data_26845 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26845 _Entry.Title ; Field dependent R1 and R2 relaxation in B3 domain of protein G (GB3) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-07-05 _Entry.Accession_date 2016-07-05 _Entry.Last_release_date 2016-07-05 _Entry.Original_release_date 2016-07-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Griselda Hernandez . . . . 26845 2 David LeMaster . M. . . 26845 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Wadsworth Center/NYS Department of Health' . 26845 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID heteronucl_T1_relaxation 4 26845 heteronucl_T2_relaxation 4 26845 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'T1 relaxation values' 204 26845 'T2 relaxation values' 204 26845 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-12-29 . original BMRB . 26845 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 15283 'B3 Immunoglobulin-Binding Domain of Streptococcal Protein G (GB3) by MAS-NMR' 26845 BMRB 18531 'Three-State Ensemble obtained from eNOEs of the Third Immunoglobulin Binding Domain of Protein G (GB3)' 26845 BMRB 2575 'Sequence-Specific 1H NMR Assignments and Secondary Structure of the Streptococcal Protein G B2-Domain' 26845 BMRB 25807 'Sidechain chi1 distribution in B3 domain of protein G' 26845 BMRB 5569 '15N relaxation rates for backbone of GB1' 26845 BMRB 5839 'Differentiating Between Conformational Exchange and Anisotropic Diffusion in the B3 Domain of Protein G' 26845 GB AAA26921 . 26845 GB AAB27024 . 26845 GB ABL60854 . 26845 GB ABL60859 . 26845 GB ABO76907 . 26845 PDB 1IGC . 26845 PDB 1IGD . 26845 PDB 1P7E . 26845 PDB 1PGX . 26845 PDB 2IGD . 26845 PDB 2IGH . 26845 PDB 2LUM . 26845 PDB 2N7J . 26845 PDB 2NMQ . 26845 PDB 2OED . 26845 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26845 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27734179 _Citation.Full_citation . _Citation.Title ; Quantifying protein dynamics in the ps-ns time regime by NMR relaxation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 66 _Citation.Journal_issue 3 _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 163 _Citation.Page_last 174 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Griselda Hernandez . . . . 26845 1 2 David LeMaster . M. . . 26845 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID GB3 26845 1 'chemical shift anisotropy' 26845 1 'exchange linebroadening' 26845 1 'field strength dependence' 26845 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26845 _Assembly.ID 1 _Assembly.Name GB3 _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 6207.8 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 GB3 1 $GB3 A . yes native no no 1 . . 26845 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 2IGD . . X-ray . . . 26845 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'immunoglobulin binding domain' 26845 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_GB3 _Entity.Sf_category entity _Entity.Sf_framecode GB3 _Entity.Entry_ID 26845 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name GB3 _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 ; MQYKLVINGKTLKGETTTKA VDAETAEKAFKQYANDNGVD GVWTYDDATKTFTVTE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 56 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'B3 domain of protein G' _Entity.Mutation T2Q _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 6207.8 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes GB AAA26921 . . . . . . . . . . . . . . . . 26845 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'immunoglobin binding domain' 26845 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 . MET . 26845 1 2 . GLN . 26845 1 3 . TYR . 26845 1 4 . LYS . 26845 1 5 . LEU . 26845 1 6 . VAL . 26845 1 7 . ILE . 26845 1 8 . ASN . 26845 1 9 . GLY . 26845 1 10 . LYS . 26845 1 11 . THR . 26845 1 12 . LEU . 26845 1 13 . LYS . 26845 1 14 . GLY . 26845 1 15 . GLU . 26845 1 16 . THR . 26845 1 17 . THR . 26845 1 18 . THR . 26845 1 19 . LYS . 26845 1 20 . ALA . 26845 1 21 . VAL . 26845 1 22 . ASP . 26845 1 23 . ALA . 26845 1 24 . GLU . 26845 1 25 . THR . 26845 1 26 . ALA . 26845 1 27 . GLU . 26845 1 28 . LYS . 26845 1 29 . ALA . 26845 1 30 . PHE . 26845 1 31 . LYS . 26845 1 32 . GLN . 26845 1 33 . TYR . 26845 1 34 . ALA . 26845 1 35 . ASN . 26845 1 36 . ASP . 26845 1 37 . ASN . 26845 1 38 . GLY . 26845 1 39 . VAL . 26845 1 40 . ASP . 26845 1 41 . GLY . 26845 1 42 . VAL . 26845 1 43 . TRP . 26845 1 44 . THR . 26845 1 45 . TYR . 26845 1 46 . ASP . 26845 1 47 . ASP . 26845 1 48 . ALA . 26845 1 49 . THR . 26845 1 50 . LYS . 26845 1 51 . THR . 26845 1 52 . PHE . 26845 1 53 . THR . 26845 1 54 . VAL . 26845 1 55 . THR . 26845 1 56 . GLU . 26845 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26845 1 . GLN 2 2 26845 1 . TYR 3 3 26845 1 . LYS 4 4 26845 1 . LEU 5 5 26845 1 . VAL 6 6 26845 1 . ILE 7 7 26845 1 . ASN 8 8 26845 1 . GLY 9 9 26845 1 . LYS 10 10 26845 1 . THR 11 11 26845 1 . LEU 12 12 26845 1 . LYS 13 13 26845 1 . GLY 14 14 26845 1 . GLU 15 15 26845 1 . THR 16 16 26845 1 . THR 17 17 26845 1 . THR 18 18 26845 1 . LYS 19 19 26845 1 . ALA 20 20 26845 1 . VAL 21 21 26845 1 . ASP 22 22 26845 1 . ALA 23 23 26845 1 . GLU 24 24 26845 1 . THR 25 25 26845 1 . ALA 26 26 26845 1 . GLU 27 27 26845 1 . LYS 28 28 26845 1 . ALA 29 29 26845 1 . PHE 30 30 26845 1 . LYS 31 31 26845 1 . GLN 32 32 26845 1 . TYR 33 33 26845 1 . ALA 34 34 26845 1 . ASN 35 35 26845 1 . ASP 36 36 26845 1 . ASN 37 37 26845 1 . GLY 38 38 26845 1 . VAL 39 39 26845 1 . ASP 40 40 26845 1 . GLY 41 41 26845 1 . VAL 42 42 26845 1 . TRP 43 43 26845 1 . THR 44 44 26845 1 . TYR 45 45 26845 1 . ASP 46 46 26845 1 . ASP 47 47 26845 1 . ALA 48 48 26845 1 . THR 49 49 26845 1 . LYS 50 50 26845 1 . THR 51 51 26845 1 . PHE 52 52 26845 1 . THR 53 53 26845 1 . VAL 54 54 26845 1 . THR 55 55 26845 1 . GLU 56 56 26845 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26845 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $GB3 . 1301 organism . Streptococcus Streptococcus . . Bacteria . Streptococcus . 'group G' . . . . . . . . . . . . 26845 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 26845 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $GB3 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli K12 BL21Star(DE3) . . . . pET11a . . . 26845 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26845 _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 GB3 '[U-99% 15N]' . . 1 $GB3 . . 2 . . mM . . . . 26845 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 26845 1 3 'sodium azide' 'natural abundance' . . . . . . 0.01 . . % . . . . 26845 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 26845 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 30 . mM 26845 1 pH 6.3 . pH 26845 1 pressure 1 . atm 26845 1 temperature 298 . K 26845 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 26845 _Software.ID 1 _Software.Name Felix _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Felix NMR' . . 26845 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26845 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26845 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 26845 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 26845 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 26845 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 26845 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 500 . . . 26845 1 2 spectrometer_2 Bruker Avance . 600 . . . 26845 1 3 spectrometer_3 Bruker Avance . 800 . . . 26845 1 4 spectrometer_4 Bruker Avance . 900 . . . 26845 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 26845 _Experiment_list.ID 1 _Experiment_list.Details '15N R1 and R1p (HSQC-based) pulse sequences as described in Lakomek et al. (2012) J Biomol NMR 53, 209.' 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 T1_relaxation_500 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26845 1 2 T1_relaxation_600 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26845 1 3 T1_relaxation_800 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26845 1 4 T1_relaxation_900 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 26845 1 5 T2_relaxation_500 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26845 1 6 T2_relaxation_600 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26845 1 7 T2_relaxation_800 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26845 1 8 T2_relaxation_900 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 26845 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_GB3_15N_T1_relaxation_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode GB3_15N_T1_relaxation_1 _Heteronucl_T1_list.Entry_ID 26845 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 500 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 1 T1_relaxation_500 . . . 26845 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $Felix . . 26845 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 GLN N N 15 2.503 0.105 . . . . . 26845 1 2 . 1 1 3 3 TYR N N 15 2.632 0.024 . . . . . 26845 1 3 . 1 1 4 4 LYS N N 15 2.770 0.024 . . . . . 26845 1 4 . 1 1 5 5 LEU N N 15 2.797 0.020 . . . . . 26845 1 5 . 1 1 6 6 VAL N N 15 2.747 0.017 . . . . . 26845 1 6 . 1 1 7 7 ILE N N 15 2.732 0.018 . . . . . 26845 1 7 . 1 1 8 8 ASN N N 15 2.725 0.016 . . . . . 26845 1 8 . 1 1 9 9 GLY N N 15 2.667 0.017 . . . . . 26845 1 9 . 1 1 10 10 LYS N N 15 2.538 0.016 . . . . . 26845 1 10 . 1 1 11 11 THR N N 15 2.418 0.023 . . . . . 26845 1 11 . 1 1 12 12 LEU N N 15 2.088 0.013 . . . . . 26845 1 12 . 1 1 13 13 LYS N N 15 2.481 0.016 . . . . . 26845 1 13 . 1 1 14 14 GLY N N 15 2.345 0.015 . . . . . 26845 1 14 . 1 1 16 16 THR N N 15 2.663 0.017 . . . . . 26845 1 15 . 1 1 17 17 THR N N 15 2.554 0.026 . . . . . 26845 1 16 . 1 1 18 18 THR N N 15 2.706 0.017 . . . . . 26845 1 17 . 1 1 19 19 LYS N N 15 2.475 0.032 . . . . . 26845 1 18 . 1 1 20 20 ALA N N 15 2.581 0.023 . . . . . 26845 1 19 . 1 1 21 21 VAL N N 15 2.663 0.035 . . . . . 26845 1 20 . 1 1 22 22 ASP N N 15 2.674 0.017 . . . . . 26845 1 21 . 1 1 23 23 ALA N N 15 2.729 0.018 . . . . . 26845 1 22 . 1 1 24 24 GLU N N 15 2.591 0.019 . . . . . 26845 1 23 . 1 1 26 26 ALA N N 15 2.829 0.020 . . . . . 26845 1 24 . 1 1 28 28 LYS N N 15 2.755 0.017 . . . . . 26845 1 25 . 1 1 29 29 ALA N N 15 2.786 0.017 . . . . . 26845 1 26 . 1 1 30 30 PHE N N 15 2.789 0.017 . . . . . 26845 1 27 . 1 1 31 31 LYS N N 15 2.817 0.018 . . . . . 26845 1 28 . 1 1 32 32 GLN N N 15 2.740 0.029 . . . . . 26845 1 29 . 1 1 33 33 TYR N N 15 2.778 0.017 . . . . . 26845 1 30 . 1 1 34 34 ALA N N 15 2.837 0.018 . . . . . 26845 1 31 . 1 1 36 36 ASP N N 15 2.751 0.017 . . . . . 26845 1 32 . 1 1 37 37 ASN N N 15 2.594 0.016 . . . . . 26845 1 33 . 1 1 38 38 GLY N N 15 2.674 0.017 . . . . . 26845 1 34 . 1 1 39 39 VAL N N 15 2.618 0.016 . . . . . 26845 1 35 . 1 1 40 40 ASP N N 15 2.326 0.016 . . . . . 26845 1 36 . 1 1 41 41 GLY N N 15 1.957 0.012 . . . . . 26845 1 37 . 1 1 42 42 VAL N N 15 2.674 0.017 . . . . . 26845 1 38 . 1 1 43 43 TRP N N 15 2.674 0.017 . . . . . 26845 1 39 . 1 1 44 44 THR N N 15 2.725 0.029 . . . . . 26845 1 40 . 1 1 45 45 TYR N N 15 2.591 0.027 . . . . . 26845 1 41 . 1 1 46 46 ASP N N 15 2.628 0.015 . . . . . 26845 1 42 . 1 1 47 47 ASP N N 15 2.604 0.030 . . . . . 26845 1 43 . 1 1 48 48 ALA N N 15 2.454 0.028 . . . . . 26845 1 44 . 1 1 49 49 THR N N 15 2.594 0.038 . . . . . 26845 1 45 . 1 1 50 50 LYS N N 15 2.778 0.024 . . . . . 26845 1 46 . 1 1 51 51 THR N N 15 2.695 0.020 . . . . . 26845 1 47 . 1 1 52 52 PHE N N 15 2.786 0.020 . . . . . 26845 1 48 . 1 1 53 53 THR N N 15 2.685 0.018 . . . . . 26845 1 49 . 1 1 54 54 VAL N N 15 2.809 0.018 . . . . . 26845 1 50 . 1 1 55 55 THR N N 15 2.732 0.017 . . . . . 26845 1 51 . 1 1 56 56 GLU N N 15 2.681 0.017 . . . . . 26845 1 stop_ save_ save_GB3_15N_T1_relaxation_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode GB3_15N_T1_relaxation_2 _Heteronucl_T1_list.Entry_ID 26845 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 2 T1_relaxation_600 . . . 26845 2 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $Felix . . 26845 2 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 GLN N N 15 2.156 0.032 . . . . . 26845 2 2 . 1 1 3 3 TYR N N 15 2.317 0.008 . . . . . 26845 2 3 . 1 1 4 4 LYS N N 15 2.425 0.008 . . . . . 26845 2 4 . 1 1 5 5 LEU N N 15 2.472 0.011 . . . . . 26845 2 5 . 1 1 6 6 VAL N N 15 2.421 0.010 . . . . . 26845 2 6 . 1 1 7 7 ILE N N 15 2.401 0.014 . . . . . 26845 2 7 . 1 1 8 8 ASN N N 15 2.382 0.013 . . . . . 26845 2 8 . 1 1 9 9 GLY N N 15 2.341 0.019 . . . . . 26845 2 9 . 1 1 10 10 LYS N N 15 2.255 0.007 . . . . . 26845 2 10 . 1 1 11 11 THR N N 15 2.133 0.007 . . . . . 26845 2 11 . 1 1 12 12 LEU N N 15 1.902 0.006 . . . . . 26845 2 12 . 1 1 13 13 LYS N N 15 2.180 0.007 . . . . . 26845 2 13 . 1 1 14 14 GLY N N 15 2.066 0.007 . . . . . 26845 2 14 . 1 1 16 16 THR N N 15 2.331 0.008 . . . . . 26845 2 15 . 1 1 17 17 THR N N 15 2.251 0.010 . . . . . 26845 2 16 . 1 1 18 18 THR N N 15 2.364 0.008 . . . . . 26845 2 17 . 1 1 19 19 LYS N N 15 2.164 0.009 . . . . . 26845 2 18 . 1 1 20 20 ALA N N 15 2.266 0.007 . . . . . 26845 2 19 . 1 1 21 21 VAL N N 15 2.323 0.008 . . . . . 26845 2 20 . 1 1 22 22 ASP N N 15 2.382 0.008 . . . . . 26845 2 21 . 1 1 23 23 ALA N N 15 2.373 0.008 . . . . . 26845 2 22 . 1 1 24 24 GLU N N 15 2.254 0.007 . . . . . 26845 2 23 . 1 1 26 26 ALA N N 15 2.487 0.010 . . . . . 26845 2 24 . 1 1 28 28 LYS N N 15 2.381 0.009 . . . . . 26845 2 25 . 1 1 29 29 ALA N N 15 2.428 0.008 . . . . . 26845 2 26 . 1 1 30 30 PHE N N 15 2.411 0.008 . . . . . 26845 2 27 . 1 1 31 31 LYS N N 15 2.445 0.008 . . . . . 26845 2 28 . 1 1 32 32 GLN N N 15 2.380 0.008 . . . . . 26845 2 29 . 1 1 33 33 TYR N N 15 2.425 0.010 . . . . . 26845 2 30 . 1 1 34 34 ALA N N 15 2.472 0.008 . . . . . 26845 2 31 . 1 1 36 36 ASP N N 15 2.371 0.008 . . . . . 26845 2 32 . 1 1 37 37 ASN N N 15 2.278 0.007 . . . . . 26845 2 33 . 1 1 38 38 GLY N N 15 2.353 0.008 . . . . . 26845 2 34 . 1 1 39 39 VAL N N 15 2.293 0.007 . . . . . 26845 2 35 . 1 1 40 40 ASP N N 15 2.033 0.007 . . . . . 26845 2 36 . 1 1 41 41 GLY N N 15 1.731 0.006 . . . . . 26845 2 37 . 1 1 42 42 VAL N N 15 2.350 0.011 . . . . . 26845 2 38 . 1 1 43 43 TRP N N 15 2.374 0.008 . . . . . 26845 2 39 . 1 1 44 44 THR N N 15 2.398 0.008 . . . . . 26845 2 40 . 1 1 45 45 TYR N N 15 2.284 0.010 . . . . . 26845 2 41 . 1 1 46 46 ASP N N 15 2.371 0.008 . . . . . 26845 2 42 . 1 1 47 47 ASP N N 15 2.280 0.012 . . . . . 26845 2 43 . 1 1 48 48 ALA N N 15 2.153 0.009 . . . . . 26845 2 44 . 1 1 49 49 THR N N 15 2.239 0.007 . . . . . 26845 2 45 . 1 1 50 50 LYS N N 15 2.474 0.008 . . . . . 26845 2 46 . 1 1 51 51 THR N N 15 2.387 0.010 . . . . . 26845 2 47 . 1 1 52 52 PHE N N 15 2.448 0.008 . . . . . 26845 2 48 . 1 1 53 53 THR N N 15 2.371 0.013 . . . . . 26845 2 49 . 1 1 54 54 VAL N N 15 2.475 0.008 . . . . . 26845 2 50 . 1 1 55 55 THR N N 15 2.385 0.012 . . . . . 26845 2 51 . 1 1 56 56 GLU N N 15 2.380 0.015 . . . . . 26845 2 stop_ save_ save_GB3_15N_T1_relaxation_3 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode GB3_15N_T1_relaxation_3 _Heteronucl_T1_list.Entry_ID 26845 _Heteronucl_T1_list.ID 3 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 3 T1_relaxation_800 . . . 26845 3 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $Felix . . 26845 3 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 GLN N N 15 1.678 0.032 . . . . . 26845 3 2 . 1 1 3 3 TYR N N 15 1.910 0.010 . . . . . 26845 3 3 . 1 1 4 4 LYS N N 15 2.010 0.013 . . . . . 26845 3 4 . 1 1 5 5 LEU N N 15 2.055 0.012 . . . . . 26845 3 5 . 1 1 6 6 VAL N N 15 1.988 0.010 . . . . . 26845 3 6 . 1 1 7 7 ILE N N 15 2.001 0.020 . . . . . 26845 3 7 . 1 1 8 8 ASN N N 15 1.952 0.011 . . . . . 26845 3 8 . 1 1 9 9 GLY N N 15 1.943 0.010 . . . . . 26845 3 9 . 1 1 10 10 LYS N N 15 1.899 0.009 . . . . . 26845 3 10 . 1 1 11 11 THR N N 15 1.757 0.009 . . . . . 26845 3 11 . 1 1 12 12 LEU N N 15 1.631 0.008 . . . . . 26845 3 12 . 1 1 13 13 LYS N N 15 1.840 0.013 . . . . . 26845 3 13 . 1 1 14 14 GLY N N 15 1.754 0.009 . . . . . 26845 3 14 . 1 1 16 16 THR N N 15 1.936 0.010 . . . . . 26845 3 15 . 1 1 17 17 THR N N 15 1.812 0.013 . . . . . 26845 3 16 . 1 1 18 18 THR N N 15 1.956 0.010 . . . . . 26845 3 17 . 1 1 19 19 LYS N N 15 1.753 0.010 . . . . . 26845 3 18 . 1 1 20 20 ALA N N 15 1.866 0.009 . . . . . 26845 3 19 . 1 1 21 21 VAL N N 15 1.877 0.009 . . . . . 26845 3 20 . 1 1 22 22 ASP N N 15 1.990 0.020 . . . . . 26845 3 21 . 1 1 23 23 ALA N N 15 1.941 0.016 . . . . . 26845 3 22 . 1 1 24 24 GLU N N 15 1.848 0.009 . . . . . 26845 3 23 . 1 1 26 26 ALA N N 15 2.050 0.013 . . . . . 26845 3 24 . 1 1 28 28 LYS N N 15 1.905 0.010 . . . . . 26845 3 25 . 1 1 29 29 ALA N N 15 1.978 0.012 . . . . . 26845 3 26 . 1 1 30 30 PHE N N 15 1.968 0.012 . . . . . 26845 3 27 . 1 1 31 31 LYS N N 15 2.002 0.010 . . . . . 26845 3 28 . 1 1 32 32 GLN N N 15 1.946 0.010 . . . . . 26845 3 29 . 1 1 33 33 TYR N N 15 1.990 0.010 . . . . . 26845 3 30 . 1 1 34 34 ALA N N 15 2.065 0.010 . . . . . 26845 3 31 . 1 1 36 36 ASP N N 15 1.972 0.012 . . . . . 26845 3 32 . 1 1 37 37 ASN N N 15 1.876 0.018 . . . . . 26845 3 33 . 1 1 38 38 GLY N N 15 1.975 0.010 . . . . . 26845 3 34 . 1 1 39 39 VAL N N 15 1.911 0.010 . . . . . 26845 3 35 . 1 1 40 40 ASP N N 15 1.722 0.009 . . . . . 26845 3 36 . 1 1 41 41 GLY N N 15 1.517 0.008 . . . . . 26845 3 37 . 1 1 42 42 VAL N N 15 1.940 0.010 . . . . . 26845 3 38 . 1 1 43 43 TRP N N 15 1.998 0.010 . . . . . 26845 3 39 . 1 1 44 44 THR N N 15 1.975 0.023 . . . . . 26845 3 40 . 1 1 45 45 TYR N N 15 1.855 0.009 . . . . . 26845 3 41 . 1 1 46 46 ASP N N 15 1.929 0.011 . . . . . 26845 3 42 . 1 1 47 47 ASP N N 15 1.847 0.010 . . . . . 26845 3 43 . 1 1 48 48 ALA N N 15 1.819 0.015 . . . . . 26845 3 44 . 1 1 49 49 THR N N 15 1.744 0.014 . . . . . 26845 3 45 . 1 1 50 50 LYS N N 15 2.114 0.011 . . . . . 26845 3 46 . 1 1 51 51 THR N N 15 1.920 0.011 . . . . . 26845 3 47 . 1 1 52 52 PHE N N 15 1.958 0.019 . . . . . 26845 3 48 . 1 1 53 53 THR N N 15 1.904 0.010 . . . . . 26845 3 49 . 1 1 54 54 VAL N N 15 2.079 0.010 . . . . . 26845 3 50 . 1 1 55 55 THR N N 15 1.923 0.014 . . . . . 26845 3 51 . 1 1 56 56 GLU N N 15 2.012 0.010 . . . . . 26845 3 stop_ save_ save_GB3_15N_T1_relaxation_4 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode GB3_15N_T1_relaxation_4 _Heteronucl_T1_list.Entry_ID 26845 _Heteronucl_T1_list.ID 4 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 900 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 4 T1_relaxation_900 . . . 26845 4 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $Felix . . 26845 4 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 GLN N N 15 1.726 0.022 . . . . . 26845 4 2 . 1 1 3 3 TYR N N 15 1.800 0.007 . . . . . 26845 4 3 . 1 1 4 4 LYS N N 15 1.867 0.006 . . . . . 26845 4 4 . 1 1 5 5 LEU N N 15 1.925 0.006 . . . . . 26845 4 5 . 1 1 6 6 VAL N N 15 1.850 0.006 . . . . . 26845 4 6 . 1 1 7 7 ILE N N 15 1.835 0.006 . . . . . 26845 4 7 . 1 1 8 8 ASN N N 15 1.815 0.008 . . . . . 26845 4 8 . 1 1 9 9 GLY N N 15 1.799 0.006 . . . . . 26845 4 9 . 1 1 10 10 LYS N N 15 1.808 0.007 . . . . . 26845 4 10 . 1 1 11 11 THR N N 15 1.699 0.007 . . . . . 26845 4 11 . 1 1 12 12 LEU N N 15 1.567 0.005 . . . . . 26845 4 12 . 1 1 13 13 LYS N N 15 1.702 0.006 . . . . . 26845 4 13 . 1 1 14 14 GLY N N 15 1.621 0.005 . . . . . 26845 4 14 . 1 1 16 16 THR N N 15 1.828 0.006 . . . . . 26845 4 15 . 1 1 17 17 THR N N 15 1.764 0.007 . . . . . 26845 4 16 . 1 1 18 18 THR N N 15 1.840 0.006 . . . . . 26845 4 17 . 1 1 19 19 LYS N N 15 1.692 0.005 . . . . . 26845 4 18 . 1 1 20 20 ALA N N 15 1.778 0.006 . . . . . 26845 4 19 . 1 1 21 21 VAL N N 15 1.802 0.008 . . . . . 26845 4 20 . 1 1 22 22 ASP N N 15 1.871 0.006 . . . . . 26845 4 21 . 1 1 23 23 ALA N N 15 1.820 0.007 . . . . . 26845 4 22 . 1 1 24 24 GLU N N 15 1.748 0.006 . . . . . 26845 4 23 . 1 1 26 26 ALA N N 15 1.862 0.007 . . . . . 26845 4 24 . 1 1 28 28 LYS N N 15 1.715 0.006 . . . . . 26845 4 25 . 1 1 29 29 ALA N N 15 1.762 0.007 . . . . . 26845 4 26 . 1 1 30 30 PHE N N 15 1.813 0.010 . . . . . 26845 4 27 . 1 1 31 31 LYS N N 15 1.845 0.006 . . . . . 26845 4 28 . 1 1 32 32 GLN N N 15 1.797 0.006 . . . . . 26845 4 29 . 1 1 33 33 TYR N N 15 1.840 0.006 . . . . . 26845 4 30 . 1 1 34 34 ALA N N 15 1.889 0.006 . . . . . 26845 4 31 . 1 1 36 36 ASP N N 15 1.810 0.006 . . . . . 26845 4 32 . 1 1 37 37 ASN N N 15 1.717 0.006 . . . . . 26845 4 33 . 1 1 38 38 GLY N N 15 1.823 0.006 . . . . . 26845 4 34 . 1 1 39 39 VAL N N 15 1.795 0.006 . . . . . 26845 4 35 . 1 1 40 40 ASP N N 15 1.591 0.005 . . . . . 26845 4 36 . 1 1 41 41 GLY N N 15 1.422 0.005 . . . . . 26845 4 37 . 1 1 42 42 VAL N N 15 1.805 0.006 . . . . . 26845 4 38 . 1 1 43 43 TRP N N 15 1.874 0.006 . . . . . 26845 4 39 . 1 1 44 44 THR N N 15 1.867 0.006 . . . . . 26845 4 40 . 1 1 45 45 TYR N N 15 1.768 0.006 . . . . . 26845 4 41 . 1 1 46 46 ASP N N 15 1.838 0.007 . . . . . 26845 4 42 . 1 1 47 47 ASP N N 15 1.789 0.006 . . . . . 26845 4 43 . 1 1 48 48 ALA N N 15 1.726 0.007 . . . . . 26845 4 44 . 1 1 49 49 THR N N 15 1.594 0.006 . . . . . 26845 4 45 . 1 1 50 50 LYS N N 15 2.020 0.007 . . . . . 26845 4 46 . 1 1 51 51 THR N N 15 1.835 0.008 . . . . . 26845 4 47 . 1 1 52 52 PHE N N 15 1.689 0.012 . . . . . 26845 4 48 . 1 1 53 53 THR N N 15 1.794 0.007 . . . . . 26845 4 49 . 1 1 54 54 VAL N N 15 1.942 0.009 . . . . . 26845 4 50 . 1 1 55 55 THR N N 15 1.821 0.006 . . . . . 26845 4 51 . 1 1 56 56 GLU N N 15 1.860 0.009 . . . . . 26845 4 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_GB3_15N_T2_relaxation_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode GB3_15N_T2_relaxation_1 _Heteronucl_T2_list.Entry_ID 26845 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 5 T2_relaxation_500 . . . 26845 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $Felix . . 26845 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 GLN N N 15 4.833 0.025 . . . . . . . 26845 1 2 . 1 1 3 3 TYR N N 15 4.678 0.059 . . . . . . . 26845 1 3 . 1 1 4 4 LYS N N 15 4.865 0.030 . . . . . . . 26845 1 4 . 1 1 5 5 LEU N N 15 4.890 0.021 . . . . . . . 26845 1 5 . 1 1 6 6 VAL N N 15 4.832 0.021 . . . . . . . 26845 1 6 . 1 1 7 7 ILE N N 15 4.786 0.021 . . . . . . . 26845 1 7 . 1 1 8 8 ASN N N 15 4.833 0.021 . . . . . . . 26845 1 8 . 1 1 9 9 GLY N N 15 4.662 0.038 . . . . . . . 26845 1 9 . 1 1 10 10 LYS N N 15 4.470 0.039 . . . . . . . 26845 1 10 . 1 1 11 11 THR N N 15 4.388 0.021 . . . . . . . 26845 1 11 . 1 1 12 12 LEU N N 15 3.712 0.021 . . . . . . . 26845 1 12 . 1 1 13 13 LYS N N 15 4.410 0.021 . . . . . . . 26845 1 13 . 1 1 14 14 GLY N N 15 4.161 0.021 . . . . . . . 26845 1 14 . 1 1 16 16 THR N N 15 4.593 0.021 . . . . . . . 26845 1 15 . 1 1 17 17 THR N N 15 4.549 0.028 . . . . . . . 26845 1 16 . 1 1 18 18 THR N N 15 4.749 0.021 . . . . . . . 26845 1 17 . 1 1 19 19 LYS N N 15 4.503 0.026 . . . . . . . 26845 1 18 . 1 1 20 20 ALA N N 15 4.532 0.021 . . . . . . . 26845 1 19 . 1 1 21 21 VAL N N 15 4.726 0.021 . . . . . . . 26845 1 20 . 1 1 22 22 ASP N N 15 4.942 0.021 . . . . . . . 26845 1 21 . 1 1 23 23 ALA N N 15 5.037 0.021 . . . . . . . 26845 1 22 . 1 1 24 24 GLU N N 15 5.030 0.021 . . . . . . . 26845 1 23 . 1 1 26 26 ALA N N 15 5.347 0.021 . . . . . . . 26845 1 24 . 1 1 28 28 LYS N N 15 5.389 0.028 . . . . . . . 26845 1 25 . 1 1 29 29 ALA N N 15 5.270 0.031 . . . . . . . 26845 1 26 . 1 1 30 30 PHE N N 15 5.214 0.021 . . . . . . . 26845 1 27 . 1 1 31 31 LYS N N 15 5.486 0.021 . . . . . . . 26845 1 28 . 1 1 32 32 GLN N N 15 5.401 0.029 . . . . . . . 26845 1 29 . 1 1 33 33 TYR N N 15 5.290 0.021 . . . . . . . 26845 1 30 . 1 1 34 34 ALA N N 15 5.422 0.026 . . . . . . . 26845 1 31 . 1 1 36 36 ASP N N 15 5.369 0.021 . . . . . . . 26845 1 32 . 1 1 37 37 ASN N N 15 4.793 0.021 . . . . . . . 26845 1 33 . 1 1 38 38 GLY N N 15 4.967 0.024 . . . . . . . 26845 1 34 . 1 1 39 39 VAL N N 15 5.002 0.021 . . . . . . . 26845 1 35 . 1 1 40 40 ASP N N 15 4.267 0.021 . . . . . . . 26845 1 36 . 1 1 41 41 GLY N N 15 3.456 0.021 . . . . . . . 26845 1 37 . 1 1 42 42 VAL N N 15 4.796 0.025 . . . . . . . 26845 1 38 . 1 1 43 43 TRP N N 15 4.714 0.030 . . . . . . . 26845 1 39 . 1 1 44 44 THR N N 15 4.747 0.021 . . . . . . . 26845 1 40 . 1 1 45 45 TYR N N 15 4.562 0.032 . . . . . . . 26845 1 41 . 1 1 46 46 ASP N N 15 4.726 0.025 . . . . . . . 26845 1 42 . 1 1 47 47 ASP N N 15 4.592 0.024 . . . . . . . 26845 1 43 . 1 1 48 48 ALA N N 15 4.479 0.043 . . . . . . . 26845 1 44 . 1 1 49 49 THR N N 15 4.698 0.026 . . . . . . . 26845 1 45 . 1 1 50 50 LYS N N 15 4.826 0.021 . . . . . . . 26845 1 46 . 1 1 51 51 THR N N 15 4.772 0.028 . . . . . . . 26845 1 47 . 1 1 52 52 PHE N N 15 4.894 0.048 . . . . . . . 26845 1 48 . 1 1 53 53 THR N N 15 4.825 0.041 . . . . . . . 26845 1 49 . 1 1 54 54 VAL N N 15 4.917 0.021 . . . . . . . 26845 1 50 . 1 1 55 55 THR N N 15 4.904 0.028 . . . . . . . 26845 1 51 . 1 1 56 56 GLU N N 15 4.750 0.021 . . . . . . . 26845 1 stop_ save_ save_GB3_15N_T2_relaxation_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode GB3_15N_T2_relaxation_2 _Heteronucl_T2_list.Entry_ID 26845 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 6 T2_relaxation_600 . . . 26845 2 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $Felix . . 26845 2 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 GLN N N 15 5.237 0.078 . . . . . . . 26845 2 2 . 1 1 3 3 TYR N N 15 5.051 0.040 . . . . . . . 26845 2 3 . 1 1 4 4 LYS N N 15 5.273 0.031 . . . . . . . 26845 2 4 . 1 1 5 5 LEU N N 15 5.290 0.035 . . . . . . . 26845 2 5 . 1 1 6 6 VAL N N 15 5.245 0.071 . . . . . . . 26845 2 6 . 1 1 7 7 ILE N N 15 5.142 0.035 . . . . . . . 26845 2 7 . 1 1 8 8 ASN N N 15 5.183 0.031 . . . . . . . 26845 2 8 . 1 1 9 9 GLY N N 15 5.049 0.031 . . . . . . . 26845 2 9 . 1 1 10 10 LYS N N 15 4.874 0.031 . . . . . . . 26845 2 10 . 1 1 11 11 THR N N 15 4.915 0.075 . . . . . . . 26845 2 11 . 1 1 12 12 LEU N N 15 4.121 0.043 . . . . . . . 26845 2 12 . 1 1 13 13 LYS N N 15 4.853 0.031 . . . . . . . 26845 2 13 . 1 1 14 14 GLY N N 15 4.609 0.046 . . . . . . . 26845 2 14 . 1 1 16 16 THR N N 15 5.052 0.069 . . . . . . . 26845 2 15 . 1 1 17 17 THR N N 15 4.969 0.031 . . . . . . . 26845 2 16 . 1 1 18 18 THR N N 15 5.150 0.043 . . . . . . . 26845 2 17 . 1 1 19 19 LYS N N 15 4.821 0.035 . . . . . . . 26845 2 18 . 1 1 20 20 ALA N N 15 4.894 0.046 . . . . . . . 26845 2 19 . 1 1 21 21 VAL N N 15 5.100 0.034 . . . . . . . 26845 2 20 . 1 1 22 22 ASP N N 15 5.448 0.031 . . . . . . . 26845 2 21 . 1 1 23 23 ALA N N 15 5.499 0.031 . . . . . . . 26845 2 22 . 1 1 24 24 GLU N N 15 5.518 0.031 . . . . . . . 26845 2 23 . 1 1 26 26 ALA N N 15 5.695 0.031 . . . . . . . 26845 2 24 . 1 1 28 28 LYS N N 15 5.875 0.056 . . . . . . . 26845 2 25 . 1 1 29 29 ALA N N 15 5.688 0.031 . . . . . . . 26845 2 26 . 1 1 30 30 PHE N N 15 5.669 0.031 . . . . . . . 26845 2 27 . 1 1 31 31 LYS N N 15 5.983 0.053 . . . . . . . 26845 2 28 . 1 1 32 32 GLN N N 15 5.856 0.031 . . . . . . . 26845 2 29 . 1 1 33 33 TYR N N 15 5.766 0.034 . . . . . . . 26845 2 30 . 1 1 34 34 ALA N N 15 5.870 0.031 . . . . . . . 26845 2 31 . 1 1 36 36 ASP N N 15 5.799 0.038 . . . . . . . 26845 2 32 . 1 1 37 37 ASN N N 15 5.205 0.031 . . . . . . . 26845 2 33 . 1 1 38 38 GLY N N 15 5.395 0.031 . . . . . . . 26845 2 34 . 1 1 39 39 VAL N N 15 5.457 0.049 . . . . . . . 26845 2 35 . 1 1 40 40 ASP N N 15 4.692 0.031 . . . . . . . 26845 2 36 . 1 1 41 41 GLY N N 15 3.773 0.031 . . . . . . . 26845 2 37 . 1 1 42 42 VAL N N 15 5.216 0.031 . . . . . . . 26845 2 38 . 1 1 43 43 TRP N N 15 5.246 0.031 . . . . . . . 26845 2 39 . 1 1 44 44 THR N N 15 5.121 0.058 . . . . . . . 26845 2 40 . 1 1 45 45 TYR N N 15 5.004 0.031 . . . . . . . 26845 2 41 . 1 1 46 46 ASP N N 15 5.086 0.040 . . . . . . . 26845 2 42 . 1 1 47 47 ASP N N 15 4.959 0.049 . . . . . . . 26845 2 43 . 1 1 48 48 ALA N N 15 4.952 0.037 . . . . . . . 26845 2 44 . 1 1 49 49 THR N N 15 5.055 0.031 . . . . . . . 26845 2 45 . 1 1 50 50 LYS N N 15 5.302 0.031 . . . . . . . 26845 2 46 . 1 1 51 51 THR N N 15 5.205 0.031 . . . . . . . 26845 2 47 . 1 1 52 52 PHE N N 15 5.257 0.031 . . . . . . . 26845 2 48 . 1 1 53 53 THR N N 15 5.175 0.031 . . . . . . . 26845 2 49 . 1 1 54 54 VAL N N 15 5.386 0.055 . . . . . . . 26845 2 50 . 1 1 55 55 THR N N 15 5.297 0.038 . . . . . . . 26845 2 51 . 1 1 56 56 GLU N N 15 5.212 0.031 . . . . . . . 26845 2 stop_ save_ save_GB3_15N_T2_relaxation_3 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode GB3_15N_T2_relaxation_3 _Heteronucl_T2_list.Entry_ID 26845 _Heteronucl_T2_list.ID 3 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 7 T2_relaxation_800 . . . 26845 3 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $Felix . . 26845 3 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 GLN N N 15 5.809 0.100 . . . . . . . 26845 3 2 . 1 1 3 3 TYR N N 15 5.534 0.090 . . . . . . . 26845 3 3 . 1 1 4 4 LYS N N 15 5.663 0.050 . . . . . . . 26845 3 4 . 1 1 5 5 LEU N N 15 5.838 0.050 . . . . . . . 26845 3 5 . 1 1 6 6 VAL N N 15 5.692 0.050 . . . . . . . 26845 3 6 . 1 1 7 7 ILE N N 15 5.541 0.076 . . . . . . . 26845 3 7 . 1 1 8 8 ASN N N 15 5.621 0.050 . . . . . . . 26845 3 8 . 1 1 9 9 GLY N N 15 5.614 0.060 . . . . . . . 26845 3 9 . 1 1 10 10 LYS N N 15 5.469 0.050 . . . . . . . 26845 3 10 . 1 1 11 11 THR N N 15 5.577 0.068 . . . . . . . 26845 3 11 . 1 1 12 12 LEU N N 15 4.512 0.050 . . . . . . . 26845 3 12 . 1 1 13 13 LYS N N 15 5.275 0.062 . . . . . . . 26845 3 13 . 1 1 14 14 GLY N N 15 5.111 0.050 . . . . . . . 26845 3 14 . 1 1 16 16 THR N N 15 5.489 0.056 . . . . . . . 26845 3 15 . 1 1 17 17 THR N N 15 5.547 0.081 . . . . . . . 26845 3 16 . 1 1 18 18 THR N N 15 5.588 0.053 . . . . . . . 26845 3 17 . 1 1 19 19 LYS N N 15 5.333 0.050 . . . . . . . 26845 3 18 . 1 1 20 20 ALA N N 15 5.403 0.112 . . . . . . . 26845 3 19 . 1 1 21 21 VAL N N 15 5.588 0.050 . . . . . . . 26845 3 20 . 1 1 22 22 ASP N N 15 6.094 0.050 . . . . . . . 26845 3 21 . 1 1 23 23 ALA N N 15 6.082 0.050 . . . . . . . 26845 3 22 . 1 1 24 24 GLU N N 15 6.148 0.079 . . . . . . . 26845 3 23 . 1 1 26 26 ALA N N 15 6.368 0.050 . . . . . . . 26845 3 24 . 1 1 28 28 LYS N N 15 6.411 0.052 . . . . . . . 26845 3 25 . 1 1 29 29 ALA N N 15 6.275 0.050 . . . . . . . 26845 3 26 . 1 1 30 30 PHE N N 15 6.360 0.088 . . . . . . . 26845 3 27 . 1 1 31 31 LYS N N 15 6.663 0.050 . . . . . . . 26845 3 28 . 1 1 32 32 GLN N N 15 6.421 0.106 . . . . . . . 26845 3 29 . 1 1 33 33 TYR N N 15 6.295 0.123 . . . . . . . 26845 3 30 . 1 1 34 34 ALA N N 15 6.601 0.071 . . . . . . . 26845 3 31 . 1 1 36 36 ASP N N 15 6.404 0.050 . . . . . . . 26845 3 32 . 1 1 37 37 ASN N N 15 5.658 0.050 . . . . . . . 26845 3 33 . 1 1 38 38 GLY N N 15 6.120 0.098 . . . . . . . 26845 3 34 . 1 1 39 39 VAL N N 15 5.942 0.050 . . . . . . . 26845 3 35 . 1 1 40 40 ASP N N 15 5.090 0.108 . . . . . . . 26845 3 36 . 1 1 41 41 GLY N N 15 4.108 0.071 . . . . . . . 26845 3 37 . 1 1 42 42 VAL N N 15 5.738 0.109 . . . . . . . 26845 3 38 . 1 1 43 43 TRP N N 15 5.719 0.050 . . . . . . . 26845 3 39 . 1 1 44 44 THR N N 15 5.707 0.050 . . . . . . . 26845 3 40 . 1 1 45 45 TYR N N 15 5.388 0.050 . . . . . . . 26845 3 41 . 1 1 46 46 ASP N N 15 5.629 0.050 . . . . . . . 26845 3 42 . 1 1 47 47 ASP N N 15 5.552 0.103 . . . . . . . 26845 3 43 . 1 1 48 48 ALA N N 15 5.621 0.075 . . . . . . . 26845 3 44 . 1 1 49 49 THR N N 15 5.440 0.050 . . . . . . . 26845 3 45 . 1 1 50 50 LYS N N 15 5.968 0.050 . . . . . . . 26845 3 46 . 1 1 51 51 THR N N 15 5.708 0.057 . . . . . . . 26845 3 47 . 1 1 52 52 PHE N N 15 5.804 0.084 . . . . . . . 26845 3 48 . 1 1 53 53 THR N N 15 5.590 0.050 . . . . . . . 26845 3 49 . 1 1 54 54 VAL N N 15 5.918 0.060 . . . . . . . 26845 3 50 . 1 1 55 55 THR N N 15 5.701 0.050 . . . . . . . 26845 3 51 . 1 1 56 56 GLU N N 15 5.580 0.050 . . . . . . . 26845 3 stop_ save_ save_GB3_15N_T2_relaxation_4 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode GB3_15N_T2_relaxation_4 _Heteronucl_T2_list.Entry_ID 26845 _Heteronucl_T2_list.ID 4 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 900 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 8 T2_relaxation_900 . . . 26845 4 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $Felix . . 26845 4 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 GLN N N 15 6.038 0.065 . . . . . . . 26845 4 2 . 1 1 3 3 TYR N N 15 5.691 0.071 . . . . . . . 26845 4 3 . 1 1 4 4 LYS N N 15 5.948 0.091 . . . . . . . 26845 4 4 . 1 1 5 5 LEU N N 15 6.060 0.065 . . . . . . . 26845 4 5 . 1 1 6 6 VAL N N 15 5.909 0.073 . . . . . . . 26845 4 6 . 1 1 7 7 ILE N N 15 5.793 0.090 . . . . . . . 26845 4 7 . 1 1 8 8 ASN N N 15 5.889 0.094 . . . . . . . 26845 4 8 . 1 1 9 9 GLY N N 15 5.908 0.102 . . . . . . . 26845 4 9 . 1 1 10 10 LYS N N 15 5.804 0.076 . . . . . . . 26845 4 10 . 1 1 11 11 THR N N 15 5.836 0.065 . . . . . . . 26845 4 11 . 1 1 12 12 LEU N N 15 4.853 0.065 . . . . . . . 26845 4 12 . 1 1 13 13 LYS N N 15 5.495 0.065 . . . . . . . 26845 4 13 . 1 1 14 14 GLY N N 15 5.325 0.089 . . . . . . . 26845 4 14 . 1 1 16 16 THR N N 15 5.761 0.089 . . . . . . . 26845 4 15 . 1 1 17 17 THR N N 15 5.807 0.162 . . . . . . . 26845 4 16 . 1 1 18 18 THR N N 15 5.883 0.065 . . . . . . . 26845 4 17 . 1 1 19 19 LYS N N 15 5.532 0.065 . . . . . . . 26845 4 18 . 1 1 20 20 ALA N N 15 5.454 0.072 . . . . . . . 26845 4 19 . 1 1 21 21 VAL N N 15 5.882 0.065 . . . . . . . 26845 4 20 . 1 1 22 22 ASP N N 15 6.429 0.065 . . . . . . . 26845 4 21 . 1 1 23 23 ALA N N 15 6.465 0.081 . . . . . . . 26845 4 22 . 1 1 24 24 GLU N N 15 6.424 0.065 . . . . . . . 26845 4 23 . 1 1 26 26 ALA N N 15 6.761 0.065 . . . . . . . 26845 4 24 . 1 1 28 28 LYS N N 15 6.753 0.076 . . . . . . . 26845 4 25 . 1 1 29 29 ALA N N 15 6.674 0.093 . . . . . . . 26845 4 26 . 1 1 30 30 PHE N N 15 6.644 0.065 . . . . . . . 26845 4 27 . 1 1 31 31 LYS N N 15 7.048 0.151 . . . . . . . 26845 4 28 . 1 1 32 32 GLN N N 15 6.788 0.065 . . . . . . . 26845 4 29 . 1 1 33 33 TYR N N 15 6.644 0.065 . . . . . . . 26845 4 30 . 1 1 34 34 ALA N N 15 6.998 0.080 . . . . . . . 26845 4 31 . 1 1 36 36 ASP N N 15 6.815 0.094 . . . . . . . 26845 4 32 . 1 1 37 37 ASN N N 15 5.898 0.065 . . . . . . . 26845 4 33 . 1 1 38 38 GLY N N 15 6.325 0.065 . . . . . . . 26845 4 34 . 1 1 39 39 VAL N N 15 6.321 0.065 . . . . . . . 26845 4 35 . 1 1 40 40 ASP N N 15 5.298 0.065 . . . . . . . 26845 4 36 . 1 1 41 41 GLY N N 15 4.174 0.065 . . . . . . . 26845 4 37 . 1 1 42 42 VAL N N 15 6.009 0.065 . . . . . . . 26845 4 38 . 1 1 43 43 TRP N N 15 6.002 0.065 . . . . . . . 26845 4 39 . 1 1 44 44 THR N N 15 6.039 0.065 . . . . . . . 26845 4 40 . 1 1 45 45 TYR N N 15 5.688 0.065 . . . . . . . 26845 4 41 . 1 1 46 46 ASP N N 15 5.758 0.100 . . . . . . . 26845 4 42 . 1 1 47 47 ASP N N 15 5.799 0.077 . . . . . . . 26845 4 43 . 1 1 48 48 ALA N N 15 5.906 0.065 . . . . . . . 26845 4 44 . 1 1 49 49 THR N N 15 5.547 0.065 . . . . . . . 26845 4 45 . 1 1 50 50 LYS N N 15 6.355 0.106 . . . . . . . 26845 4 46 . 1 1 51 51 THR N N 15 5.991 0.134 . . . . . . . 26845 4 47 . 1 1 52 52 PHE N N 15 6.058 0.065 . . . . . . . 26845 4 48 . 1 1 53 53 THR N N 15 5.855 0.065 . . . . . . . 26845 4 49 . 1 1 54 54 VAL N N 15 6.185 0.091 . . . . . . . 26845 4 50 . 1 1 55 55 THR N N 15 5.902 0.100 . . . . . . . 26845 4 51 . 1 1 56 56 GLU N N 15 6.055 0.065 . . . . . . . 26845 4 stop_ save_