 78 1JCAHA . 1 1 98 98 VAL CA C 13 . . 1 1 98 98 VAL HA H 1 . 141.71 . . 0.50 . . . 96 VAL CA . 96 VAL HA . 15909 3 79 1JCAHA . 1 1 99 99 VAL CA C 13 . . 1 1 99 99 VAL HA H 1 . 140.84 . . 0.50 . . . 97 VAL CA . 97 VAL HA . 15909 3 80 1JCAHA . 1 1 100 100 GLN CA C 13 . . 1 1 100 100 GLN HA H 1 . 142.68 . . 0.50 . . . 98 GLN CA . 98 GLN HA . 15909 3 81 1JCAHA . 1 1 101 101 THR CA C 13 . . 1 1 101 101 THR HA H 1 . 141.68 . . 0.50 . . . 99 THR CA . 99 THR HA . 15909 3 82 1JCAHA . 1 1 102 102 ASP CA C 13 . . 1 1 102 102 ASP HA H 1 . 142.70 . . 0.50 . . . 100 ASP CA . 100 ASP HA . 15909 3 83 1JCAHA . 1 1 104 104 THR CA C 13 . . 1 1 104 104 THR HA H 1 . 141.39 . . 0.50 . . . 102 THR CA . 102 THR HA . 15909 3 84 1JCAHA . 1 1 105 105 PHE CA C 13 . . 1 1 105 105 PHE HA H 1 . 143.46 . . 0.50 . . . 103 PHE CA . 103 PHE HA . 15909 3 85 1JCAHA . 1 1 106 106 GLU CA C 13 . . 1 1 106 106 GLU HA H 1 . 140.91 . . 0.50 . . . 104 GLU CA . 104 GLU HA . 15909 3 86 1JCAHA . 1 1 107 107 GLU CA C 13 . . 1 1 107 107 GLU HA H 1 . 142.98 . . 0.50 . . . 105 GLU CA . 105 GLU HA . 15909 3 87 1JCAHA . 1 1 108 108 ILE CA C 13 . . 1 1 108 108 ILE HA H 1 . 143.16 . . 0.50 . . . 106 ILE CA . 106 ILE HA . 15909 3 88 1JCAHA . 1 1 109 109 ALA CA C 13 . . 1 1 109 109 ALA HA H 1 . 141.67 . . 0.50 . . . 107 ALA CA . 107 ALA HA . 15909 3 89 1JCAHA . 1 1 110 110 LYS CA C 13 . . 1 1 110 110 LYS HA H 1 . 147.12 . . 0.50 . . . 108 LYS CA . 108 LYS HA . 15909 3 90 1JCAHA . 1 1 112 112 ASP CA C 13 . . 1 1 112 112 ASP HA H 1 . 135.29 . . 0.50 . . . 110 ASP CA . 110 ASP HA . 15909 3 91 1JCAHA . 1 1 113 113 SER CA C 13 . . 1 1 113 113 SER HA H 1 . 144.93 . . 0.50 . . . 111 SER CA . 111 SER HA . 15909 3 92 1JCAHA . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU HA H 1 . 139.96 . . 0.50 . . . 112 GLU CA . 112 GLU HA . 15909 3 93 1JCAHA . 1 1 116 116 ARG CA C 13 . . 1 1 116 116 ARG HA H 1 . 143.50 . . 0.50 . . . 114 ARG CA . 114 ARG HA . 15909 3 94 1JCAHA . 1 1 117 117 ARG CA C 13 . . 1 1 117 117 ARG HA H 1 . 141.52 . . 0.50 . . . 115 ARG CA . 115 ARG HA . 15909 3 95 1JCAHA . 1 1 118 118 MET CA C 13 . . 1 1 118 118 MET HA H 1 . 141.70 . . 0.50 . . . 116 MET CA . 116 MET HA . 15909 3 96 1JCAHA . 1 1 119 119 GLN CA C 13 . . 1 1 119 119 GLN HA H 1 . 141.74 . . 0.50 . . . 117 GLN CA . 117 GLN HA . 15909 3 97 1JCAHA . 1 1 121 121 CYS CA C 13 . . 1 1 121 121 CYS HA H 1 . 139.69 . . 0.50 . . . 119 CYS CA . 119 CYS HA . 15909 3 98 1JCAHA . 1 1 122 122 ASN CA C 13 . . 1 1 122 122 ASN HA H 1 . 143.29 . . 0.50 . . . 120 ASN CA . 120 ASN HA . 15909 3 99 1JCAHA . 1 1 123 123 ASP CA C 13 . . 1 1 123 123 ASP HA H 1 . 140.10 . . 0.50 . . . 121 ASP CA . 121 ASP HA . 15909 3 100 1JCAHA . 1 1 124 124 CYS CA C 13 . . 1 1 124 124 CYS HA H 1 . 140.92 . . 0.50 . . . 122 CYS CA . 122 CYS HA . 15909 3 101 1JCAHA . 1 1 125 125 ALA CA C 13 . . 1 1 125 125 ALA HA H 1 . 141.27 . . 0.50 . . . 123 ALA CA . 123 ALA HA . 15909 3 102 1JCAHA . 1 1 126 126 PHE CA C 13 . . 1 1 126 126 PHE HA H 1 . 146.32 . . 0.50 . . . 124 PHE CA . 124 PHE HA . 15909 3 103 1JCAHA . 1 1 127 127 ASP CA C 13 . . 1 1 127 127 ASP HA H 1 . 138.81 . . 0.50 . . . 125 ASP CA . 125 ASP HA . 15909 3 104 1JCAHA . 1 1 129 129 GLU CA C 13 . . 1 1 129 129 GLU HA H 1 . 144.83 . . 0.50 . . . 127 GLU CA . 127 GLU HA . 15909 3 105 1JCAHA . 1 1 131 131 ASN CA C 13 . . 1 1 131 131 ASN HA H 1 . 145.96 . . 0.50 . . . 129 ASN CA . 129 ASN HA . 15909 3 106 1JCAHA . 1 1 132 132 LEU CA C 13 . . 1 1 132 132 LEU HA H 1 . 141.21 . . 0.50 . . . 130 LEU CA . 130 LEU HA . 15909 3 107 1JCAHA . 1 1 133 133 TRP CA C 13 . . 1 1 133 133 TRP HA H 1 . 144.88 . . 0.50 . . . 131 TRP CA . 131 TRP HA . 15909 3 108 1JCAHA . 1 1 134 134 ILE CA C 13 . . 1 1 134 134 ILE HA H 1 . 142.88 . . 0.50 . . . 132 ILE CA . 132 ILE HA . 15909 3 109 1JCAHA . 1 1 135 135 THR CA C 13 . . 1 1 135 135 THR HA H 1 . 135.11 . . 0.50 . . . 133 THR CA . 133 THR HA . 15909 3 110 1JCAHA . 1 1 137 137 PRO CA C 13 . . 1 1 137 137 PRO HA H 1 . 140.50 . . 0.50 . . . 135 PRO CA . 135 PRO HA . 15909 3 111 1JCAHA . 1 1 138 138 ALA CA C 13 . . 1 1 138 138 ALA HA H 1 . 141.93 . . 0.50 . . . 136 ALA CA . 136 ALA HA . 15909 3 112 1JCAHA . 1 1 140 140 GLU CA C 13 . . 1 1 140 140 GLU HA H 1 . 141.55 . . 0.50 . . . 138 GLU CA . 138 GLU HA . 15909 3 113 1JCAHA . 1 1 141 141 VAL CA C 13 . . 1 1 141 141 VAL HA H 1 . 144.12 . . 0.50 . . . 139 VAL CA . 139 VAL HA . 15909 3 114 1JCAHA . 1 1 142 142 ALA CA C 13 . . 1 1 142 142 ALA HA H 1 . 140.63 . . 0.50 . . . 140 ALA CA . 140 ALA HA . 15909 3 115 1JCAHA . 1 1 143 143 PRO CA C 13 . . 1 1 143 143 PRO HA H 1 . 143.85 . . 0.50 . . . 141 PRO CA . 141 PRO HA . 15909 3 116 1JCAHA . 1 1 144 144 ALA CA C 13 . . 1 1 144 144 ALA HA H 1 . 145.91 . . 0.50 . . . 142 ALA CA . 142 ALA HA . 15909 3 117 1JCAHA . 1 1 145 145 ASP CA C 13 . . 1 1 145 145 ASP HA H 1 . 143.66 . . 0.50 . . . 143 ASP CA . 143 ASP HA . 15909 3 118 1JCAHA . 1 1 146 146 TYR CA C 13 . . 1 1 146 146 TYR HA H 1 . 142.59 . . 0.50 . . . 144 TYR CA . 144 TYR HA . 15909 3 119 1JCAHA . 1 1 147 147 THR CA C 13 . . 1 1 147 147 THR HA H 1 . 143.82 . . 0.50 . . . 145 THR CA . 145 THR HA . 15909 3 120 1JCAHA . 1 1 148 148 ARG CA C 13 . . 1 1 148 148 ARG HA H 1 . 142.01 . . 0.50 . . . 146 ARG CA . 146 ARG HA . 15909 3 121 1JCAHA . 1 1 150 150 MET CA C 13 . . 1 1 150 150 MET HA H 1 . 145.11 . . 0.50 . . . 148 MET CA . 148 MET HA . 15909 3 122 1JCAHA . 1 1 151 151 GLN CA C 13 . . 1 1 151 151 GLN HA H 1 . 143.86 . . 0.50 . . . 149 GLN CA . 149 GLN HA . 15909 3 123 1JCAHA . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU HA H 1 . 143.10 . . 0.50 . . . 150 GLU CA . 150 GLU HA . 15909 3 124 1JCAHA . 1 1 153 153 LYS CA C 13 . . 1 1 153 153 LYS HA H 1 . 145.50 . . 0.50 . . . 151 LYS CA . 151 LYS HA . 15909 3 125 1JCAHA . 1 1 154 154 PHE CA C 13 . . 1 1 154 154 PHE HA H 1 . 141.95 . . 0.50 . . . 152 PHE CA . 152 PHE HA . 15909 3 126 1JCAHA . 1 1 156 156 SER CA C 13 . . 1 1 156 156 SER HA H 1 . 144.03 . . 0.50 . . . 154 SER CA . 154 SER HA . 15909 3 127 1JCAHA . 1 1 157 157 ILE CA C 13 . . 1 1 157 157 ILE HA H 1 . 143.07 . . 0.50 . . . 155 ILE CA . 155 ILE HA . 15909 3 128 1JCAHA . 1 1 158 158 TYR CA C 13 . . 1 1 158 158 TYR HA H 1 . 142.16 . . 0.50 . . . 156 TYR CA . 156 TYR HA . 15909 3 129 1JCAHA . 1 1 159 159 CYS CA C 13 . . 1 1 159 159 CYS HA H 1 . 145.02 . . 0.50 . . . 157 CYS CA . 157 CYS HA . 15909 3 130 1JCAHA . 1 1 160 160 PHE CA C 13 . . 1 1 160 160 PHE HA H 1 . 144.23 . . 0.50 . . . 158 PHE CA . 158 PHE HA . 15909 3 131 1JCAHA . 1 1 161 161 THR CA C 13 . . 1 1 161 161 THR HA H 1 . 145.43 . . 0.50 . . . 159 THR CA . 159 THR HA . 15909 3 132 1JCAHA . 1 1 162 162 THR CA C 13 . . 1 1 162 162 THR HA H 1 . 146.44 . . 0.50 . . . 160 THR CA . 160 THR HA . 15909 3 133 1JCAHA . 1 1 163 163 ASP CA C 13 . . 1 1 163 163 ASP HA H 1 . 142.09 . . 0.50 . . . 161 ASP CA . 161 ASP HA . 15909 3 134 1JCAHA . 1 1 165 165 GLN CA C 13 . . 1 1 165 165 GLN HA H 1 . 143.45 . . 0.50 . . . 163 GLN CA . 163 GLN HA . 15909 3 135 1JCAHA . 1 1 166 166 MET CA C 13 . . 1 1 166 166 MET HA H 1 . 141.42 . . 0.50 . . . 164 MET CA . 164 MET HA . 15909 3 136 1JCAHA . 1 1 167 167 ILE CA C 13 . . 1 1 167 167 ILE HA H 1 . 141.41 . . 0.50 . . . 165 ILE CA . 165 ILE HA . 15909 3 137 1JCAHA . 1 1 168 168 GLN CA C 13 . . 1 1 168 168 GLN HA H 1 . 142.88 . . 0.50 . . . 166 GLN CA . 166 GLN HA . 15909 3 138 1JCAHA . 1 1 169 169 VAL CA C 13 . . 1 1 169 169 VAL HA H 1 . 142.30 . . 0.50 . . . 167 VAL CA . 167 VAL HA . 15909 3 139 1JCAHA . 1 1 170 170 ASP CA C 13 . . 1 1 170 170 ASP HA H 1 . 144.55 . . 0.50 . . . 168 ASP CA . 168 ASP HA . 15909 3 140 1JCAHA . 1 1 171 171 THR CA C 13 . . 1 1 171 171 THR HA H 1 . 137.07 . . 0.50 . . . 169 THR CA . 169 THR HA . 15909 3 141 1JCAHA . 1 1 172 172 ALA CA C 13 . . 1 1 172 172 ALA HA H 1 . 143.28 . . 0.50 . . . 170 ALA CA . 170 ALA HA . 15909 3 142 1JCAHA . 1 1 173 173 PHE CA C 13 . . 1 1 173 173 PHE HA H 1 . 141.82 . . 0.50 . . . 171 PHE CA . 171 PHE HA . 15909 3 143 1JCAHA . 1 1 174 174 GLN CA C 13 . . 1 1 174 174 GLN HA H 1 . 147.25 . . 0.50 . . . 172 GLN CA . 172 GLN HA . 15909 3 144 1JCAHA . 1 1 176 176 PRO CA C 13 . . 1 1 176 176 PRO HA H 1 . 147.93 . . 0.50 . . . 174 PRO CA . 174 PRO HA . 15909 3 145 1JCAHA . 1 1 179 179 ILE CA C 13 . . 1 1 179 179 ILE HA H 1 . 144.73 . . 0.50 . . . 177 ILE CA . 177 ILE HA . 15909 3 146 1JCAHA . 1 1 180 180 ALA CA C 13 . . 1 1 180 180 ALA HA H 1 . 142.44 . . 0.50 . . . 178 ALA CA . 178 ALA HA . 15909 3 147 1JCAHA . 1 1 181 181 VAL CA C 13 . . 1 1 181 181 VAL HA H 1 . 142.50 . . 0.50 . . . 179 VAL CA . 179 VAL HA . 15909 3 148 1JCAHA . 1 1 183 183 HIS CA C 13 . . 1 1 183 183 HIS HA H 1 . 143.84 . . 0.50 . . . 181 HIS CA . 181 HIS HA . 15909 3 149 1JCAHA . 1 1 184 184 MET CA C 13 . . 1 1 184 184 MET HA H 1 . 145.87 . . 0.50 . . . 182 MET CA . 182 MET HA . 15909 3 150 1JCAHA . 1 1 186 186 ASP CA C 13 . . 1 1 186 186 ASP HA H 1 . 141.28 . . 0.50 . . . 184 ASP CA . 184 ASP HA . 15909 3 151 1JCAHA . 1 1 188 188 ARG CA C 13 . . 1 1 188 188 ARG HA H 1 . 143.86 . . 0.50 . . . 186 ARG CA . 186 ARG HA . 15909 3 152 1JCAHA . 1 1 189 189 PRO CA C 13 . . 1 1 189 189 PRO HA H 1 . 146.24 . . 0.50 . . . 187 PRO CA . 187 PRO HA . 15909 3 153 1JCAHA . 1 1 190 190 TYR CA C 13 . . 1 1 190 190 TYR HA H 1 . 142.32 . . 0.50 . . . 188 TYR CA . 188 TYR HA . 15909 3 154 1JCAHA . 1 1 191 191 GLN CA C 13 . . 1 1 191 191 GLN HA H 1 . 141.00 . . 0.50 . . . 189 GLN CA . 189 GLN HA . 15909 3 155 1JCAHA . 1 1 192 192 LEU CA C 13 . . 1 1 192 192 LEU HA H 1 . 139.84 . . 0.50 . . . 190 LEU CA . 190 LEU HA . 15909 3 156 1JCAHA . 1 1 193 193 ILE CA C 13 . . 1 1 193 193 ILE HA H 1 . 142.95 . . 0.50 . . . 191 ILE CA . 191 ILE HA . 15909 3 157 1JCAHA . 1 1 194 194 VAL CA C 13 . . 1 1 194 194 VAL HA H 1 . 143.17 . . 0.50 . . . 192 VAL CA . 192 VAL HA . 15909 3 158 1JCAHA . 1 1 195 195 ALA CA C 13 . . 1 1 195 195 ALA HA H 1 . 141.91 . . 0.50 . . . 193 ALA CA . 193 ALA HA . 15909 3 159 1JCAHA . 1 1 196 196 GLU CA C 13 . . 1 1 196 196 GLU HA H 1 . 142.31 . . 0.50 . . . 194 GLU CA . 194 GLU HA . 15909 3 160 1JCAHA . 1 1 198 198 PRO CA C 13 . . 1 1 198 198 PRO HA H 1 . 150.84 . . 0.50 . . . 196 PRO CA . 196 PRO HA . 15909 3 161 1JCAHA . 1 1 199 199 THR CA C 13 . . 1 1 199 199 THR HA H 1 . 144.25 . . 0.50 . . . 197 THR CA . 197 THR HA . 15909 3 162 1JCAHA . 1 1 200 200 LYS CA C 13 . . 1 1 200 200 LYS HA H 1 . 137.55 . . 0.50 . . . 198 LYS CA . 198 LYS HA . 15909 3 163 1JCAHA . 1 1 201 201 LYS CA C 13 . . 1 1 201 201 LYS HA H 1 . 135.94 . . 0.50 . . . 199 LYS CA . 199 LYS HA . 15909 3 164 1JCAHA . 1 1 202 202 LEU CA C 13 . . 1 1 202 202 LEU HA H 1 . 143.12 . . 0.50 . . . 200 LEU CA . 200 LEU HA . 15909 3 165 1JCAHA . 1 1 203 203 TRP CA C 13 . . 1 1 203 203 TRP HA H 1 . 143.95 . . 0.50 . . . 201 TRP CA . 201 TRP HA . 15909 3 166 1JCAHA . 1 1 204 204 SER CA C 13 . . 1 1 204 204 SER HA H 1 . 141.94 . . 0.50 . . . 202 SER CA . 202 SER HA . 15909 3 167 1JCAHA . 1 1 205 205 TYR CA C 13 . . 1 1 205 205 TYR HA H 1 . 143.38 . . 0.50 . . . 203 TYR CA . 203 TYR HA . 15909 3 168 1JCAHA . 1 1 206 206 ASP CA C 13 . . 1 1 206 206 ASP HA H 1 . 145.70 . . 0.50 . . . 204 ASP CA . 204 ASP HA . 15909 3 169 1JCAHA . 1 1 207 207 ILE CA C 13 . . 1 1 207 207 ILE HA H 1 . 141.73 . . 0.50 . . . 205 ILE CA . 205 ILE HA . 15909 3 170 1JCAHA . 1 1 208 208 LYS CA C 13 . . 1 1 208 208 LYS HA H 1 . 143.24 . . 0.50 . . . 206 LYS CA . 206 LYS HA . 15909 3 171 1JCAHA . 1 1 210 210 PRO CA C 13 . . 1 1 210 210 PRO HA H 1 . 143.89 . . 0.50 . . . 208 PRO CA . 208 PRO HA . 15909 3 172 1JCAHA . 1 1 211 211 ALA CA C 13 . . 1 1 211 211 ALA HA H 1 . 139.56 . . 0.50 . . . 209 ALA CA . 209 ALA HA . 15909 3 173 1JCAHA . 1 1 212 212 LYS CA C 13 . . 1 1 212 212 LYS HA H 1 . 138.74 . . 0.50 . . . 210 LYS CA . 210 LYS HA . 15909 3 174 1JCAHA . 1 1 213 213 ILE CA C 13 . . 1 1 213 213 ILE HA H 1 . 140.21 . . 0.50 . . . 211 ILE CA . 211 ILE HA . 15909 3 175 1JCAHA . 1 1 214 214 GLU CA C 13 . . 1 1 214 214 GLU HA H 1 . 143.10 . . 0.50 . . . 212 GLU CA . 212 GLU HA . 15909 3 176 1JCAHA . 1 1 215 215 ASN CA C 13 . . 1 1 215 215 ASN HA H 1 . 139.90 . . 0.50 . . . 213 ASN CA . 213 ASN HA . 15909 3 177 1JCAHA . 1 1 216 216 LYS CA C 13 . . 1 1 216 216 LYS HA H 1 . 147.57 . . 0.50 . . . 214 LYS CA . 214 LYS HA . 15909 3 178 1JCAHA . 1 1 217 217 LYS CA C 13 . . 1 1 217 217 LYS HA H 1 . 138.53 . . 0.50 . . . 215 LYS CA . 215 LYS HA . 15909 3 179 1JCAHA . 1 1 218 218 VAL CA C 13 . . 1 1 218 218 VAL HA H 1 . 143.21 . . 0.50 . . . 216 VAL CA . 216 VAL HA . 15909 3 180 1JCAHA . 1 1 219 219 TRP CA C 13 . . 1 1 219 219 TRP HA H 1 . 145.19 . . 0.50 . . . 217 TRP CA . 217 TRP HA . 15909 3 181 1JCAHA . 1 1 221 221 HIS CA C 13 . . 1 1 221 221 HIS HA H 1 . 142.89 . . 0.50 . . . 219 HIS CA . 219 HIS HA . 15909 3 182 1JCAHA . 1 1 223 223 PRO CA C 13 . . 1 1 223 223 PRO HA H 1 . 145.13 . . 0.50 . . . 221 PRO CA . 221 PRO HA . 15909 3 183 1JCAHA . 1 1 225 225 THR CA C 13 . . 1 1 225 225 THR HA H 1 . 135.26 . . 0.50 . . . 223 THR CA . 223 THR HA . 15909 3 184 1JCAHA . 1 1 226 226 HIS CA C 13 . . 1 1 226 226 HIS HA H 1 . 147.03 . . 0.50 . . . 224 HIS CA . 224 HIS HA . 15909 3 185 1JCAHA . 1 1 227 227 GLU CA C 13 . . 1 1 227 227 GLU HA H 1 . 144.05 . . 0.50 . . . 225 GLU CA . 225 GLU HA . 15909 3 186 1JCAHA . 1 1 233 233 MET CA C 13 . . 1 1 233 233 MET HA H 1 . 146.19 . . 0.50 . . . 231 MET CA . 231 MET HA . 15909 3 187 1JCAHA . 1 1 234 234 ASP CA C 13 . . 1 1 234 234 ASP HA H 1 . 143.28 . . 0.50 . . . 232 ASP CA . 232 ASP HA . 15909 3 188 1JCAHA . 1 1 235 235 PHE CA C 13 . . 1 1 235 235 PHE HA H 1 . 146.84 . . 0.50 . . . 233 PHE CA . 233 PHE HA . 15909 3 189 1JCAHA . 1 1 236 236 ASP CA C 13 . . 1 1 236 236 ASP HA H 1 . 130.98 . . 0.50 . . . 234 ASP CA . 234 ASP HA . 15909 3 190 1JCAHA . 1 1 237 237 GLU CA C 13 . . 1 1 237 237 GLU HA H 1 . 145.77 . . 0.50 . . . 235 GLU CA . 235 GLU HA . 15909 3 191 1JCAHA . 1 1 238 238 ASP CA C 13 . . 1 1 238 238 ASP HA H 1 . 142.19 . . 0.50 . . . 236 ASP CA . 236 ASP HA . 15909 3 192 1JCAHA . 1 1 239 239 ASN CA C 13 . . 1 1 239 239 ASN HA H 1 . 137.53 . . 0.50 . . . 237 ASN CA . 237 ASN HA . 15909 3 193 1JCAHA . 1 1 240 240 ASN CA C 13 . . 1 1 240 240 ASN HA H 1 . 149.49 . . 0.50 . . . 238 ASN CA . 238 ASN HA . 15909 3 194 1JCAHA . 1 1 241 241 LEU CA C 13 . . 1 1 241 241 LEU HA H 1 . 143.31 . . 0.50 . . . 239 LEU CA . 239 LEU HA . 15909 3 195 1JCAHA . 1 1 242 242 LEU CA C 13 . . 1 1 242 242 LEU HA H 1 . 147.26 . . 0.50 . . . 240 LEU CA . 240 LEU HA . 15909 3 196 1JCAHA . 1 1 243 243 VAL CA C 13 . . 1 1 243 243 VAL HA H 1 . 141.56 . . 0.50 . . . 241 VAL CA . 241 VAL HA . 15909 3 197 1JCAHA . 1 1 244 244 ALA CA C 13 . . 1 1 244 244 ALA HA H 1 . 140.87 . . 0.50 . . . 242 ALA CA . 242 ALA HA . 15909 3 198 1JCAHA . 1 1 245 245 ASN CA C 13 . . 1 1 245 245 ASN HA H 1 . 140.36 . . 0.50 . . . 243 ASN CA . 243 ASN HA . 15909 3 199 1JCAHA . 1 1 246 246 TRP CA C 13 . . 1 1 246 246 TRP HA H 1 . 142.87 . . 0.50 . . . 244 TRP CA . 244 TRP HA . 15909 3 200 1JCAHA . 1 1 248 248 SER CA C 13 . . 1 1 248 248 SER HA H 1 . 145.87 . . 0.50 . . . 246 SER CA . 246 SER HA . 15909 3 201 1JCAHA . 1 1 249 249 SER CA C 13 . . 1 1 249 249 SER HA H 1 . 139.79 . . 0.50 . . . 247 SER CA . 247 SER HA . 15909 3 202 1JCAHA . 1 1 250 250 HIS CA C 13 . . 1 1 250 250 HIS HA H 1 . 143.72 . . 0.50 . . . 248 HIS CA . 248 HIS HA . 15909 3 203 1JCAHA . 1 1 251 251 ILE CA C 13 . . 1 1 251 251 ILE HA H 1 . 140.88 . . 0.50 . . . 249 ILE CA . 249 ILE HA . 15909 3 204 1JCAHA . 1 1 252 252 GLU CA C 13 . . 1 1 252 252 GLU HA H 1 . 144.26 . . 0.50 . . . 250 GLU CA . 250 GLU HA . 15909 3 205 1JCAHA . 1 1 253 253 VAL CA C 13 . . 1 1 253 253 VAL HA H 1 . 143.98 . . 0.50 . . . 251 VAL CA . 251 VAL HA . 15909 3 206 1JCAHA . 1 1 254 254 PHE CA C 13 . . 1 1 254 254 PHE HA H 1 . 144.99 . . 0.50 . . . 252 PHE CA . 252 PHE HA . 15909 3 207 1JCAHA . 1 1 256 256 PRO CA C 13 . . 1 1 256 256 PRO HA H 1 . 148.40 . . 0.50 . . . 254 PRO CA . 254 PRO HA . 15909 3 208 1JCAHA . 1 1 257 257 ASP CA C 13 . . 1 1 257 257 ASP HA H 1 . 143.34 . . 0.50 . . . 255 ASP CA . 255 ASP HA . 15909 3 209 1JCAHA . 1 1 260 260 GLN CA C 13 . . 1 1 260 260 GLN HA H 1 . 141.44 . . 0.50 . . . 258 GLN CA . 258 GLN HA . 15909 3 210 1JCAHA . 1 1 261 261 PRO CA C 13 . . 1 1 261 261 PRO HA H 1 . 144.97 . . 0.50 . . . 259 PRO CA . 259 PRO HA . 15909 3 211 1JCAHA . 1 1 262 262 LYS CA C 13 . . 1 1 262 262 LYS HA H 1 . 144.73 . . 0.50 . . . 260 LYS CA . 260 LYS HA . 15909 3 212 1JCAHA . 1 1 263 263 MET CA C 13 . . 1 1 263 263 MET HA H 1 . 145.13 . . 0.50 . . . 261 MET CA . 261 MET HA . 15909 3 213 1JCAHA . 1 1 264 264 ARG CA C 13 . . 1 1 264 264 ARG HA H 1 . 141.72 . . 0.50 . . . 262 ARG CA . 262 ARG HA . 15909 3 214 1JCAHA . 1 1 265 265 ILE CA C 13 . . 1 1 265 265 ILE HA H 1 . 140.89 . . 0.50 . . . 263 ILE CA . 263 ILE HA . 15909 3 215 1JCAHA . 1 1 266 266 ARG CA C 13 . . 1 1 266 266 ARG HA H 1 . 142.26 . . 0.50 . . . 264 ARG CA . 264 ARG HA . 15909 3 216 1JCAHA . 1 1 268 268 PRO CA C 13 . . 1 1 268 268 PRO HA H 1 . 148.03 . . 0.50 . . . 266 PRO CA . 266 PRO HA . 15909 3 217 1JCAHA . 1 1 269 269 PHE CA C 13 . . 1 1 269 269 PHE HA H 1 . 145.29 . . 0.50 . . . 267 PHE CA . 267 PHE HA . 15909 3 218 1JCAHA . 1 1 270 270 GLU CA C 13 . . 1 1 270 270 GLU HA H 1 . 143.80 . . 0.50 . . . 268 GLU CA . 268 GLU HA . 15909 3 219 1JCAHA . 1 1 273 273 SER CA C 13 . . 1 1 273 273 SER HA H 1 . 141.01 . . 0.50 . . . 271 SER CA . 271 SER HA . 15909 3 220 1JCAHA . 1 1 274 274 ASN CA C 13 . . 1 1 274 274 ASN HA H 1 . 140.91 . . 0.50 . . . 272 ASN CA . 272 ASN HA . 15909 3 221 1JCAHA . 1 1 275 275 LEU CA C 13 . . 1 1 275 275 LEU HA H 1 . 141.89 . . 0.50 . . . 273 LEU CA . 273 LEU HA . 15909 3 222 1JCAHA . 1 1 276 276 HIS CA C 13 . . 1 1 276 276 HIS HA H 1 . 140.63 . . 0.50 . . . 274 HIS CA . 274 HIS HA . 15909 3 223 1JCAHA . 1 1 277 277 PHE CA C 13 . . 1 1 277 277 PHE HA H 1 . 145.12 . . 0.50 . . . 275 PHE CA . 275 PHE HA . 15909 3 224 1JCAHA . 1 1 278 278 LYS CA C 13 . . 1 1 278 278 LYS HA H 1 . 140.70 . . 0.50 . . . 276 LYS CA . 276 LYS HA . 15909 3 225 1JCAHA . 1 1 279 279 PRO CA C 13 . . 1 1 279 279 PRO HA H 1 . 143.98 . . 0.50 . . . 277 PRO CA . 277 PRO HA . 15909 3 226 1JCAHA . 1 1 280 280 GLN CA C 13 . . 1 1 280 280 GLN HA H 1 . 138.81 . . 0.50 . . . 278 GLN CA . 278 GLN HA . 15909 3 227 1JCAHA . 1 1 281 281 THR CA C 13 . . 1 1 281 281 THR HA H 1 . 139.59 . . 0.50 . . . 279 THR CA . 279 THR HA . 15909 3 228 1JCAHA . 1 1 282 282 LYS CA C 13 . . 1 1 282 282 LYS HA H 1 . 139.39 . . 0.50 . . . 280 LYS CA . 280 LYS HA . 15909 3 229 1JCAHA . 1 1 283 283 THR CA C 13 . . 1 1 283 283 THR HA H 1 . 141.11 . . 0.50 . . . 281 THR CA . 281 THR HA . 15909 3 230 1JCAHA . 1 1 284 284 ILE CA C 13 . . 1 1 284 284 ILE HA H 1 . 139.49 . . 0.50 . . . 282 ILE CA . 282 ILE HA . 15909 3 231 1JCAHA . 1 1 285 285 PHE CA C 13 . . 1 1 285 285 PHE HA H 1 . 143.09 . . 0.50 . . . 283 PHE CA . 283 PHE HA . 15909 3 232 1JCAHA . 1 1 286 286 VAL CA C 13 . . 1 1 286 286 VAL HA H 1 . 140.91 . . 0.50 . . . 284 VAL CA . 284 VAL HA . 15909 3 233 1JCAHA . 1 1 287 287 THR CA C 13 . . 1 1 287 287 THR HA H 1 . 141.12 . . 0.50 . . . 285 THR CA . 285 THR HA . 15909 3 234 1JCAHA . 1 1 288 288 GLU CA C 13 . . 1 1 288 288 GLU HA H 1 . 142.61 . . 0.50 . . . 286 GLU CA . 286 GLU HA . 15909 3 235 1JCAHA . 1 1 289 289 HIS CA C 13 . . 1 1 289 289 HIS HA H 1 . 141.81 . . 0.50 . . . 287 HIS CA . 287 HIS HA . 15909 3 236 1JCAHA . 1 1 290 290 GLU CA C 13 . . 1 1 290 290 GLU HA H 1 . 151.09 . . 0.50 . . . 288 GLU CA . 288 GLU HA . 15909 3 237 1JCAHA . 1 1 291 291 ASN CA C 13 . . 1 1 291 291 ASN HA H 1 . 143.92 . . 0.50 . . . 289 ASN CA . 289 ASN HA . 15909 3 238 1JCAHA . 1 1 292 292 ASN CA C 13 . . 1 1 292 292 ASN HA H 1 . 141.76 . . 0.50 . . . 290 ASN CA . 290 ASN HA . 15909 3 239 1JCAHA . 1 1 293 293 ALA CA C 13 . . 1 1 293 293 ALA HA H 1 . 137.78 . . 0.50 . . . 291 ALA CA . 291 ALA HA . 15909 3 240 1JCAHA . 1 1 294 294 VAL CA C 13 . . 1 1 294 294 VAL HA H 1 . 143.42 . . 0.50 . . . 292 VAL CA . 292 VAL HA . 15909 3 241 1JCAHA . 1 1 295 295 TRP CA C 13 . . 1 1 295 295 TRP HA H 1 . 141.78 . . 0.50 . . . 293 TRP CA . 293 TRP HA . 15909 3 242 1JCAHA . 1 1 296 296 LYS CA C 13 . . 1 1 296 296 LYS HA H 1 . 141.36 . . 0.50 . . . 294 LYS CA . 294 LYS HA . 15909 3 243 1JCAHA . 1 1 297 297 PHE CA C 13 . . 1 1 297 297 PHE HA H 1 . 147.73 . . 0.50 . . . 295 PHE CA . 295 PHE HA . 15909 3 244 1JCAHA . 1 1 298 298 GLU CA C 13 . . 1 1 298 298 GLU HA H 1 . 146.57 . . 0.50 . . . 296 GLU CA . 296 GLU HA . 15909 3 245 1JCAHA . 1 1 299 299 TRP CA C 13 . . 1 1 299 299 TRP HA H 1 . 148.06 . . 0.50 . . . 297 TRP CA . 297 TRP HA . 15909 3 246 1JCAHA . 1 1 300 300 GLN CA C 13 . . 1 1 300 300 GLN HA H 1 . 145.43 . . 0.50 . . . 298 GLN CA . 298 GLN HA . 15909 3 247 1JCAHA . 1 1 301 301 ARG CA C 13 . . 1 1 301 301 ARG HA H 1 . 140.38 . . 0.50 . . . 299 ARG CA . 299 ARG HA . 15909 3 248 1JCAHA . 1 1 302 302 ASN CA C 13 . . 1 1 302 302 ASN HA H 1 . 147.97 . . 0.50 . . . 300 ASN CA . 300 ASN HA . 15909 3 249 1JCAHA . 1 1 305 305 LYS CA C 13 . . 1 1 305 305 LYS HA H 1 . 140.88 . . 0.50 . . . 303 LYS CA . 303 LYS HA . 15909 3 250 1JCAHA . 1 1 306 306 GLN CA C 13 . . 1 1 306 306 GLN HA H 1 . 144.09 . . 0.50 . . . 304 GLN CA . 304 GLN HA . 15909 3 251 1JCAHA . 1 1 307 307 TYR CA C 13 . . 1 1 307 307 TYR HA H 1 . 149.23 . . 0.50 . . . 305 TYR CA . 305 TYR HA . 15909 3 252 1JCAHA . 1 1 308 308 CYS CA C 13 . . 1 1 308 308 CYS HA H 1 . 141.62 . . 0.50 . . . 306 CYS CA . 306 CYS HA . 15909 3 253 1JCAHA . 1 1 309 309 GLU CA C 13 . . 1 1 309 309 GLU HA H 1 . 143.85 . . 0.50 . . . 307 GLU CA . 307 GLU HA . 15909 3 254 1JCAHA . 1 1 310 310 THR CA C 13 . . 1 1 310 310 THR HA H 1 . 137.82 . . 0.50 . . . 308 THR CA . 308 THR HA . 15909 3 stop_ save_ save_1JCaCb _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode 1JCaCb _Coupling_constant_list.Entry_ID 15909 _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 800 _Coupling_constant_list.Details 'Ca evolution time typically 70-90ms' _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 Cb-coupled [15N,1H]-TROSY-HN(CO)CA' . . . 15909 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 1JCACB . 1 1 3 3 MET CA C 13 . . 1 1 3 3 MET CB C 13 . 34.52 . . 0.50 . . . 1 MET CA . 1 MET CB . 15909 4 2 1JCACB . 1 1 4 4 GLU CA C 13 . . 1 1 4 4 GLU CB C 13 . 34.62 . . 0.50 . . . 2 GLU CA . 2 GLU CB . 15909 4 3 1JCACB . 1 1 6 6 PRO CA C 13 . . 1 1 6 6 PRO CB C 13 . 32.26 . . 0.50 . . . 4 PRO CA . 4 PRO CB . 15909 4 4 1JCACB . 1 1 7 7 VAL CA C 13 . . 1 1 7 7 VAL CB C 13 . 34.18 . . 0.50 . . . 5 VAL CA . 5 VAL CB . 15909 4 5 1JCACB . 1 1 8 8 ILE CA C 13 . . 1 1 8 8 ILE CB C 13 . 34.12 . . 0.50 . . . 6 ILE CA . 6 ILE CB . 15909 4 6 1JCACB . 1 1 10 10 PRO CA C 13 . . 1 1 10 10 PRO CB C 13 . 31.90 . . 0.50 . . . 8 PRO CA . 8 PRO CB . 15909 4 7 1JCACB . 1 1 11 11 LEU CA C 13 . . 1 1 11 11 LEU CB C 13 . 34.21 . . 0.50 . . . 9 LEU CA . 9 LEU CB . 15909 4 8 1JCACB . 1 1 12 12 PHE CA C 13 . . 1 1 12 12 PHE CB C 13 . 33.39 . . 0.50 . . . 10 PHE CA . 10 PHE CB . 15909 4 9 1JCACB . 1 1 13 13 THR CA C 13 . . 1 1 13 13 THR CB C 13 . 37.07 . . 0.50 . . . 11 THR CA . 11 THR CB . 15909 4 10 1JCACB . 1 1 14 14 LYS CA C 13 . . 1 1 14 14 LYS CB C 13 . 34.40 . . 0.50 . . . 12 LYS CA . 12 LYS CB . 15909 4 11 1JCACB . 1 1 15 15 VAL CA C 13 . . 1 1 15 15 VAL CB C 13 . 32.70 . . 0.50 . . . 13 VAL CA . 13 VAL CB . 15909 4 12 1JCACB . 1 1 16 16 THR CA C 13 . . 1 1 16 16 THR CB C 13 . 40.69 . . 0.50 . . . 14 THR CA . 14 THR CB . 15909 4 13 1JCACB . 1 1 17 17 GLU CA C 13 . . 1 1 17 17 GLU CB C 13 . 33.75 . . 0.50 . . . 15 GLU CA . 15 GLU CB . 15909 4 14 1JCACB . 1 1 18 18 ASP CA C 13 . . 1 1 18 18 ASP CB C 13 . 40.54 . . 0.50 . . . 16 ASP CA . 16 ASP CB . 15909 4 15 1JCACB . 1 1 26 26 VAL CA C 13 . . 1 1 26 26 VAL CB C 13 . 32.77 . . 0.50 . . . 24 VAL CA . 24 VAL CB . 15909 4 16 1JCACB . 1 1 28 28 ASP CA C 13 . . 1 1 28 28 ASP CB C 13 . 37.46 . . 0.50 . . . 26 ASP CA . 26 ASP CB . 15909 4 17 1JCACB . 1 1 29 29 LYS CA C 13 . . 1 1 29 29 LYS CB C 13 . 33.34 . . 0.50 . . . 27 LYS CA . 27 LYS CB . 15909 4 18 1JCACB . 1 1 30 30 ASN CA C 13 . . 1 1 30 30 ASN CB C 13 . 38.27 . . 0.50 . . . 28 ASN CA . 28 ASN CB . 15909 4 19 1JCACB . 1 1 32 32 ASP CA C 13 . . 1 1 32 32 ASP CB C 13 . 36.08 . . 0.50 . . . 30 ASP CA . 30 ASP CB . 15909 4 20 1JCACB . 1 1 39 39 GLU CA C 13 . . 1 1 39 39 GLU CB C 13 . 36.41 . . 0.50 . . . 37 GLU CA . 37 GLU CB . 15909 4 21 1JCACB . 1 1 41 41 GLU CA C 13 . . 1 1 41 41 GLU CB C 13 . 33.53 . . 0.50 . . . 39 GLU CA . 39 GLU CB . 15909 4 22 1JCACB . 1 1 46 46 PRO CA C 13 . . 1 1 46 46 PRO CB C 13 . 31.83 . . 0.50 . . . 44 PRO CA . 44 PRO CB . 15909 4 23 1JCACB . 1 1 47 47 ALA CA C 13 . . 1 1 47 47 ALA CB C 13 . 38.77 . . 0.50 . . . 45 ALA CA . 45 ALA CB . 15909 4 24 1JCACB . 1 1 53 53 ILE CA C 13 . . 1 1 53 53 ILE CB C 13 . 34.27 . . 0.50 . . . 51 ILE CA . 51 ILE CB . 15909 4 25 1JCACB . 1 1 54 54 ASP CA C 13 . . 1 1 54 54 ASP CB C 13 . 36.29 . . 0.50 . . . 52 ASP CA . 52 ASP CB . 15909 4 26 1JCACB . 1 1 55 55 LEU CA C 13 . . 1 1 55 55 LEU CB C 13 . 33.92 . . 0.50 . . . 53 LEU CA . 53 LEU CB . 15909 4 27 1JCACB . 1 1 56 56 LYS CA C 13 . . 1 1 56 56 LYS CB C 13 . 33.22 . . 0.50 . . . 54 LYS CA . 54 LYS CB . 15909 4 28 1JCACB . 1 1 57 57 THR CA C 13 . . 1 1 57 57 THR CB C 13 . 36.46 . . 0.50 . . . 55 THR CA . 55 THR CB . 15909 4 29 1JCACB . 1 1 59 59 LYS CA C 13 . . 1 1 59 59 LYS CB C 13 . 33.47 . . 0.50 . . . 57 LYS CA . 57 LYS CB . 15909 4 30 1JCACB . 1 1 60 60 LYS CA C 13 . . 1 1 60 60 LYS CB C 13 . 33.76 . . 0.50 . . . 58 LYS CA . 58 LYS CB . 15909 4 31 1JCACB . 1 1 61 61 THR CA C 13 . . 1 1 61 61 THR CB C 13 . 36.89 . . 0.50 . . . 59 THR CA . 59 THR CB . 15909 4 32 1JCACB . 1 1 62 62 VAL CA C 13 . . 1 1 62 62 VAL CB C 13 . 35.22 . . 0.50 . . . 60 VAL CA . 60 VAL CB . 15909 4 33 1JCACB . 1 1 63 63 ILE CA C 13 . . 1 1 63 63 ILE CB C 13 . 33.37 . . 0.50 . . . 61 ILE CA . 61 ILE CB . 15909 4 34 1JCACB . 1 1 64 64 CYS CA C 13 . . 1 1 64 64 CYS CB C 13 . 33.34 . . 0.50 . . . 62 CYS CA . 62 CYS CB . 15909 4 35 1JCACB . 1 1 66 66 PRO CA C 13 . . 1 1 66 66 PRO CB C 13 . 32.28 . . 0.50 . . . 64 PRO CA . 64 PRO CB . 15909 4 36 1JCACB . 1 1 67 67 GLU CA C 13 . . 1 1 67 67 GLU CB C 13 . 33.24 . . 0.50 . . . 65 GLU CA . 65 GLU CB . 15909 4 37 1JCACB . 1 1 68 68 VAL CA C 13 . . 1 1 68 68 VAL CB C 13 . 34.99 . . 0.50 . . . 66 VAL CA . 66 VAL CB . 15909 4 38 1JCACB . 1 1 69 69 ASN CA C 13 . . 1 1 69 69 ASN CB C 13 . 41.34 . . 0.50 . . . 67 ASN CA . 67 ASN CB . 15909 4 39 1JCACB . 1 1 71 71 TYR CA C 13 . . 1 1 71 71 TYR CB C 13 . 33.96 . . 0.50 . . . 69 TYR CA . 69 TYR CB . 15909 4 40 1JCACB . 1 1 80 80 CYS CA C 13 . . 1 1 80 80 CYS CB C 13 . 35.84 . . 0.50 . . . 78 CYS CA . 78 CYS CB . 15909 4 41 1JCACB . 1 1 81 81 ASP CA C 13 . . 1 1 81 81 ASP CB C 13 . 35.13 . . 0.50 . . . 79 ASP CA . 79 ASP CB . 15909 4 42 1JCACB . 1 1 82 82 ARG CA C 13 . . 1 1 82 82 ARG CB C 13 . 32.68 . . 0.50 . . . 80 ARG CA . 80 ARG CB . 15909 4 43 1JCACB . 1 1 83 83 ASP CA C 13 . . 1 1 83 83 ASP CB C 13 . 36.39 . . 0.50 . . . 81 ASP CA . 81 ASP CB . 15909 4 44 1JCACB . 1 1 85 85 ASN CA C 13 . . 1 1 85 85 ASN CB C 13 . 40.00 . . 0.50 . . . 83 ASN CA . 83 ASN CB . 15909 4 45 1JCACB . 1 1 99 99 VAL CA C 13 . . 1 1 99 99 VAL CB C 13 . 34.63 . . 0.50 . . . 97 VAL CA . 97 VAL CB . 15909 4 46 1JCACB . 1 1 100 100 GLN CA C 13 . . 1 1 100 100 GLN CB C 13 . 33.44 . . 0.50 . . . 98 GLN CA . 98 GLN CB . 15909 4 47 1JCACB . 1 1 101 101 THR CA C 13 . . 1 1 101 101 THR CB C 13 . 42.40 . . 0.50 . . . 99 THR CA . 99 THR CB . 15909 4 48 1JCACB . 1 1 102 102 ASP CA C 13 . . 1 1 102 102 ASP CB C 13 . 38.28 . . 0.50 . . . 100 ASP CA . 100 ASP CB . 15909 4 49 1JCACB . 1 1 104 104 THR CA C 13 . . 1 1 104 104 THR CB C 13 . 37.63 . . 0.50 . . . 102 THR CA . 102 THR CB . 15909 4 50 1JCACB . 1 1 105 105 PHE CA C 13 . . 1 1 105 105 PHE CB C 13 . 31.15 . . 0.50 . . . 103 PHE CA . 103 PHE CB . 15909 4 51 1JCACB . 1 1 106 106 GLU CA C 13 . . 1 1 106 106 GLU CB C 13 . 33.51 . . 0.50 . . . 104 GLU CA . 104 GLU CB . 15909 4 52 1JCACB . 1 1 107 107 GLU CA C 13 . . 1 1 107 107 GLU CB C 13 . 34.73 . . 0.50 . . . 105 GLU CA . 105 GLU CB . 15909 4 53 1JCACB . 1 1 108 108 ILE CA C 13 . . 1 1 108 108 ILE CB C 13 . 33.34 . . 0.50 . . . 106 ILE CA . 106 ILE CB . 15909 4 54 1JCACB . 1 1 110 110 LYS CA C 13 . . 1 1 110 110 LYS CB C 13 . 34.03 . . 0.50 . . . 108 LYS CA . 108 LYS CB . 15909 4 55 1JCACB . 1 1 111 111 LYS CA C 13 . . 1 1 111 111 LYS CB C 13 . 33.33 . . 0.50 . . . 109 LYS CA . 109 LYS CB . 15909 4 56 1JCACB . 1 1 112 112 ASP CA C 13 . . 1 1 112 112 ASP CB C 13 . 36.71 . . 0.50 . . . 110 ASP CA . 110 ASP CB . 15909 4 57 1JCACB . 1 1 113 113 SER CA C 13 . . 1 1 113 113 SER CB C 13 . 39.46 . . 0.50 . . . 111 SER CA . 111 SER CB . 15909 4 58 1JCACB . 1 1 114 114 GLU CA C 13 . . 1 1 114 114 GLU CB C 13 . 36.53 . . 0.50 . . . 112 GLU CA . 112 GLU CB . 15909 4 59 1JCACB . 1 1 116 116 ARG CA C 13 . . 1 1 116 116 ARG CB C 13 . 33.92 . . 0.50 . . . 114 ARG CA . 114 ARG CB . 15909 4 60 1JCACB . 1 1 117 117 ARG CA C 13 . . 1 1 117 117 ARG CB C 13 . 33.37 . . 0.50 . . . 115 ARG CA . 115 ARG CB . 15909 4 61 1JCACB . 1 1 118 118 MET CA C 13 . . 1 1 118 118 MET CB C 13 . 33.56 . . 0.50 . . . 116 MET CA . 116 MET CB . 15909 4 62 1JCACB . 1 1 119 119 GLN CA C 13 . . 1 1 119 119 GLN CB C 13 . 34.44 . . 0.50 . . . 117 GLN CA . 117 GLN CB . 15909 4 63 1JCACB . 1 1 125 125 ALA CA C 13 . . 1 1 125 125 ALA CB C 13 . 34.14 . . 0.50 . . . 123 ALA CA . 123 ALA CB . 15909 4 64 1JCACB . 1 1 127 127 ASP CA C 13 . . 1 1 127 127 ASP CB C 13 . 36.56 . . 0.50 . . . 125 ASP CA . 125 ASP CB . 15909 4 65 1JCACB . 1 1 128 128 TYR CA C 13 . . 1 1 128 128 TYR CB C 13 . 36.01 . . 0.50 . . . 126 TYR CA . 126 TYR CB . 15909 4 66 1JCACB . 1 1 137 137 PRO CA C 13 . . 1 1 137 137 PRO CB C 13 . 32.93 . . 0.50 . . . 135 PRO CA . 135 PRO CB . 15909 4 67 1JCACB . 1 1 138 138 ALA CA C 13 . . 1 1 138 138 ALA CB C 13 . 34.92 . . 0.50 . . . 136 ALA CA . 136 ALA CB . 15909 4 68 1JCACB . 1 1 140 140 GLU CA C 13 . . 1 1 140 140 GLU CB C 13 . 33.29 . . 0.50 . . . 138 GLU CA . 138 GLU CB . 15909 4 69 1JCACB . 1 1 141 141 VAL CA C 13 . . 1 1 141 141 VAL CB C 13 . 32.65 . . 0.50 . . . 139 VAL CA . 139 VAL CB . 15909 4 70 1JCACB . 1 1 143 143 PRO CA C 13 . . 1 1 143 143 PRO CB C 13 . 33.48 . . 0.50 . . . 141 PRO CA . 141 PRO CB . 15909 4 71 1JCACB . 1 1 144 144 ALA CA C 13 . . 1 1 144 144 ALA CB C 13 . 33.33 . . 0.50 . . . 142 ALA CA . 142 ALA CB . 15909 4 72 1JCACB . 1 1 145 145 ASP CA C 13 . . 1 1 145 145 ASP CB C 13 . 35.22 . . 0.50 . . . 143 ASP CA . 143 ASP CB . 15909 4 73 1JCACB . 1 1 146 146 TYR CA C 13 . . 1 1 146 146 TYR CB C 13 . 34.47 . . 0.50 . . . 144 TYR CA . 144 TYR CB . 15909 4 74 1JCACB . 1 1 147 147 THR CA C 13 . . 1 1 147 147 THR CB C 13 . 36.86 . . 0.50 . . . 145 THR CA . 145 THR CB . 15909 4 75 1JCACB . 1 1 148 148 ARG CA C 13 . . 1 1 148 148 ARG CB C 13 . 34.12 . . 0.50 . . . 146 ARG CA . 146 ARG CB . 15909 4 76 1JCACB . 1 1 151 151 GLN CA C 13 . . 1 1 151 151 GLN CB C 13 . 34.25 . . 0.50 . . . 149 GLN CA . 149 GLN CB . 15909 4 77 1JCACB . 1 1 152 152 GLU CA C 13 . . 1 1 152 152 GLU CB C 13 . 33.97 . . 0.50 . . . 150 GLU CA . 150 GLU CB . 15909 4 78 1JCACB . 1 1 153 153 LYS CA C 13 . . 1 1 153 153 LYS CB C 13 . 37.53 . . 0.50 . . . 151 LYS CA . 151 LYS CB . 15909 4 79 1JCACB . 1 1 154 154 PHE CA C 13 . . 1 1 154 154 PHE CB C 13 . 35.14 . . 0.50 . . . 152 PHE CA . 152 PHE CB . 15909 4 80 1JCACB . 1 1 160 160 PHE CA C 13 . . 1 1 160 160 PHE CB C 13 . 36.45 . . 0.50 . . . 158 PHE CA . 158 PHE CB . 15909 4 81 1JCACB . 1 1 161 161 THR CA C 13 . . 1 1 161 161 THR CB C 13 . 37.34 . . 0.50 . . . 159 THR CA . 159 THR CB . 15909 4 82 1JCACB . 1 1 162 162 THR CA C 13 . . 1 1 162 162 THR CB C 13 . 39.33 . . 0.50 . . . 160 THR CA . 160 THR CB . 15909 4 83 1JCACB . 1 1 163 163 ASP CA C 13 . . 1 1 163 163 ASP CB C 13 . 37.33 . . 0.50 . . . 161 ASP CA . 161 ASP CB . 15909 4 84 1JCACB . 1 1 165 165 GLN CA C 13 . . 1 1 165 165 GLN CB C 13 . 34.69 . . 0.50 . . . 163 GLN CA . 163 GLN CB . 15909 4 85 1JCACB . 1 1 167 167 ILE CA C 13 . . 1 1 167 167 ILE CB C 13 . 34.50 . . 0.50 . . . 165 ILE CA . 165 ILE CB . 15909 4 86 1JCACB . 1 1 169 169 VAL CA C 13 . . 1 1 169 169 VAL CB C 13 . 34.06 . . 0.50 . . . 167 VAL CA . 167 VAL CB . 15909 4 87 1JCACB . 1 1 170 170 ASP CA C 13 . . 1 1 170 170 ASP CB C 13 . 36.39 . . 0.50 . . . 168 ASP CA . 168 ASP CB . 15909 4 88 1JCACB . 1 1 171 171 THR CA C 13 . . 1 1 171 171 THR CB C 13 . 38.41 . . 0.50 . . . 169 THR CA . 169 THR CB . 15909 4 89 1JCACB . 1 1 172 172 ALA CA C 13 . . 1 1 172 172 ALA CB C 13 . 38.47 . . 0.50 . . . 170 ALA CA . 170 ALA CB . 15909 4 90 1JCACB . 1 1 173 173 PHE CA C 13 . . 1 1 173 173 PHE CB C 13 . 33.56 . . 0.50 . . . 171 PHE CA . 171 PHE CB . 15909 4 91 1JCACB . 1 1 174 174 GLN CA C 13 . . 1 1 174 174 GLN CB C 13 . 39.44 . . 0.50 . . . 172 GLN CA . 172 GLN CB . 15909 4 92 1JCACB . 1 1 180 180 ALA CA C 13 . . 1 1 180 180 ALA CB C 13 . 33.60 . . 0.50 . . . 178 ALA CA . 178 ALA CB . 15909 4 93 1JCACB . 1 1 182 182 ARG CA C 13 . . 1 1 182 182 ARG CB C 13 . 34.04 . . 0.50 . . . 180 ARG CA . 180 ARG CB . 15909 4 94 1JCACB . 1 1 183 183 HIS CA C 13 . . 1 1 183 183 HIS CB C 13 . 33.13 . . 0.50 . . . 181 HIS CA . 181 HIS CB . 15909 4 95 1JCACB . 1 1 185 185 ASN CA C 13 . . 1 1 185 185 ASN CB C 13 . 35.77 . . 0.50 . . . 183 ASN CA . 183 ASN CB . 15909 4 96 1JCACB . 1 1 186 186 ASP CA C 13 . . 1 1 186 186 ASP CB C 13 . 37.61 . . 0.50 . . . 184 ASP CA . 184 ASP CB . 15909 4 97 1JCACB . 1 1 189 189 PRO CA C 13 . . 1 1 189 189 PRO CB C 13 . 32.77 . . 0.50 . . . 187 PRO CA . 187 PRO CB . 15909 4 98 1JCACB . 1 1 190 190 TYR CA C 13 . . 1 1 190 190 TYR CB C 13 . 32.49 . . 0.50 . . . 188 TYR CA . 188 TYR CB . 15909 4 99 1JCACB . 1 1 195 195 ALA CA C 13 . . 1 1 195 195 ALA CB C 13 . 34.22 . . 0.50 . . . 193 ALA CA . 193 ALA CB . 15909 4 100 1JCACB . 1 1 196 196 GLU CA C 13 . . 1 1 196 196 GLU CB C 13 . 37.76 . . 0.50 . . . 194 GLU CA . 194 GLU CB . 15909 4 101 1JCACB . 1 1 198 198 PRO CA C 13 . . 1 1 198 198 PRO CB C 13 . 32.06 . . 0.50 . . . 196 PRO CA . 196 PRO CB . 15909 4 102 1JCACB . 1 1 199 199 THR CA C 13 . . 1 1 199 199 THR CB C 13 . 41.23 . . 0.50 . . . 197 THR CA . 197 THR CB . 15909 4 103 1JCACB . 1 1 205 205 TYR CA C 13 . . 1 1 205 205 TYR CB C 13 . 31.93 . . 0.50 . . . 203 TYR CA . 203 TYR CB . 15909 4 104 1JCACB . 1 1 206 206 ASP CA C 13 . . 1 1 206 206 ASP CB C 13 . 36.59 . . 0.50 . . . 204 ASP CA . 204 ASP CB . 15909 4 105 1JCACB . 1 1 207 207 ILE CA C 13 . . 1 1 207 207 ILE CB C 13 . 35.33 . . 0.50 . . . 205 ILE CA . 205 ILE CB . 15909 4 106 1JCACB . 1 1 208 208 LYS CA C 13 . . 1 1 208 208 LYS CB C 13 . 34.90 . . 0.50 . . . 206 LYS CA . 206 LYS CB . 15909 4 107 1JCACB . 1 1 210 210 PRO CA C 13 . . 1 1 210 210 PRO CB C 13 . 33.65 . . 0.50 . . . 208 PRO CA . 208 PRO CB . 15909 4 108 1JCACB . 1 1 211 211 ALA CA C 13 . . 1 1 211 211 ALA CB C 13 . 38.98 . . 0.50 . . . 209 ALA CA . 209 ALA CB . 15909 4 109 1JCACB . 1 1 212 212 LYS CA C 13 . . 1 1 212 212 LYS CB C 13 . 35.68 . . 0.50 . . . 210 LYS CA . 210 LYS CB . 15909 4 110 1JCACB . 1 1 213 213 ILE CA C 13 . . 1 1 213 213 ILE CB C 13 . 33.17 . . 0.50 . . . 211 ILE CA . 211 ILE CB . 15909 4 111 1JCACB . 1 1 214 214 GLU CA C 13 . . 1 1 214 214 GLU CB C 13 . 33.34 . . 0.50 . . . 212 GLU CA . 212 GLU CB . 15909 4 112 1JCACB . 1 1 215 215 ASN CA C 13 . . 1 1 215 215 ASN CB C 13 . 41.92 . . 0.50 . . . 213 ASN CA . 213 ASN CB . 15909 4 113 1JCACB . 1 1 216 216 LYS CA C 13 . . 1 1 216 216 LYS CB C 13 . 33.55 . . 0.50 . . . 214 LYS CA . 214 LYS CB . 15909 4 114 1JCACB . 1 1 217 217 LYS CA C 13 . . 1 1 217 217 LYS CB C 13 . 31.97 . . 0.50 . . . 215 LYS CA . 215 LYS CB . 15909 4 115 1JCACB . 1 1 218 218 VAL CA C 13 . . 1 1 218 218 VAL CB C 13 . 34.60 . . 0.50 . . . 216 VAL CA . 216 VAL CB . 15909 4 116 1JCACB . 1 1 219 219 TRP CA C 13 . . 1 1 219 219 TRP CB C 13 . 32.61 . . 0.50 . . . 217 TRP CA . 217 TRP CB . 15909 4 117 1JCACB . 1 1 221 221 HIS CA C 13 . . 1 1 221 221 HIS CB C 13 . 34.01 . . 0.50 . . . 219 HIS CA . 219 HIS CB . 15909 4 118 1JCACB . 1 1 223 223 PRO CA C 13 . . 1 1 223 223 PRO CB C 13 . 31.66 . . 0.50 . . . 221 PRO CA . 221 PRO CB . 15909 4 119 1JCACB . 1 1 225 225 THR CA C 13 . . 1 1 225 225 THR CB C 13 . 41.12 . . 0.50 . . . 223 THR CA . 223 THR CB . 15909 4 120 1JCACB . 1 1 226 226 HIS CA C 13 . . 1 1 226 226 HIS CB C 13 . 31.57 . . 0.50 . . . 224 HIS CA . 224 HIS CB . 15909 4 121 1JCACB . 1 1 227 227 GLU CA C 13 . . 1 1 227 227 GLU CB C 13 . 35.00 . . 0.50 . . . 225 GLU CA . 225 GLU CB . 15909 4 122 1JCACB . 1 1 234 234 ASP CA C 13 . . 1 1 234 234 ASP CB C 13 . 34.32 . . 0.50 . . . 232 ASP CA . 232 ASP CB . 15909 4 123 1JCACB . 1 1 236 236 ASP CA C 13 . . 1 1 236 236 ASP CB C 13 . 37.64 . . 0.50 . . . 234 ASP CA . 234 ASP CB . 15909 4 124 1JCACB . 1 1 237 237 GLU CA C 13 . . 1 1 237 237 GLU CB C 13 . 32.78 . . 0.50 . . . 235 GLU CA . 235 GLU CB . 15909 4 125 1JCACB . 1 1 238 238 ASP CA C 13 . . 1 1 238 238 ASP CB C 13 . 39.59 . . 0.50 . . . 236 ASP CA . 236 ASP CB . 15909 4 126 1JCACB . 1 1 239 239 ASN CA C 13 . . 1 1 239 239 ASN CB C 13 . 40.34 . . 0.50 . . . 237 ASN CA . 237 ASN CB . 15909 4 127 1JCACB . 1 1 246 246 TRP CA C 13 . . 1 1 246 246 TRP CB C 13 . 35.31 . . 0.50 . . . 244 TRP CA . 244 TRP CB . 15909 4 128 1JCACB . 1 1 248 248 SER CA C 13 . . 1 1 248 248 SER CB C 13 . 35.72 . . 0.50 . . . 246 SER CA . 246 SER CB . 15909 4 129 1JCACB . 1 1 249 249 SER CA C 13 . . 1 1 249 249 SER CB C 13 . 45.53 . . 0.50 . . . 247 SER CA . 247 SER CB . 15909 4 130 1JCACB . 1 1 254 254 PHE CA C 13 . . 1 1 254 254 PHE CB C 13 . 32.60 . . 0.50 . . . 252 PHE CA . 252 PHE CB . 15909 4 131 1JCACB . 1 1 256 256 PRO CA C 13 . . 1 1 256 256 PRO CB C 13 . 32.17 . . 0.50 . . . 254 PRO CA . 254 PRO CB . 15909 4 132 1JCACB . 1 1 257 257 ASP CA C 13 . . 1 1 257 257 ASP CB C 13 . 36.81 . . 0.50 . . . 255 ASP CA . 255 ASP CB . 15909 4 133 1JCACB . 1 1 261 261 PRO CA C 13 . . 1 1 261 261 PRO CB C 13 . 32.33 . . 0.50 . . . 259 PRO CA . 259 PRO CB . 15909 4 134 1JCACB . 1 1 263 263 MET CA C 13 . . 1 1 263 263 MET CB C 13 . 32.03 . . 0.50 . . . 261 MET CA . 261 MET CB . 15909 4 135 1JCACB . 1 1 265 265 ILE CA C 13 . . 1 1 265 265 ILE CB C 13 . 36.00 . . 0.50 . . . 263 ILE CA . 263 ILE CB . 15909 4 136 1JCACB . 1 1 268 268 PRO CA C 13 . . 1 1 268 268 PRO CB C 13 . 35.44 . . 0.50 . . . 266 PRO CA . 266 PRO CB . 15909 4 137 1JCACB . 1 1 269 269 PHE CA C 13 . . 1 1 269 269 PHE CB C 13 . 31.10 . . 0.50 . . . 267 PHE CA . 267 PHE CB . 15909 4 138 1JCACB . 1 1 270 270 GLU CA C 13 . . 1 1 270 270 GLU CB C 13 . 32.86 . . 0.50 . . . 268 GLU CA . 268 GLU CB . 15909 4 139 1JCACB . 1 1 274 274 ASN CA C 13 . . 1 1 274 274 ASN CB C 13 . 37.29 . . 0.50 . . . 272 ASN CA . 272 ASN CB . 15909 4 140 1JCACB . 1 1 276 276 HIS CA C 13 . . 1 1 276 276 HIS CB C 13 . 33.46 . . 0.50 . . . 274 HIS CA . 274 HIS CB . 15909 4 141 1JCACB . 1 1 279 279 PRO CA C 13 . . 1 1 279 279 PRO CB C 13 . 32.28 . . 0.50 . . . 277 PRO CA . 277 PRO CB . 15909 4 142 1JCACB . 1 1 280 280 GLN CA C 13 . . 1 1 280 280 GLN CB C 13 . 38.22 . . 0.50 . . . 278 GLN CA . 278 GLN CB . 15909 4 143 1JCACB . 1 1 281 281 THR CA C 13 . . 1 1 281 281 THR CB C 13 . 34.64 . . 0.50 . . . 279 THR CA . 279 THR CB . 15909 4 144 1JCACB . 1 1 282 282 LYS CA C 13 . . 1 1 282 282 LYS CB C 13 . 36.22 . . 0.50 . . . 280 LYS CA . 280 LYS CB . 15909 4 145 1JCACB . 1 1 288 288 GLU CA C 13 . . 1 1 288 288 GLU CB C 13 . 32.46 . . 0.50 . . . 286 GLU CA . 286 GLU CB . 15909 4 146 1JCACB . 1 1 289 289 HIS CA C 13 . . 1 1 289 289 HIS CB C 13 . 36.66 . . 0.50 . . . 287 HIS CA . 287 HIS CB . 15909 4 147 1JCACB . 1 1 290 290 GLU CA C 13 . . 1 1 290 290 GLU CB C 13 . 34.56 . . 0.50 . . . 288 GLU CA . 288 GLU CB . 15909 4 148 1JCACB . 1 1 291 291 ASN CA C 13 . . 1 1 291 291 ASN CB C 13 . 33.88 . . 0.50 . . . 289 ASN CA . 289 ASN CB . 15909 4 149 1JCACB . 1 1 292 292 ASN CA C 13 . . 1 1 292 292 ASN CB C 13 . 40.65 . . 0.50 . . . 290 ASN CA . 290 ASN CB . 15909 4 150 1JCACB . 1 1 297 297 PHE CA C 13 . . 1 1 297 297 PHE CB C 13 . 32.33 . . 0.50 . . . 295 PHE CA . 295 PHE CB . 15909 4 151 1JCACB . 1 1 299 299 TRP CA C 13 . . 1 1 299 299 TRP CB C 13 . 33.69 . . 0.50 . . . 297 TRP CA . 297 TRP CB . 15909 4 152 1JCACB . 1 1 300 300 GLN CA C 13 . . 1 1 300 300 GLN CB C 13 . 33.98 . . 0.50 . . . 298 GLN CA . 298 GLN CB . 15909 4 153 1JCACB . 1 1 301 301 ARG CA C 13 . . 1 1 301 301 ARG CB C 13 . 33.55 . . 0.50 . . . 299 ARG CA . 299 ARG CB . 15909 4 154 1JCACB . 1 1 302 302 ASN CA C 13 . . 1 1 302 302 ASN CB C 13 . 35.23 . . 0.50 . . . 300 ASN CA . 300 ASN CB . 15909 4 155 1JCACB . 1 1 304 304 LYS CA C 13 . . 1 1 304 304 LYS CB C 13 . 33.17 . . 0.50 . . . 302 LYS CA . 302 LYS CB . 15909 4 156 1JCACB . 1 1 305 305 LYS CA C 13 . . 1 1 305 305 LYS CB C 13 . 33.59 . . 0.50 . . . 303 LYS CA . 303 LYS CB . 15909 4 157 1JCACB . 1 1 306 306 GLN CA C 13 . . 1 1 306 306 GLN CB C 13 . 33.26 . . 0.50 . . . 304 GLN CA . 304 GLN CB . 15909 4 158 1JCACB . 1 1 307 307 TYR CA C 13 . . 1 1 307 307 TYR CB C 13 . 32.44 . . 0.50 . . . 305 TYR CA . 305 TYR CB . 15909 4 159 1JCACB . 1 1 308 308 CYS CA C 13 . . 1 1 308 308 CYS CB C 13 . 35.54 . . 0.50 . . . 306 CYS CA . 306 CYS CB . 15909 4 160 1JCACB . 1 1 310 310 THR CA C 13 . . 1 1 310 310 THR CB C 13 . 36.61 . . 0.50 . . . 308 THR CA . 308 THR CB . 15909 4 stop_ save_