data_51056 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51056 _Entry.Title ; Chemical shifts and relaxation data from DREB2A with RCD1-RST ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-08-11 _Entry.Accession_date 2021-08-11 _Entry.Last_release_date 2021-08-11 _Entry.Original_release_date 2021-08-11 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details ; Chemical shifts and relaxation rates for Arabidopsis thaliana DREB2A 234-276 in complex with RCD1-RST. Also includes chemical shifts for RCD1-RST in complex with the specific DREB2A fragment. ; _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 Frederik Theisen . F. . 0000-0002-3412-4242 51056 2 Lasse Staby . . . 0000-0002-5588-5163 51056 3 Frederik Tidemand . G. . 0000-0001-8914-9626 51056 4 Charlotte O'Shea . . . 0000-0002-5548-8002 51056 5 Andreas Prestel . . . 0000-0002-5459-9608 51056 6 Martin Willemoes . . . 0000-0003-1689-2712 51056 7 Birthe Kragelund . B. . 0000-0002-7454-1761 51056 8 Karen Skriver . . . 0000-0003-2225-4012 51056 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 51056 heteronucl_T1_relaxation 2 51056 heteronucl_T2_relaxation 2 51056 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 271 51056 '15N chemical shifts' 107 51056 '1H chemical shifts' 107 51056 'T1 relaxation values' 107 51056 'T2 relaxation values' 107 51056 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 . . 2022-01-29 2021-08-11 update BMRB 'update entry citation' 51056 1 . . 2021-09-04 2021-08-11 original author 'original release' 51056 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51055 'Chemical shifts and relaxation data from DREB2A 243-276' 51056 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51056 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34473923 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Quantification of Conformational Entropy Unravels Effect of Disordered Flanking Region in Coupled Folding and Binding ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 143 _Citation.Journal_issue 36 _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 14540 _Citation.Page_last 14550 _Citation.Year 2021 _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 Frederik Theisen . F. . . 51056 1 2 Lasse Staby . . . . 51056 1 3 Frederik Tidemand . G. . . 51056 1 4 Charlotte O'Shea . . . . 51056 1 5 Andreas Prestel . . . . 51056 1 6 Martin Willemoes . . . . 51056 1 7 Birthe Kragelund . B. . . 51056 1 8 Karen Skriver . . . . 51056 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51056 _Assembly.ID 1 _Assembly.Name 'DREB2A:RCD1-RST complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange yes _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 DREB2A 1 $entity_1 . . yes native yes yes . . . 51056 1 2 RCD1-RST 2 $entity_2 . . yes native yes yes . . . 51056 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 5OAO . . 'solution NMR' . RCD1-RST 'In complex with a shorter DREB2A (255-272) fragment' 51056 1 yes PDB 5OAP . . 'solution NMR' . 'DREB2A 255-272' 'A shorter DREB2A (255-272) fragment in complex with RCD1-RST' 51056 1 stop_ loop_ _Assembly_interaction.ID _Assembly_interaction.Entity_assembly_ID_1 _Assembly_interaction.Entity_assembly_ID_2 _Assembly_interaction.Mol_interaction_type _Assembly_interaction.Entry_ID _Assembly_interaction.Assembly_ID 1 1 2 'Slow exchange' 51056 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51056 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; GQDSLSVADYGWPNDVDQSH LDSSDMFDVDELLRDLNGDD VFAG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Arabidopsis thaliana' _Entity.Ambiguous_conformational_states yes _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 44 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'DREB2A 234-276' _Entity.Mutation 'First residue is a non-wildtype glycine left over from GST tag removal' _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 0 GLY . 51056 1 2 1 GLN . 51056 1 3 2 ASP . 51056 1 4 3 SER . 51056 1 5 4 LEU . 51056 1 6 5 SER . 51056 1 7 6 VAL . 51056 1 8 7 ALA . 51056 1 9 8 ASP . 51056 1 10 9 TYR . 51056 1 11 10 GLY . 51056 1 12 11 TRP . 51056 1 13 12 PRO . 51056 1 14 13 ASN . 51056 1 15 14 ASP . 51056 1 16 15 VAL . 51056 1 17 16 ASP . 51056 1 18 17 GLN . 51056 1 19 18 SER . 51056 1 20 19 HIS . 51056 1 21 20 LEU . 51056 1 22 21 ASP . 51056 1 23 22 SER . 51056 1 24 23 SER . 51056 1 25 24 ASP . 51056 1 26 25 MET . 51056 1 27 26 PHE . 51056 1 28 27 ASP . 51056 1 29 28 VAL . 51056 1 30 29 ASP . 51056 1 31 30 GLU . 51056 1 32 31 LEU . 51056 1 33 32 LEU . 51056 1 34 33 ARG . 51056 1 35 34 ASP . 51056 1 36 35 LEU . 51056 1 37 36 ASN . 51056 1 38 37 GLY . 51056 1 39 38 ASP . 51056 1 40 39 ASP . 51056 1 41 40 VAL . 51056 1 42 41 PHE . 51056 1 43 42 ALA . 51056 1 44 43 GLY . 51056 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 51056 1 . GLN 2 2 51056 1 . ASP 3 3 51056 1 . SER 4 4 51056 1 . LEU 5 5 51056 1 . SER 6 6 51056 1 . VAL 7 7 51056 1 . ALA 8 8 51056 1 . ASP 9 9 51056 1 . TYR 10 10 51056 1 . GLY 11 11 51056 1 . TRP 12 12 51056 1 . PRO 13 13 51056 1 . ASN 14 14 51056 1 . ASP 15 15 51056 1 . VAL 16 16 51056 1 . ASP 17 17 51056 1 . GLN 18 18 51056 1 . SER 19 19 51056 1 . HIS 20 20 51056 1 . LEU 21 21 51056 1 . ASP 22 22 51056 1 . SER 23 23 51056 1 . SER 24 24 51056 1 . ASP 25 25 51056 1 . MET 26 26 51056 1 . PHE 27 27 51056 1 . ASP 28 28 51056 1 . VAL 29 29 51056 1 . ASP 30 30 51056 1 . GLU 31 31 51056 1 . LEU 32 32 51056 1 . LEU 33 33 51056 1 . ARG 34 34 51056 1 . ASP 35 35 51056 1 . LEU 36 36 51056 1 . ASN 37 37 51056 1 . GLY 38 38 51056 1 . ASP 39 39 51056 1 . ASP 40 40 51056 1 . VAL 41 41 51056 1 . PHE 42 42 51056 1 . ALA 43 43 51056 1 . GLY 44 44 51056 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 51056 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _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 ; MSTTRPKSPWMPFPTLFAAI SHKVAENDMLLINADYQQLR DKKMTRAEFVRKLRVIVGDD LLRSTITTLQNQPKS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Arabidopsis thaliana' _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 75 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment 'RCD1-RST 499-572' _Entity.Mutation 'First residue is a non-wildtype methionine.' _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 -1 MET . 51056 2 2 0 SER . 51056 2 3 1 THR . 51056 2 4 2 THR . 51056 2 5 3 ARG . 51056 2 6 4 PRO . 51056 2 7 5 LYS . 51056 2 8 6 SER . 51056 2 9 7 PRO . 51056 2 10 8 TRP . 51056 2 11 9 MET . 51056 2 12 10 PRO . 51056 2 13 11 PHE . 51056 2 14 12 PRO . 51056 2 15 13 THR . 51056 2 16 14 LEU . 51056 2 17 15 PHE . 51056 2 18 16 ALA . 51056 2 19 17 ALA . 51056 2 20 18 ILE . 51056 2 21 19 SER . 51056 2 22 20 HIS . 51056 2 23 21 LYS . 51056 2 24 22 VAL . 51056 2 25 23 ALA . 51056 2 26 24 GLU . 51056 2 27 25 ASN . 51056 2 28 26 ASP . 51056 2 29 27 MET . 51056 2 30 28 LEU . 51056 2 31 29 LEU . 51056 2 32 30 ILE . 51056 2 33 31 ASN . 51056 2 34 32 ALA . 51056 2 35 33 ASP . 51056 2 36 34 TYR . 51056 2 37 35 GLN . 51056 2 38 36 GLN . 51056 2 39 37 LEU . 51056 2 40 38 ARG . 51056 2 41 39 ASP . 51056 2 42 40 LYS . 51056 2 43 41 LYS . 51056 2 44 42 MET . 51056 2 45 43 THR . 51056 2 46 44 ARG . 51056 2 47 45 ALA . 51056 2 48 46 GLU . 51056 2 49 47 PHE . 51056 2 50 48 VAL . 51056 2 51 49 ARG . 51056 2 52 50 LYS . 51056 2 53 51 LEU . 51056 2 54 52 ARG . 51056 2 55 53 VAL . 51056 2 56 54 ILE . 51056 2 57 55 VAL . 51056 2 58 56 GLY . 51056 2 59 57 ASP . 51056 2 60 58 ASP . 51056 2 61 59 LEU . 51056 2 62 60 LEU . 51056 2 63 61 ARG . 51056 2 64 62 SER . 51056 2 65 63 THR . 51056 2 66 64 ILE . 51056 2 67 65 THR . 51056 2 68 66 THR . 51056 2 69 67 LEU . 51056 2 70 68 GLN . 51056 2 71 69 ASN . 51056 2 72 70 GLN . 51056 2 73 71 PRO . 51056 2 74 72 LYS . 51056 2 75 73 SER . 51056 2 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 51056 2 . SER 2 2 51056 2 . THR 3 3 51056 2 . THR 4 4 51056 2 . ARG 5 5 51056 2 . PRO 6 6 51056 2 . LYS 7 7 51056 2 . SER 8 8 51056 2 . PRO 9 9 51056 2 . TRP 10 10 51056 2 . MET 11 11 51056 2 . PRO 12 12 51056 2 . PHE 13 13 51056 2 . PRO 14 14 51056 2 . THR 15 15 51056 2 . LEU 16 16 51056 2 . PHE 17 17 51056 2 . ALA 18 18 51056 2 . ALA 19 19 51056 2 . ILE 20 20 51056 2 . SER 21 21 51056 2 . HIS 22 22 51056 2 . LYS 23 23 51056 2 . VAL 24 24 51056 2 . ALA 25 25 51056 2 . GLU 26 26 51056 2 . ASN 27 27 51056 2 . ASP 28 28 51056 2 . MET 29 29 51056 2 . LEU 30 30 51056 2 . LEU 31 31 51056 2 . ILE 32 32 51056 2 . ASN 33 33 51056 2 . ALA 34 34 51056 2 . ASP 35 35 51056 2 . TYR 36 36 51056 2 . GLN 37 37 51056 2 . GLN 38 38 51056 2 . LEU 39 39 51056 2 . ARG 40 40 51056 2 . ASP 41 41 51056 2 . LYS 42 42 51056 2 . LYS 43 43 51056 2 . MET 44 44 51056 2 . THR 45 45 51056 2 . ARG 46 46 51056 2 . ALA 47 47 51056 2 . GLU 48 48 51056 2 . PHE 49 49 51056 2 . VAL 50 50 51056 2 . ARG 51 51 51056 2 . LYS 52 52 51056 2 . LEU 53 53 51056 2 . ARG 54 54 51056 2 . VAL 55 55 51056 2 . ILE 56 56 51056 2 . VAL 57 57 51056 2 . GLY 58 58 51056 2 . ASP 59 59 51056 2 . ASP 60 60 51056 2 . LEU 61 61 51056 2 . LEU 62 62 51056 2 . ARG 63 63 51056 2 . SER 64 64 51056 2 . THR 65 65 51056 2 . ILE 66 66 51056 2 . THR 67 67 51056 2 . THR 68 68 51056 2 . LEU 69 69 51056 2 . GLN 70 70 51056 2 . ASN 71 71 51056 2 . GLN 72 72 51056 2 . PRO 73 73 51056 2 . LYS 74 74 51056 2 . SER 75 75 51056 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51056 _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 $entity_1 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . AT5G05410 . 51056 1 2 2 $entity_2 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . AT1G32230 . 51056 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51056 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . plasmid . . pGEX-4T1 . . 'Expressed at 37 C' 51056 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . plasmid . . pET11a . . 'Expressed at 18 C overnight' 51056 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51056 _Sample.ID 1 _Sample.Name '13C15N DREB2A 234-276 + RCD1-RST 499-572' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D2O 'natural abundance' . . . . . . 10 . . % . . . . 51056 1 2 DSS 'natural abundance' . . . . . . 0.2 . . mM . . . . 51056 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 51056 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51056 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 51056 1 6 DREB2A '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 200 . . uM . . . . 51056 1 7 RCD1-RST 'natural abundance' . . 2 $entity_2 . . 300 . . uM . . . . 51056 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51056 _Sample.ID 2 _Sample.Name '13C15N RCD1-RST + DREB2A 234-276' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D2O 'natural abundance' . . . . . . 10 . . % . . . . 51056 2 2 DSS 'natural abundance' . . . . . . 0.2 . . mM . . . . 51056 2 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 51056 2 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51056 2 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 51056 2 6 RCD1-RST '[U-100% 13C; U-100% 15N]' . . 2 $entity_2 . . 300 . . uM . . . . 51056 2 7 DREB2A 'natural abundance' . . 1 $entity_1 . . 400 . . uM . . . . 51056 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 51056 _Sample_condition_list.ID 1 _Sample_condition_list.Name default _Sample_condition_list.Details '20 mM NaPO4, pH 7.0, 100 mM NaCl, 25C' 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 7 0.1 pH 51056 1 temperature 298 1 K 51056 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51056 _Software.ID 1 _Software.Type . _Software.Name ANALYSIS _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51056 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51056 _Software.ID 2 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51056 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51056 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51056 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51056 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker AVANCE 800 MHz' _NMR_spectrometer.Details 'Equipped with cryogenic probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 51056 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker AVANCE 750 MHz' _NMR_spectrometer.Details 'Equipped with cryogenic probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51056 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 2 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 3 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 5 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 6 '3D HN(CO)CACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 7 'T1/R1 relaxation' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 8 'T2/R2 relaxation' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 9 'T1/R1 relaxation' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 10 'T2/R2 relaxation' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51056 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51056 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name default _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.25145 . . . . . 51056 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 51056 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.10133 . . . . . 51056 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51056 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '13C15N DREB2A + RCD1-RST' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51056 1 2 '3D HNCACB' . . . 51056 1 3 '3D HN(CO)CACB' . . . 51056 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51056 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 GLN C C 13 175.746 . . 1 . . . . . 1 GLN C . 51056 1 2 . 1 . 1 2 2 GLN CA C 13 56.277 . . 1 . . . . . 1 GLN CA . 51056 1 3 . 1 . 1 2 2 GLN CB C 13 29.487 . . 1 . . . . . 1 GLN CB . 51056 1 4 . 1 . 1 3 3 ASP H H 1 8.563 . . 1 . . . . . 2 ASP H . 51056 1 5 . 1 . 1 3 3 ASP C C 13 176.392 . . 1 . . . . . 2 ASP C . 51056 1 6 . 1 . 1 3 3 ASP CA C 13 54.510 . . 1 . . . . . 2 ASP CA . 51056 1 7 . 1 . 1 3 3 ASP CB C 13 41.198 . . 1 . . . . . 2 ASP CB . 51056 1 8 . 1 . 1 3 3 ASP N N 15 121.512 . . 1 . . . . . 2 ASP N . 51056 1 9 . 1 . 1 4 4 SER H H 1 8.260 . . 1 . . . . . 3 SER H . 51056 1 10 . 1 . 1 4 4 SER C C 13 174.518 . . 1 . . . . . 3 SER C . 51056 1 11 . 1 . 1 4 4 SER CA C 13 58.655 . . 1 . . . . . 3 SER CA . 51056 1 12 . 1 . 1 4 4 SER CB C 13 63.793 . . 1 . . . . . 3 SER CB . 51056 1 13 . 1 . 1 4 4 SER N N 15 115.952 . . 1 . . . . . 3 SER N . 51056 1 14 . 1 . 1 5 5 LEU H H 1 8.282 . . 1 . . . . . 4 LEU H . 51056 1 15 . 1 . 1 5 5 LEU C C 13 177.451 . . 1 . . . . . 4 LEU C . 51056 1 16 . 1 . 1 5 5 LEU CA C 13 55.349 . . 1 . . . . . 4 LEU CA . 51056 1 17 . 1 . 1 5 5 LEU CB C 13 42.381 . . 1 . . . . . 4 LEU CB . 51056 1 18 . 1 . 1 5 5 LEU N N 15 123.679 . . 1 . . . . . 4 LEU N . 51056 1 19 . 1 . 1 6 6 SER H H 1 8.343 . . 1 . . . . . 5 SER H . 51056 1 20 . 1 . 1 6 6 SER C C 13 174.644 . . 1 . . . . . 5 SER C . 51056 1 21 . 1 . 1 6 6 SER CA C 13 58.151 . . 1 . . . . . 5 SER CA . 51056 1 22 . 1 . 1 6 6 SER CB C 13 63.980 . . 1 . . . . . 5 SER CB . 51056 1 23 . 1 . 1 6 6 SER N N 15 116.929 . . 1 . . . . . 5 SER N . 51056 1 24 . 1 . 1 7 7 VAL H H 1 8.107 . . 1 . . . . . 6 VAL H . 51056 1 25 . 1 . 1 7 7 VAL C C 13 175.998 . . 1 . . . . . 6 VAL C . 51056 1 26 . 1 . 1 7 7 VAL CA C 13 62.482 . . 1 . . . . . 6 VAL CA . 51056 1 27 . 1 . 1 7 7 VAL CB C 13 32.596 . . 1 . . . . . 6 VAL CB . 51056 1 28 . 1 . 1 7 7 VAL N N 15 121.417 . . 1 . . . . . 6 VAL N . 51056 1 29 . 1 . 1 8 8 ALA H H 1 8.216 . . 1 . . . . . 7 ALA H . 51056 1 30 . 1 . 1 8 8 ALA C C 13 177.257 . . 1 . . . . . 7 ALA C . 51056 1 31 . 1 . 1 8 8 ALA CA C 13 52.629 . . 1 . . . . . 7 ALA CA . 51056 1 32 . 1 . 1 8 8 ALA CB C 13 19.218 . . 1 . . . . . 7 ALA CB . 51056 1 33 . 1 . 1 8 8 ALA N N 15 126.539 . . 1 . . . . . 7 ALA N . 51056 1 34 . 1 . 1 9 9 ASP H H 1 8.039 . . 1 . . . . . 8 ASP H . 51056 1 35 . 1 . 1 9 9 ASP C C 13 176.001 . . 1 . . . . . 8 ASP C . 51056 1 36 . 1 . 1 9 9 ASP CA C 13 54.236 . . 1 . . . . . 8 ASP CA . 51056 1 37 . 1 . 1 9 9 ASP CB C 13 41.360 . . 1 . . . . . 8 ASP CB . 51056 1 38 . 1 . 1 9 9 ASP N N 15 119.032 . . 1 . . . . . 8 ASP N . 51056 1 39 . 1 . 1 10 10 TYR H H 1 7.973 . . 1 . . . . . 9 TYR H . 51056 1 40 . 1 . 1 10 10 TYR C C 13 177.521 . . 1 . . . . . 9 TYR C . 51056 1 41 . 1 . 1 10 10 TYR CA C 13 57.995 . . 1 . . . . . 9 TYR CA . 51056 1 42 . 1 . 1 10 10 TYR CB C 13 38.551 . . 1 . . . . . 9 TYR CB . 51056 1 43 . 1 . 1 10 10 TYR N N 15 120.105 . . 1 . . . . . 9 TYR N . 51056 1 44 . 1 . 1 11 11 GLY H H 1 8.155 . . 1 . . . . . 10 GLY H . 51056 1 45 . 1 . 1 11 11 GLY C C 13 173.417 . . 1 . . . . . 10 GLY C . 51056 1 46 . 1 . 1 11 11 GLY CA C 13 45.262 . . 1 . . . . . 10 GLY CA . 51056 1 47 . 1 . 1 11 11 GLY N N 15 109.426 . . 1 . . . . . 10 GLY N . 51056 1 48 . 1 . 1 12 12 TRP H H 1 7.973 . . 1 . . . . . 11 TRP H . 51056 1 49 . 1 . 1 12 12 TRP C C 13 174.549 . . 1 . . . . . 11 TRP C . 51056 1 50 . 1 . 1 12 12 TRP CA C 13 55.162 . . 1 . . . . . 11 TRP CA . 51056 1 51 . 1 . 1 12 12 TRP CB C 13 29.039 . . 1 . . . . . 11 TRP CB . 51056 1 52 . 1 . 1 12 12 TRP N N 15 122.101 . . 1 . . . . . 11 TRP N . 51056 1 53 . 1 . 1 13 13 PRO C C 13 176.685 . . 1 . . . . . 12 PRO C . 51056 1 54 . 1 . 1 13 13 PRO CA C 13 63.494 . . 1 . . . . . 12 PRO CA . 51056 1 55 . 1 . 1 13 13 PRO CB C 13 31.966 . . 1 . . . . . 12 PRO CB . 51056 1 56 . 1 . 1 14 14 ASN H H 1 8.420 . . 1 . . . . . 13 ASN H . 51056 1 57 . 1 . 1 14 14 ASN C C 13 175.040 . . 1 . . . . . 13 ASN C . 51056 1 58 . 1 . 1 14 14 ASN CA C 13 53.604 . . 1 . . . . . 13 ASN CA . 51056 1 59 . 1 . 1 14 14 ASN CB C 13 39.072 . . 1 . . . . . 13 ASN CB . 51056 1 60 . 1 . 1 14 14 ASN N N 15 118.474 . . 1 . . . . . 13 ASN N . 51056 1 61 . 1 . 1 15 15 ASP H H 1 8.324 . . 1 . . . . . 14 ASP H . 51056 1 62 . 1 . 1 15 15 ASP C C 13 176.290 . . 1 . . . . . 14 ASP C . 51056 1 63 . 1 . 1 15 15 ASP CA C 13 54.345 . . 1 . . . . . 14 ASP CA . 51056 1 64 . 1 . 1 15 15 ASP CB C 13 41.061 . . 1 . . . . . 14 ASP CB . 51056 1 65 . 1 . 1 15 15 ASP N N 15 119.854 . . 1 . . . . . 14 ASP N . 51056 1 66 . 1 . 1 16 16 VAL H H 1 7.956 . . 1 . . . . . 15 VAL H . 51056 1 67 . 1 . 1 16 16 VAL C C 13 175.958 . . 1 . . . . . 15 VAL C . 51056 1 68 . 1 . 1 16 16 VAL CA C 13 62.542 . . 1 . . . . . 15 VAL CA . 51056 1 69 . 1 . 1 16 16 VAL CB C 13 32.804 . . 1 . . . . . 15 VAL CB . 51056 1 70 . 1 . 1 16 16 VAL N N 15 119.348 . . 1 . . . . . 15 VAL N . 51056 1 71 . 1 . 1 17 17 ASP H H 1 8.394 . . 1 . . . . . 16 ASP H . 51056 1 72 . 1 . 1 17 17 ASP C C 13 176.664 . . 1 . . . . . 16 ASP C . 51056 1 73 . 1 . 1 17 17 ASP CA C 13 54.434 . . 1 . . . . . 16 ASP CA . 51056 1 74 . 1 . 1 17 17 ASP CB C 13 41.194 . . 1 . . . . . 16 ASP CB . 51056 1 75 . 1 . 1 17 17 ASP N N 15 123.576 . . 1 . . . . . 16 ASP N . 51056 1 76 . 1 . 1 18 18 GLN H H 1 8.374 . . 1 . . . . . 17 GLN H . 51056 1 77 . 1 . 1 18 18 GLN C C 13 176.637 . . 1 . . . . . 17 GLN C . 51056 1 78 . 1 . 1 18 18 GLN CA C 13 56.430 . . 1 . . . . . 17 GLN CA . 51056 1 79 . 1 . 1 18 18 GLN CB C 13 28.844 . . 1 . . . . . 17 GLN CB . 51056 1 80 . 1 . 1 18 18 GLN N N 15 121.617 . . 1 . . . . . 17 GLN N . 51056 1 81 . 1 . 1 19 19 SER H H 1 8.400 . . 1 . . . . . 18 SER H . 51056 1 82 . 1 . 1 19 19 SER C C 13 174.819 . . 1 . . . . . 18 SER C . 51056 1 83 . 1 . 1 19 19 SER CA C 13 59.794 . . 1 . . . . . 18 SER CA . 51056 1 84 . 1 . 1 19 19 SER CB C 13 63.580 . . 1 . . . . . 18 SER CB . 51056 1 85 . 1 . 1 19 19 SER N N 15 116.063 . . 1 . . . . . 18 SER N . 51056 1 86 . 1 . 1 20 20 HIS H H 1 8.151 . . 1 . . . . . 19 HIS H . 51056 1 87 . 1 . 1 20 20 HIS C C 13 175.151 . . 1 . . . . . 19 HIS C . 51056 1 88 . 1 . 1 20 20 HIS CA C 13 56.250 . . 1 . . . . . 19 HIS CA . 51056 1 89 . 1 . 1 20 20 HIS CB C 13 29.769 . . 1 . . . . . 19 HIS CB . 51056 1 90 . 1 . 1 20 20 HIS N N 15 120.163 . . 1 . . . . . 19 HIS N . 51056 1 91 . 1 . 1 21 21 LEU H H 1 7.769 . . 1 . . . . . 20 LEU H . 51056 1 92 . 1 . 1 21 21 LEU C C 13 177.111 . . 1 . . . . . 20 LEU C . 51056 1 93 . 1 . 1 21 21 LEU CA C 13 55.402 . . 1 . . . . . 20 LEU CA . 51056 1 94 . 1 . 1 21 21 LEU CB C 13 42.417 . . 1 . . . . . 20 LEU CB . 51056 1 95 . 1 . 1 21 21 LEU N N 15 122.168 . . 1 . . . . . 20 LEU N . 51056 1 96 . 1 . 1 22 22 ASP H H 1 8.526 . . 1 . . . . . 21 ASP H . 51056 1 97 . 1 . 1 22 22 ASP C C 13 176.776 . . 1 . . . . . 21 ASP C . 51056 1 98 . 1 . 1 22 22 ASP CA C 13 54.239 . . 1 . . . . . 21 ASP CA . 51056 1 99 . 1 . 1 22 22 ASP CB C 13 41.680 . . 1 . . . . . 21 ASP CB . 51056 1 100 . 1 . 1 22 22 ASP N N 15 121.052 . . 1 . . . . . 21 ASP N . 51056 1 101 . 1 . 1 23 23 SER H H 1 8.211 . . 1 . . . . . 22 SER H . 51056 1 102 . 1 . 1 23 23 SER C C 13 175.619 . . 1 . . . . . 22 SER C . 51056 1 103 . 1 . 1 23 23 SER CA C 13 59.196 . . 1 . . . . . 22 SER CA . 51056 1 104 . 1 . 1 23 23 SER CB C 13 63.492 . . 1 . . . . . 22 SER CB . 51056 1 105 . 1 . 1 23 23 SER N N 15 116.638 . . 1 . . . . . 22 SER N . 51056 1 106 . 1 . 1 24 24 SER H H 1 8.483 . . 1 . . . . . 23 SER H . 51056 1 107 . 1 . 1 24 24 SER C C 13 173.833 . . 1 . . . . . 23 SER C . 51056 1 108 . 1 . 1 24 24 SER CA C 13 60.255 . . 1 . . . . . 23 SER CA . 51056 1 109 . 1 . 1 24 24 SER CB C 13 63.738 . . 1 . . . . . 23 SER CB . 51056 1 110 . 1 . 1 24 24 SER N N 15 117.593 . . 1 . . . . . 23 SER N . 51056 1 111 . 1 . 1 25 25 ASP H H 1 8.354 . . 1 . . . . . 24 ASP H . 51056 1 112 . 1 . 1 25 25 ASP C C 13 175.605 . . 1 . . . . . 24 ASP C . 51056 1 113 . 1 . 1 25 25 ASP CA C 13 54.552 . . 1 . . . . . 24 ASP CA . 51056 1 114 . 1 . 1 25 25 ASP CB C 13 41.928 . . 1 . . . . . 24 ASP CB . 51056 1 115 . 1 . 1 25 25 ASP N N 15 118.485 . . 1 . . . . . 24 ASP N . 51056 1 116 . 1 . 1 26 26 MET H H 1 7.900 . . 1 . . . . . 25 MET H . 51056 1 117 . 1 . 1 26 26 MET C C 13 174.385 . . 1 . . . . . 25 MET C . 51056 1 118 . 1 . 1 26 26 MET CA C 13 53.748 . . 1 . . . . . 25 MET CA . 51056 1 119 . 1 . 1 26 26 MET CB C 13 36.699 . . 1 . . . . . 25 MET CB . 51056 1 120 . 1 . 1 26 26 MET N N 15 117.401 . . 1 . . . . . 25 MET N . 51056 1 121 . 1 . 1 27 27 PHE H H 1 8.646 . . 1 . . . . . 26 PHE H . 51056 1 122 . 1 . 1 27 27 PHE C C 13 171.715 . . 1 . . . . . 26 PHE C . 51056 1 123 . 1 . 1 27 27 PHE CA C 13 55.263 . . 1 . . . . . 26 PHE CA . 51056 1 124 . 1 . 1 27 27 PHE CB C 13 41.730 . . 1 . . . . . 26 PHE CB . 51056 1 125 . 1 . 1 27 27 PHE N N 15 115.905 . . 1 . . . . . 26 PHE N . 51056 1 126 . 1 . 1 28 28 ASP H H 1 7.977 . . 1 . . . . . 27 ASP H . 51056 1 127 . 1 . 1 28 28 ASP C C 13 176.924 . . 1 . . . . . 27 ASP C . 51056 1 128 . 1 . 1 28 28 ASP CA C 13 52.479 . . 1 . . . . . 27 ASP CA . 51056 1 129 . 1 . 1 28 28 ASP CB C 13 40.544 . . 1 . . . . . 27 ASP CB . 51056 1 130 . 1 . 1 28 28 ASP N N 15 121.503 . . 1 . . . . . 27 ASP N . 51056 1 131 . 1 . 1 29 29 VAL H H 1 8.206 . . 1 . . . . . 28 VAL H . 51056 1 132 . 1 . 1 29 29 VAL C C 13 176.563 . . 1 . . . . . 28 VAL C . 51056 1 133 . 1 . 1 29 29 VAL CA C 13 66.078 . . 1 . . . . . 28 VAL CA . 51056 1 134 . 1 . 1 29 29 VAL CB C 13 32.234 . . 1 . . . . . 28 VAL CB . 51056 1 135 . 1 . 1 29 29 VAL N N 15 129.240 . . 1 . . . . . 28 VAL N . 51056 1 136 . 1 . 1 30 30 ASP H H 1 7.994 . . 1 . . . . . 29 ASP H . 51056 1 137 . 1 . 1 30 30 ASP C C 13 179.364 . . 1 . . . . . 29 ASP C . 51056 1 138 . 1 . 1 30 30 ASP CA C 13 57.454 . . 1 . . . . . 29 ASP CA . 51056 1 139 . 1 . 1 30 30 ASP CB C 13 40.067 . . 1 . . . . . 29 ASP CB . 51056 1 140 . 1 . 1 30 30 ASP N N 15 120.055 . . 1 . . . . . 29 ASP N . 51056 1 141 . 1 . 1 31 31 GLU H H 1 7.942 . . 1 . . . . . 30 GLU H . 51056 1 142 . 1 . 1 31 31 GLU C C 13 177.984 . . 1 . . . . . 30 GLU C . 51056 1 143 . 1 . 1 31 31 GLU CA C 13 59.033 . . 1 . . . . . 30 GLU CA . 51056 1 144 . 1 . 1 31 31 GLU CB C 13 29.790 . . 1 . . . . . 30 GLU CB . 51056 1 145 . 1 . 1 31 31 GLU N N 15 121.419 . . 1 . . . . . 30 GLU N . 51056 1 146 . 1 . 1 32 32 LEU H H 1 7.762 . . 1 . . . . . 31 LEU H . 51056 1 147 . 1 . 1 32 32 LEU C C 13 178.925 . . 1 . . . . . 31 LEU C . 51056 1 148 . 1 . 1 32 32 LEU CA C 13 58.193 . . 1 . . . . . 31 LEU CA . 51056 1 149 . 1 . 1 32 32 LEU CB C 13 41.249 . . 1 . . . . . 31 LEU CB . 51056 1 150 . 1 . 1 32 32 LEU N N 15 120.066 . . 1 . . . . . 31 LEU N . 51056 1 151 . 1 . 1 33 33 LEU H H 1 8.439 . . 1 . . . . . 32 LEU H . 51056 1 152 . 1 . 1 33 33 LEU C C 13 179.363 . . 1 . . . . . 32 LEU C . 51056 1 153 . 1 . 1 33 33 LEU CA C 13 58.476 . . 1 . . . . . 32 LEU CA . 51056 1 154 . 1 . 1 33 33 LEU CB C 13 41.446 . . 1 . . . . . 32 LEU CB . 51056 1 155 . 1 . 1 33 33 LEU N N 15 117.307 . . 1 . . . . . 32 LEU N . 51056 1 156 . 1 . 1 34 34 ARG H H 1 7.846 . . 1 . . . . . 33 ARG H . 51056 1 157 . 1 . 1 34 34 ARG C C 13 179.382 . . 1 . . . . . 33 ARG C . 51056 1 158 . 1 . 1 34 34 ARG CA C 13 59.723 . . 1 . . . . . 33 ARG CA . 51056 1 159 . 1 . 1 34 34 ARG CB C 13 29.989 . . 1 . . . . . 33 ARG CB . 51056 1 160 . 1 . 1 34 34 ARG N N 15 119.055 . . 1 . . . . . 33 ARG N . 51056 1 161 . 1 . 1 35 35 ASP H H 1 7.970 . . 1 . . . . . 34 ASP H . 51056 1 162 . 1 . 1 35 35 ASP C C 13 178.585 . . 1 . . . . . 34 ASP C . 51056 1 163 . 1 . 1 35 35 ASP CA C 13 56.860 . . 1 . . . . . 34 ASP CA . 51056 1 164 . 1 . 1 35 35 ASP CB C 13 40.686 . . 1 . . . . . 34 ASP CB . 51056 1 165 . 1 . 1 35 35 ASP N N 15 121.085 . . 1 . . . . . 34 ASP N . 51056 1 166 . 1 . 1 36 36 LEU H H 1 8.004 . . 1 . . . . . 35 LEU H . 51056 1 167 . 1 . 1 36 36 LEU C C 13 177.733 . . 1 . . . . . 35 LEU C . 51056 1 168 . 1 . 1 36 36 LEU CA C 13 56.117 . . 1 . . . . . 35 LEU CA . 51056 1 169 . 1 . 1 36 36 LEU CB C 13 41.452 . . 1 . . . . . 35 LEU CB . 51056 1 170 . 1 . 1 36 36 LEU N N 15 117.907 . . 1 . . . . . 35 LEU N . 51056 1 171 . 1 . 1 37 37 ASN H H 1 8.095 . . 1 . . . . . 36 ASN H . 51056 1 172 . 1 . 1 37 37 ASN C C 13 176.262 . . 1 . . . . . 36 ASN C . 51056 1 173 . 1 . 1 37 37 ASN CA C 13 53.589 . . 1 . . . . . 36 ASN CA . 51056 1 174 . 1 . 1 37 37 ASN CB C 13 39.067 . . 1 . . . . . 36 ASN CB . 51056 1 175 . 1 . 1 37 37 ASN N N 15 117.605 . . 1 . . . . . 36 ASN N . 51056 1 176 . 1 . 1 38 38 GLY H H 1 8.086 . . 1 . . . . . 37 GLY H . 51056 1 177 . 1 . 1 38 38 GLY C C 13 174.016 . . 1 . . . . . 37 GLY C . 51056 1 178 . 1 . 1 38 38 GLY CA C 13 45.670 . . 1 . . . . . 37 GLY CA . 51056 1 179 . 1 . 1 38 38 GLY N N 15 109.004 . . 1 . . . . . 37 GLY N . 51056 1 180 . 1 . 1 39 39 ASP H H 1 8.293 . . 1 . . . . . 38 ASP H . 51056 1 181 . 1 . 1 39 39 ASP C C 13 176.081 . . 1 . . . . . 38 ASP C . 51056 1 182 . 1 . 1 39 39 ASP CA C 13 54.520 . . 1 . . . . . 38 ASP CA . 51056 1 183 . 1 . 1 39 39 ASP CB C 13 41.431 . . 1 . . . . . 38 ASP CB . 51056 1 184 . 1 . 1 39 39 ASP N N 15 120.299 . . 1 . . . . . 38 ASP N . 51056 1 185 . 1 . 1 40 40 ASP H H 1 8.363 . . 1 . . . . . 39 ASP H . 51056 1 186 . 1 . 1 40 40 ASP C C 13 176.302 . . 1 . . . . . 39 ASP C . 51056 1 187 . 1 . 1 40 40 ASP CA C 13 54.281 . . 1 . . . . . 39 ASP CA . 51056 1 188 . 1 . 1 40 40 ASP CB C 13 41.273 . . 1 . . . . . 39 ASP CB . 51056 1 189 . 1 . 1 40 40 ASP N N 15 120.439 . . 1 . . . . . 39 ASP N . 51056 1 190 . 1 . 1 41 41 VAL H H 1 8.016 . . 1 . . . . . 40 VAL H . 51056 1 191 . 1 . 1 41 41 VAL C C 13 175.946 . . 1 . . . . . 40 VAL C . 51056 1 192 . 1 . 1 41 41 VAL CA C 13 62.474 . . 1 . . . . . 40 VAL CA . 51056 1 193 . 1 . 1 41 41 VAL CB C 13 32.577 . . 1 . . . . . 40 VAL CB . 51056 1 194 . 1 . 1 41 41 VAL N N 15 119.943 . . 1 . . . . . 40 VAL N . 51056 1 195 . 1 . 1 42 42 PHE H H 1 8.381 . . 1 . . . . . 41 PHE H . 51056 1 196 . 1 . 1 42 42 PHE C C 13 175.362 . . 1 . . . . . 41 PHE C . 51056 1 197 . 1 . 1 42 42 PHE CA C 13 57.930 . . 1 . . . . . 41 PHE CA . 51056 1 198 . 1 . 1 42 42 PHE CB C 13 39.437 . . 1 . . . . . 41 PHE CB . 51056 1 199 . 1 . 1 42 42 PHE N N 15 124.135 . . 1 . . . . . 41 PHE N . 51056 1 200 . 1 . 1 43 43 ALA H H 1 8.196 . . 1 . . . . . 42 ALA H . 51056 1 201 . 1 . 1 43 43 ALA C C 13 176.645 . . 1 . . . . . 42 ALA C . 51056 1 202 . 1 . 1 43 43 ALA CA C 13 52.304 . . 1 . . . . . 42 ALA CA . 51056 1 203 . 1 . 1 43 43 ALA CB C 13 19.459 . . 1 . . . . . 42 ALA CB . 51056 1 204 . 1 . 1 43 43 ALA N N 15 127.682 . . 1 . . . . . 42 ALA N . 51056 1 205 . 1 . 1 44 44 GLY H H 1 7.159 . . 1 . . . . . 43 GLY H . 51056 1 206 . 1 . 1 44 44 GLY C C 13 178.891 . . 1 . . . . . 43 GLY C . 51056 1 207 . 1 . 1 44 44 GLY CA C 13 46.179 . . 1 . . . . . 43 GLY CA . 51056 1 208 . 1 . 1 44 44 GLY N N 15 113.816 . . 1 . . . . . 43 GLY N . 51056 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 51056 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name '13C15N RCD1-RST + DREB2A' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 4 '2D 1H-15N HSQC' . . . 51056 2 5 '3D HNCACB' . . . 51056 2 6 '3D HN(CO)CACB' . . . 51056 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51056 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 . 2 3 3 THR CA C 13 62.011 . . 1 . . . . . 1 THR CA . 51056 2 2 . 2 . 2 3 3 THR CB C 13 69.835 . . 1 . . . . . 1 THR CB . 51056 2 3 . 2 . 2 4 4 THR H H 1 8.273 . . 1 . . . . . 2 THR H . 51056 2 4 . 2 . 2 4 4 THR CA C 13 61.974 . . 1 . . . . . 2 THR CA . 51056 2 5 . 2 . 2 4 4 THR CB C 13 69.866 . . 1 . . . . . 2 THR CB . 51056 2 6 . 2 . 2 4 4 THR N N 15 117.298 . . 1 . . . . . 2 THR N . 51056 2 7 . 2 . 2 5 5 ARG H H 1 8.371 . . 1 . . . . . 3 ARG H . 51056 2 8 . 2 . 2 5 5 ARG CA C 13 54.032 . . 1 . . . . . 3 ARG CA . 51056 2 9 . 2 . 2 5 5 ARG CB C 13 30.334 . . 1 . . . . . 3 ARG CB . 51056 2 10 . 2 . 2 5 5 ARG N N 15 125.204 . . 1 . . . . . 3 ARG N . 51056 2 11 . 2 . 2 6 6 PRO CA C 13 63.014 . . 1 . . . . . 4 PRO CA . 51056 2 12 . 2 . 2 6 6 PRO CB C 13 32.200 . . 1 . . . . . 4 PRO CB . 51056 2 13 . 2 . 2 7 7 LYS H H 1 8.414 . . 1 . . . . . 5 LYS H . 51056 2 14 . 2 . 2 7 7 LYS CA C 13 56.256 . . 1 . . . . . 5 LYS CA . 51056 2 15 . 2 . 2 7 7 LYS CB C 13 33.137 . . 1 . . . . . 5 LYS CB . 51056 2 16 . 2 . 2 7 7 LYS N N 15 121.858 . . 1 . . . . . 5 LYS N . 51056 2 17 . 2 . 2 8 8 SER H H 1 8.669 . . 1 . . . . . 6 SER H . 51056 2 18 . 2 . 2 8 8 SER CA C 13 56.063 . . 1 . . . . . 6 SER CA . 51056 2 19 . 2 . 2 8 8 SER CB C 13 63.661 . . 1 . . . . . 6 SER CB . 51056 2 20 . 2 . 2 8 8 SER N N 15 119.407 . . 1 . . . . . 6 SER N . 51056 2 21 . 2 . 2 9 9 PRO CA C 13 63.263 . . 1 . . . . . 7 PRO CA . 51056 2 22 . 2 . 2 9 9 PRO CB C 13 31.978 . . 1 . . . . . 7 PRO CB . 51056 2 23 . 2 . 2 10 10 TRP H H 1 7.948 . . 1 . . . . . 8 TRP H . 51056 2 24 . 2 . 2 10 10 TRP CA C 13 56.495 . . 1 . . . . . 8 TRP CA . 51056 2 25 . 2 . 2 10 10 TRP CB C 13 30.581 . . 1 . . . . . 8 TRP CB . 51056 2 26 . 2 . 2 10 10 TRP N N 15 120.909 . . 1 . . . . . 8 TRP N . 51056 2 27 . 2 . 2 11 11 MET H H 1 8.449 . . 1 . . . . . 9 MET H . 51056 2 28 . 2 . 2 11 11 MET CA C 13 52.198 . . 1 . . . . . 9 MET CA . 51056 2 29 . 2 . 2 11 11 MET CB C 13 36.467 . . 1 . . . . . 9 MET CB . 51056 2 30 . 2 . 2 11 11 MET N N 15 122.687 . . 1 . . . . . 9 MET N . 51056 2 31 . 2 . 2 12 12 PRO CA C 13 61.940 . . 1 . . . . . 10 PRO CA . 51056 2 32 . 2 . 2 12 12 PRO CB C 13 32.915 . . 1 . . . . . 10 PRO CB . 51056 2 33 . 2 . 2 13 13 PHE H H 1 9.597 . . 1 . . . . . 11 PHE H . 51056 2 34 . 2 . 2 13 13 PHE CA C 13 64.379 . . 1 . . . . . 11 PHE CA . 51056 2 35 . 2 . 2 13 13 PHE CB C 13 36.376 . . 1 . . . . . 11 PHE CB . 51056 2 36 . 2 . 2 13 13 PHE N N 15 126.508 . . 1 . . . . . 11 PHE N . 51056 2 37 . 2 . 2 14 14 PRO CA C 13 66.528 . . 1 . . . . . 12 PRO CA . 51056 2 38 . 2 . 2 14 14 PRO CB C 13 31.237 . . 1 . . . . . 12 PRO CB . 51056 2 39 . 2 . 2 15 15 THR H H 1 7.052 . . 1 . . . . . 13 THR H . 51056 2 40 . 2 . 2 15 15 THR CA C 13 66.552 . . 1 . . . . . 13 THR CA . 51056 2 41 . 2 . 2 15 15 THR CB C 13 68.638 . . 1 . . . . . 13 THR CB . 51056 2 42 . 2 . 2 15 15 THR N N 15 114.819 . . 1 . . . . . 13 THR N . 51056 2 43 . 2 . 2 16 16 LEU H H 1 7.100 . . 1 . . . . . 14 LEU H . 51056 2 44 . 2 . 2 16 16 LEU CA C 13 58.187 . . 1 . . . . . 14 LEU CA . 51056 2 45 . 2 . 2 16 16 LEU CB C 13 41.339 . . 1 . . . . . 14 LEU CB . 51056 2 46 . 2 . 2 16 16 LEU N N 15 123.511 . . 1 . . . . . 14 LEU N . 51056 2 47 . 2 . 2 17 17 PHE H H 1 8.421 . . 1 . . . . . 15 PHE H . 51056 2 48 . 2 . 2 17 17 PHE CA C 13 57.135 . . 1 . . . . . 15 PHE CA . 51056 2 49 . 2 . 2 17 17 PHE CB C 13 36.445 . . 1 . . . . . 15 PHE CB . 51056 2 50 . 2 . 2 17 17 PHE N N 15 117.132 . . 1 . . . . . 15 PHE N . 51056 2 51 . 2 . 2 18 18 ALA H H 1 7.997 . . 1 . . . . . 16 ALA H . 51056 2 52 . 2 . 2 18 18 ALA CA C 13 55.094 . . 1 . . . . . 16 ALA CA . 51056 2 53 . 2 . 2 18 18 ALA CB C 13 17.927 . . 1 . . . . . 16 ALA CB . 51056 2 54 . 2 . 2 18 18 ALA N N 15 120.278 . . 1 . . . . . 16 ALA N . 51056 2 55 . 2 . 2 19 19 ALA H H 1 7.382 . . 1 . . . . . 17 ALA H . 51056 2 56 . 2 . 2 19 19 ALA CA C 13 54.552 . . 1 . . . . . 17 ALA CA . 51056 2 57 . 2 . 2 19 19 ALA CB C 13 19.648 . . 1 . . . . . 17 ALA CB . 51056 2 58 . 2 . 2 19 19 ALA N N 15 119.301 . . 1 . . . . . 17 ALA N . 51056 2 59 . 2 . 2 20 20 ILE H H 1 8.197 . . 1 . . . . . 18 ILE H . 51056 2 60 . 2 . 2 20 20 ILE CA C 13 63.534 . . 1 . . . . . 18 ILE CA . 51056 2 61 . 2 . 2 20 20 ILE CB C 13 38.768 . . 1 . . . . . 18 ILE CB . 51056 2 62 . 2 . 2 20 20 ILE N N 15 112.948 . . 1 . . . . . 18 ILE N . 51056 2 63 . 2 . 2 21 21 SER H H 1 7.982 . . 1 . . . . . 19 SER H . 51056 2 64 . 2 . 2 21 21 SER CA C 13 62.239 . . 1 . . . . . 19 SER CA . 51056 2 65 . 2 . 2 21 21 SER CB C 13 63.059 . . 1 . . . . . 19 SER CB . 51056 2 66 . 2 . 2 21 21 SER N N 15 116.739 . . 1 . . . . . 19 SER N . 51056 2 67 . 2 . 2 22 22 HIS CA C 13 57.237 . . 1 . . . . . 20 HIS CA . 51056 2 68 . 2 . 2 22 22 HIS CB C 13 30.158 . . 1 . . . . . 20 HIS CB . 51056 2 69 . 2 . 2 23 23 LYS H H 1 8.049 . . 1 . . . . . 21 LYS H . 51056 2 70 . 2 . 2 23 23 LYS CA C 13 55.459 . . 1 . . . . . 21 LYS CA . 51056 2 71 . 2 . 2 23 23 LYS CB C 13 35.155 . . 1 . . . . . 21 LYS CB . 51056 2 72 . 2 . 2 23 23 LYS N N 15 117.591 . . 1 . . . . . 21 LYS N . 51056 2 73 . 2 . 2 24 24 VAL H H 1 7.226 . . 1 . . . . . 22 VAL H . 51056 2 74 . 2 . 2 24 24 VAL CA C 13 60.015 . . 1 . . . . . 22 VAL CA . 51056 2 75 . 2 . 2 24 24 VAL CB C 13 34.198 . . 1 . . . . . 22 VAL CB . 51056 2 76 . 2 . 2 24 24 VAL N N 15 115.538 . . 1 . . . . . 22 VAL N . 51056 2 77 . 2 . 2 25 25 ALA H H 1 8.838 . . 1 . . . . . 23 ALA H . 51056 2 78 . 2 . 2 25 25 ALA CA C 13 52.129 . . 1 . . . . . 23 ALA CA . 51056 2 79 . 2 . 2 25 25 ALA CB C 13 19.352 . . 1 . . . . . 23 ALA CB . 51056 2 80 . 2 . 2 25 25 ALA N N 15 126.477 . . 1 . . . . . 23 ALA N . 51056 2 81 . 2 . 2 26 26 GLU H H 1 9.011 . . 1 . . . . . 24 GLU H . 51056 2 82 . 2 . 2 26 26 GLU CA C 13 60.424 . . 1 . . . . . 24 GLU CA . 51056 2 83 . 2 . 2 26 26 GLU CB C 13 29.522 . . 1 . . . . . 24 GLU CB . 51056 2 84 . 2 . 2 26 26 GLU N N 15 123.263 . . 1 . . . . . 24 GLU N . 51056 2 85 . 2 . 2 27 27 ASN H H 1 8.935 . . 1 . . . . . 25 ASN H . 51056 2 86 . 2 . 2 27 27 ASN CA C 13 56.386 . . 1 . . . . . 25 ASN CA . 51056 2 87 . 2 . 2 27 27 ASN CB C 13 37.864 . . 1 . . . . . 25 ASN CB . 51056 2 88 . 2 . 2 27 27 ASN N N 15 114.950 . . 1 . . . . . 25 ASN N . 51056 2 89 . 2 . 2 28 28 ASP H H 1 7.061 . . 1 . . . . . 26 ASP H . 51056 2 90 . 2 . 2 28 28 ASP CA C 13 57.218 . . 1 . . . . . 26 ASP CA . 51056 2 91 . 2 . 2 28 28 ASP CB C 13 40.430 . . 1 . . . . . 26 ASP CB . 51056 2 92 . 2 . 2 28 28 ASP N N 15 119.720 . . 1 . . . . . 26 ASP N . 51056 2 93 . 2 . 2 29 29 MET H H 1 7.747 . . 1 . . . . . 27 MET H . 51056 2 94 . 2 . 2 29 29 MET CA C 13 56.024 . . 1 . . . . . 27 MET CA . 51056 2 95 . 2 . 2 29 29 MET CB C 13 29.826 . . 1 . . . . . 27 MET CB . 51056 2 96 . 2 . 2 29 29 MET N N 15 118.928 . . 1 . . . . . 27 MET N . 51056 2 97 . 2 . 2 30 30 LEU H H 1 7.821 . . 1 . . . . . 28 LEU H . 51056 2 98 . 2 . 2 30 30 LEU CA C 13 58.371 . . 1 . . . . . 28 LEU CA . 51056 2 99 . 2 . 2 30 30 LEU CB C 13 41.431 . . 1 . . . . . 28 LEU CB . 51056 2 100 . 2 . 2 30 30 LEU N N 15 119.312 . . 1 . . . . . 28 LEU N . 51056 2 101 . 2 . 2 31 31 LEU H H 1 7.365 . . 1 . . . . . 29 LEU H . 51056 2 102 . 2 . 2 31 31 LEU CA C 13 58.041 . . 1 . . . . . 29 LEU CA . 51056 2 103 . 2 . 2 31 31 LEU CB C 13 41.847 . . 1 . . . . . 29 LEU CB . 51056 2 104 . 2 . 2 31 31 LEU N N 15 120.907 . . 1 . . . . . 29 LEU N . 51056 2 105 . 2 . 2 32 32 ILE H H 1 7.969 . . 1 . . . . . 30 ILE H . 51056 2 106 . 2 . 2 32 32 ILE CA C 13 65.327 . . 1 . . . . . 30 ILE CA . 51056 2 107 . 2 . 2 32 32 ILE CB C 13 38.228 . . 1 . . . . . 30 ILE CB . 51056 2 108 . 2 . 2 32 32 ILE N N 15 120.815 . . 1 . . . . . 30 ILE N . 51056 2 109 . 2 . 2 33 33 ASN H H 1 8.436 . . 1 . . . . . 31 ASN H . 51056 2 110 . 2 . 2 33 33 ASN CA C 13 56.417 . . 1 . . . . . 31 ASN CA . 51056 2 111 . 2 . 2 33 33 ASN CB C 13 38.428 . . 1 . . . . . 31 ASN CB . 51056 2 112 . 2 . 2 33 33 ASN N N 15 117.133 . . 1 . . . . . 31 ASN N . 51056 2 113 . 2 . 2 34 34 ALA H H 1 7.936 . . 1 . . . . . 32 ALA H . 51056 2 114 . 2 . 2 34 34 ALA CA C 13 55.402 . . 1 . . . . . 32 ALA CA . 51056 2 115 . 2 . 2 34 34 ALA CB C 13 17.953 . . 1 . . . . . 32 ALA CB . 51056 2 116 . 2 . 2 34 34 ALA N N 15 123.581 . . 1 . . . . . 32 ALA N . 51056 2 117 . 2 . 2 35 35 ASP H H 1 8.114 . . 1 . . . . . 33 ASP H . 51056 2 118 . 2 . 2 35 35 ASP CA C 13 57.624 . . 1 . . . . . 33 ASP CA . 51056 2 119 . 2 . 2 35 35 ASP CB C 13 39.404 . . 1 . . . . . 33 ASP CB . 51056 2 120 . 2 . 2 35 35 ASP N N 15 121.323 . . 1 . . . . . 33 ASP N . 51056 2 121 . 2 . 2 36 36 TYR H H 1 9.226 . . 1 . . . . . 34 TYR H . 51056 2 122 . 2 . 2 36 36 TYR CA C 13 60.432 . . 1 . . . . . 34 TYR CA . 51056 2 123 . 2 . 2 36 36 TYR CB C 13 37.856 . . 1 . . . . . 34 TYR CB . 51056 2 124 . 2 . 2 36 36 TYR N N 15 122.400 . . 1 . . . . . 34 TYR N . 51056 2 125 . 2 . 2 37 37 GLN H H 1 8.002 . . 1 . . . . . 35 GLN H . 51056 2 126 . 2 . 2 37 37 GLN CA C 13 58.478 . . 1 . . . . . 35 GLN CA . 51056 2 127 . 2 . 2 37 37 GLN CB C 13 27.755 . . 1 . . . . . 35 GLN CB . 51056 2 128 . 2 . 2 37 37 GLN N N 15 117.843 . . 1 . . . . . 35 GLN N . 51056 2 129 . 2 . 2 38 38 GLN H H 1 7.307 . . 1 . . . . . 36 GLN H . 51056 2 130 . 2 . 2 38 38 GLN CA C 13 59.560 . . 1 . . . . . 36 GLN CA . 51056 2 131 . 2 . 2 38 38 GLN CB C 13 28.897 . . 1 . . . . . 36 GLN CB . 51056 2 132 . 2 . 2 38 38 GLN N N 15 116.687 . . 1 . . . . . 36 GLN N . 51056 2 133 . 2 . 2 39 39 LEU H H 1 8.036 . . 1 . . . . . 37 LEU H . 51056 2 134 . 2 . 2 39 39 LEU CA C 13 58.469 . . 1 . . . . . 37 LEU CA . 51056 2 135 . 2 . 2 39 39 LEU CB C 13 41.067 . . 1 . . . . . 37 LEU CB . 51056 2 136 . 2 . 2 39 39 LEU N N 15 122.914 . . 1 . . . . . 37 LEU N . 51056 2 137 . 2 . 2 40 40 ARG H H 1 8.357 . . 1 . . . . . 38 ARG H . 51056 2 138 . 2 . 2 40 40 ARG CA C 13 59.045 . . 1 . . . . . 38 ARG CA . 51056 2 139 . 2 . 2 40 40 ARG CB C 13 28.949 . . 1 . . . . . 38 ARG CB . 51056 2 140 . 2 . 2 40 40 ARG N N 15 121.501 . . 1 . . . . . 38 ARG N . 51056 2 141 . 2 . 2 41 41 ASP H H 1 7.774 . . 1 . . . . . 39 ASP H . 51056 2 142 . 2 . 2 41 41 ASP CA C 13 54.423 . . 1 . . . . . 39 ASP CA . 51056 2 143 . 2 . 2 41 41 ASP CB C 13 40.945 . . 1 . . . . . 39 ASP CB . 51056 2 144 . 2 . 2 41 41 ASP N N 15 117.697 . . 1 . . . . . 39 ASP N . 51056 2 145 . 2 . 2 42 42 LYS H H 1 8.122 . . 1 . . . . . 40 LYS H . 51056 2 146 . 2 . 2 42 42 LYS CA C 13 57.542 . . 1 . . . . . 40 LYS CA . 51056 2 147 . 2 . 2 42 42 LYS CB C 13 28.381 . . 1 . . . . . 40 LYS CB . 51056 2 148 . 2 . 2 42 42 LYS N N 15 114.001 . . 1 . . . . . 40 LYS N . 51056 2 149 . 2 . 2 43 43 LYS H H 1 8.565 . . 1 . . . . . 41 LYS H . 51056 2 150 . 2 . 2 43 43 LYS CA C 13 55.851 . . 1 . . . . . 41 LYS CA . 51056 2 151 . 2 . 2 43 43 LYS CB C 13 33.392 . . 1 . . . . . 41 LYS CB . 51056 2 152 . 2 . 2 43 43 LYS N N 15 116.642 . . 1 . . . . . 41 LYS N . 51056 2 153 . 2 . 2 44 44 MET H H 1 7.361 . . 1 . . . . . 42 MET H . 51056 2 154 . 2 . 2 44 44 MET CA C 13 54.350 . . 1 . . . . . 42 MET CA . 51056 2 155 . 2 . 2 44 44 MET CB C 13 37.290 . . 1 . . . . . 42 MET CB . 51056 2 156 . 2 . 2 44 44 MET N N 15 117.214 . . 1 . . . . . 42 MET N . 51056 2 157 . 2 . 2 45 45 THR H H 1 8.752 . . 1 . . . . . 43 THR H . 51056 2 158 . 2 . 2 45 45 THR CA C 13 60.942 . . 1 . . . . . 43 THR CA . 51056 2 159 . 2 . 2 45 45 THR CB C 13 71.401 . . 1 . . . . . 43 THR CB . 51056 2 160 . 2 . 2 45 45 THR N N 15 113.476 . . 1 . . . . . 43 THR N . 51056 2 161 . 2 . 2 46 46 ARG H H 1 9.135 . . 1 . . . . . 44 ARG H . 51056 2 162 . 2 . 2 46 46 ARG CA C 13 60.641 . . 1 . . . . . 44 ARG CA . 51056 2 163 . 2 . 2 46 46 ARG CB C 13 29.980 . . 1 . . . . . 44 ARG CB . 51056 2 164 . 2 . 2 46 46 ARG N N 15 122.413 . . 1 . . . . . 44 ARG N . 51056 2 165 . 2 . 2 47 47 ALA H H 1 8.557 . . 1 . . . . . 45 ALA H . 51056 2 166 . 2 . 2 47 47 ALA CA C 13 55.271 . . 1 . . . . . 45 ALA CA . 51056 2 167 . 2 . 2 47 47 ALA CB C 13 18.300 . . 1 . . . . . 45 ALA CB . 51056 2 168 . 2 . 2 47 47 ALA N N 15 119.519 . . 1 . . . . . 45 ALA N . 51056 2 169 . 2 . 2 48 48 GLU H H 1 7.827 . . 1 . . . . . 46 GLU H . 51056 2 170 . 2 . 2 48 48 GLU CA C 13 58.848 . . 1 . . . . . 46 GLU CA . 51056 2 171 . 2 . 2 48 48 GLU CB C 13 29.779 . . 1 . . . . . 46 GLU CB . 51056 2 172 . 2 . 2 48 48 GLU N N 15 119.448 . . 1 . . . . . 46 GLU N . 51056 2 173 . 2 . 2 49 49 PHE H H 1 8.498 . . 1 . . . . . 47 PHE H . 51056 2 174 . 2 . 2 49 49 PHE CA C 13 62.620 . . 1 . . . . . 47 PHE CA . 51056 2 175 . 2 . 2 49 49 PHE CB C 13 39.862 . . 1 . . . . . 47 PHE CB . 51056 2 176 . 2 . 2 49 49 PHE N N 15 120.997 . . 1 . . . . . 47 PHE N . 51056 2 177 . 2 . 2 50 50 VAL H H 1 8.765 . . 1 . . . . . 48 VAL H . 51056 2 178 . 2 . 2 50 50 VAL CA C 13 67.322 . . 1 . . . . . 48 VAL CA . 51056 2 179 . 2 . 2 50 50 VAL CB C 13 31.463 . . 1 . . . . . 48 VAL CB . 51056 2 180 . 2 . 2 50 50 VAL N N 15 118.706 . . 1 . . . . . 48 VAL N . 51056 2 181 . 2 . 2 51 51 ARG H H 1 7.659 . . 1 . . . . . 49 ARG H . 51056 2 182 . 2 . 2 51 51 ARG CA C 13 60.297 . . 1 . . . . . 49 ARG CA . 51056 2 183 . 2 . 2 51 51 ARG CB C 13 29.836 . . 1 . . . . . 49 ARG CB . 51056 2 184 . 2 . 2 51 51 ARG N N 15 119.198 . . 1 . . . . . 49 ARG N . 51056 2 185 . 2 . 2 52 52 LYS H H 1 7.798 . . 1 . . . . . 50 LYS H . 51056 2 186 . 2 . 2 52 52 LYS CA C 13 59.513 . . 1 . . . . . 50 LYS CA . 51056 2 187 . 2 . 2 52 52 LYS CB C 13 31.674 . . 1 . . . . . 50 LYS CB . 51056 2 188 . 2 . 2 52 52 LYS N N 15 119.062 . . 1 . . . . . 50 LYS N . 51056 2 189 . 2 . 2 53 53 LEU H H 1 8.384 . . 1 . . . . . 51 LEU H . 51056 2 190 . 2 . 2 53 53 LEU CA C 13 57.982 . . 1 . . . . . 51 LEU CA . 51056 2 191 . 2 . 2 53 53 LEU CB C 13 42.200 . . 1 . . . . . 51 LEU CB . 51056 2 192 . 2 . 2 53 53 LEU N N 15 121.578 . . 1 . . . . . 51 LEU N . 51056 2 193 . 2 . 2 54 54 ARG H H 1 8.173 . . 1 . . . . . 52 ARG H . 51056 2 194 . 2 . 2 54 54 ARG CA C 13 60.286 . . 1 . . . . . 52 ARG CA . 51056 2 195 . 2 . 2 54 54 ARG CB C 13 31.102 . . 1 . . . . . 52 ARG CB . 51056 2 196 . 2 . 2 54 54 ARG N N 15 117.161 . . 1 . . . . . 52 ARG N . 51056 2 197 . 2 . 2 55 55 VAL H H 1 7.551 . . 1 . . . . . 53 VAL H . 51056 2 198 . 2 . 2 55 55 VAL CA C 13 66.258 . . 1 . . . . . 53 VAL CA . 51056 2 199 . 2 . 2 55 55 VAL CB C 13 31.855 . . 1 . . . . . 53 VAL CB . 51056 2 200 . 2 . 2 55 55 VAL N N 15 119.152 . . 1 . . . . . 53 VAL N . 51056 2 201 . 2 . 2 56 56 ILE H H 1 7.813 . . 1 . . . . . 54 ILE H . 51056 2 202 . 2 . 2 56 56 ILE CA C 13 65.005 . . 1 . . . . . 54 ILE CA . 51056 2 203 . 2 . 2 56 56 ILE CB C 13 39.200 . . 1 . . . . . 54 ILE CB . 51056 2 204 . 2 . 2 56 56 ILE N N 15 118.908 . . 1 . . . . . 54 ILE N . 51056 2 205 . 2 . 2 57 57 VAL H H 1 8.391 . . 1 . . . . . 55 VAL H . 51056 2 206 . 2 . 2 57 57 VAL CA C 13 64.137 . . 1 . . . . . 55 VAL CA . 51056 2 207 . 2 . 2 57 57 VAL CB C 13 32.920 . . 1 . . . . . 55 VAL CB . 51056 2 208 . 2 . 2 57 57 VAL N N 15 114.698 . . 1 . . . . . 55 VAL N . 51056 2 209 . 2 . 2 58 58 GLY H H 1 7.521 . . 1 . . . . . 56 GLY H . 51056 2 210 . 2 . 2 58 58 GLY CA C 13 44.329 . . 1 . . . . . 56 GLY CA . 51056 2 211 . 2 . 2 58 58 GLY N N 15 109.070 . . 1 . . . . . 56 GLY N . 51056 2 212 . 2 . 2 59 59 ASP H H 1 8.277 . . 1 . . . . . 57 ASP H . 51056 2 213 . 2 . 2 59 59 ASP CA C 13 57.878 . . 1 . . . . . 57 ASP CA . 51056 2 214 . 2 . 2 59 59 ASP CB C 13 40.454 . . 1 . . . . . 57 ASP CB . 51056 2 215 . 2 . 2 59 59 ASP N N 15 122.938 . . 1 . . . . . 57 ASP N . 51056 2 216 . 2 . 2 60 60 ASP H H 1 8.430 . . 1 . . . . . 58 ASP H . 51056 2 217 . 2 . 2 60 60 ASP CA C 13 57.803 . . 1 . . . . . 58 ASP CA . 51056 2 218 . 2 . 2 60 60 ASP CB C 13 40.288 . . 1 . . . . . 58 ASP CB . 51056 2 219 . 2 . 2 60 60 ASP N N 15 118.409 . . 1 . . . . . 58 ASP N . 51056 2 220 . 2 . 2 61 61 LEU H H 1 8.453 . . 1 . . . . . 59 LEU H . 51056 2 221 . 2 . 2 61 61 LEU CA C 13 57.224 . . 1 . . . . . 59 LEU CA . 51056 2 222 . 2 . 2 61 61 LEU CB C 13 40.928 . . 1 . . . . . 59 LEU CB . 51056 2 223 . 2 . 2 61 61 LEU N N 15 121.971 . . 1 . . . . . 59 LEU N . 51056 2 224 . 2 . 2 62 62 LEU H H 1 7.980 . . 1 . . . . . 60 LEU H . 51056 2 225 . 2 . 2 62 62 LEU CA C 13 58.723 . . 1 . . . . . 60 LEU CA . 51056 2 226 . 2 . 2 62 62 LEU CB C 13 42.163 . . 1 . . . . . 60 LEU CB . 51056 2 227 . 2 . 2 62 62 LEU N N 15 122.226 . . 1 . . . . . 60 LEU N . 51056 2 228 . 2 . 2 63 63 ARG H H 1 8.777 . . 1 . . . . . 61 ARG H . 51056 2 229 . 2 . 2 63 63 ARG CA C 13 60.637 . . 1 . . . . . 61 ARG CA . 51056 2 230 . 2 . 2 63 63 ARG CB C 13 30.468 . . 1 . . . . . 61 ARG CB . 51056 2 231 . 2 . 2 63 63 ARG N N 15 119.095 . . 1 . . . . . 61 ARG N . 51056 2 232 . 2 . 2 64 64 SER H H 1 8.485 . . 1 . . . . . 62 SER H . 51056 2 233 . 2 . 2 64 64 SER CA C 13 61.497 . . 1 . . . . . 62 SER CA . 51056 2 234 . 2 . 2 64 64 SER CB C 13 62.593 . . 1 . . . . . 62 SER CB . 51056 2 235 . 2 . 2 64 64 SER N N 15 114.920 . . 1 . . . . . 62 SER N . 51056 2 236 . 2 . 2 65 65 THR H H 1 8.164 . . 1 . . . . . 63 THR H . 51056 2 237 . 2 . 2 65 65 THR CA C 13 67.430 . . 1 . . . . . 63 THR CA . 51056 2 238 . 2 . 2 65 65 THR CB C 13 68.391 . . 1 . . . . . 63 THR CB . 51056 2 239 . 2 . 2 65 65 THR N N 15 119.194 . . 1 . . . . . 63 THR N . 51056 2 240 . 2 . 2 66 66 ILE H H 1 8.409 . . 1 . . . . . 64 ILE H . 51056 2 241 . 2 . 2 66 66 ILE CA C 13 66.193 . . 1 . . . . . 64 ILE CA . 51056 2 242 . 2 . 2 66 66 ILE CB C 13 37.586 . . 1 . . . . . 64 ILE CB . 51056 2 243 . 2 . 2 66 66 ILE N N 15 120.914 . . 1 . . . . . 64 ILE N . 51056 2 244 . 2 . 2 67 67 THR H H 1 8.093 . . 1 . . . . . 65 THR H . 51056 2 245 . 2 . 2 67 67 THR CA C 13 66.872 . . 1 . . . . . 65 THR CA . 51056 2 246 . 2 . 2 67 67 THR CB C 13 68.682 . . 1 . . . . . 65 THR CB . 51056 2 247 . 2 . 2 67 67 THR N N 15 113.884 . . 1 . . . . . 65 THR N . 51056 2 248 . 2 . 2 68 68 THR H H 1 7.831 . . 1 . . . . . 66 THR H . 51056 2 249 . 2 . 2 68 68 THR CA C 13 66.576 . . 1 . . . . . 66 THR CA . 51056 2 250 . 2 . 2 68 68 THR CB C 13 68.868 . . 1 . . . . . 66 THR CB . 51056 2 251 . 2 . 2 68 68 THR N N 15 117.753 . . 1 . . . . . 66 THR N . 51056 2 252 . 2 . 2 69 69 LEU H H 1 7.972 . . 1 . . . . . 67 LEU H . 51056 2 253 . 2 . 2 69 69 LEU CA C 13 57.600 . . 1 . . . . . 67 LEU CA . 51056 2 254 . 2 . 2 69 69 LEU CB C 13 42.571 . . 1 . . . . . 67 LEU CB . 51056 2 255 . 2 . 2 69 69 LEU N N 15 121.768 . . 1 . . . . . 67 LEU N . 51056 2 256 . 2 . 2 70 70 GLN H H 1 8.154 . . 1 . . . . . 68 GLN H . 51056 2 257 . 2 . 2 70 70 GLN CA C 13 57.575 . . 1 . . . . . 68 GLN CA . 51056 2 258 . 2 . 2 70 70 GLN CB C 13 29.788 . . 1 . . . . . 68 GLN CB . 51056 2 259 . 2 . 2 70 70 GLN N N 15 116.888 . . 1 . . . . . 68 GLN N . 51056 2 260 . 2 . 2 71 71 ASN H H 1 7.705 . . 1 . . . . . 69 ASN H . 51056 2 261 . 2 . 2 71 71 ASN CA C 13 53.253 . . 1 . . . . . 69 ASN CA . 51056 2 262 . 2 . 2 71 71 ASN CB C 13 39.253 . . 1 . . . . . 69 ASN CB . 51056 2 263 . 2 . 2 71 71 ASN N N 15 116.866 . . 1 . . . . . 69 ASN N . 51056 2 264 . 2 . 2 72 72 GLN H H 1 7.861 . . 1 . . . . . 70 GLN H . 51056 2 265 . 2 . 2 72 72 GLN CA C 13 54.261 . . 1 . . . . . 70 GLN CA . 51056 2 266 . 2 . 2 72 72 GLN CB C 13 28.771 . . 1 . . . . . 70 GLN CB . 51056 2 267 . 2 . 2 72 72 GLN N N 15 121.274 . . 1 . . . . . 70 GLN N . 51056 2 268 . 2 . 2 73 73 PRO CA C 13 63.294 . . 1 . . . . . 71 PRO CA . 51056 2 269 . 2 . 2 73 73 PRO CB C 13 32.150 . . 1 . . . . . 71 PRO CB . 51056 2 270 . 2 . 2 74 74 LYS H H 1 8.489 . . 1 . . . . . 72 LYS H . 51056 2 271 . 2 . 2 74 74 LYS CA C 13 56.255 . . 1 . . . . . 72 LYS CA . 51056 2 272 . 2 . 2 74 74 LYS CB C 13 33.141 . . 1 . . . . . 72 LYS CB . 51056 2 273 . 2 . 2 74 74 LYS N N 15 122.269 . . 1 . . . . . 72 LYS N . 51056 2 274 . 2 . 2 75 75 SER H H 1 7.992 . . 1 . . . . . 73 SER H . 51056 2 275 . 2 . 2 75 75 SER CA C 13 59.966 . . 1 . . . . . 73 SER CA . 51056 2 276 . 2 . 2 75 75 SER CB C 13 64.892 . . 1 . . . . . 73 SER CB . 51056 2 277 . 2 . 2 75 75 SER N N 15 122.817 . . 1 . . . . . 73 SER N . 51056 2 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Entry_ID 51056 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Name '13C15N DREB2A 234-276 T1' _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 ms _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 7 'T1/R1 relaxation' . . . 51056 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 $software_1 . . 51056 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 3 3 ASP N N 15 840.83397 30.3918 . . . . . 51056 1 2 . 1 1 4 4 SER N N 15 804.76569 20.03723 . . . . . 51056 1 3 . 1 1 5 5 LEU N N 15 659.73668 6.33027 . . . . . 51056 1 4 . 1 1 6 6 SER N N 15 666.68907 9.03097 . . . . . 51056 1 5 . 1 1 7 7 VAL N N 15 712.17077 5.78746 . . . . . 51056 1 6 . 1 1 8 8 ALA N N 15 675.48196 8.0207 . . . . . 51056 1 7 . 1 1 9 9 ASP N N 15 681.96015 5.59617 . . . . . 51056 1 8 . 1 1 10 10 TYR N N 15 740.84057 9.30676 . . . . . 51056 1 9 . 1 1 11 11 GLY N N 15 669.54930 6.06368 . . . . . 51056 1 10 . 1 1 12 12 TRP N N 15 674.42705 7.90845 . . . . . 51056 1 11 . 1 1 14 14 ASN N N 15 749.08174 12.1991 . . . . . 51056 1 12 . 1 1 15 15 ASP N N 15 684.31212 9.83547 . . . . . 51056 1 13 . 1 1 16 16 VAL N N 15 695.10276 6.63962 . . . . . 51056 1 14 . 1 1 17 17 ASP N N 15 615.26326 9.70501 . . . . . 51056 1 15 . 1 1 18 18 GLN N N 15 683.89963 11.97407 . . . . . 51056 1 16 . 1 1 19 19 SER N N 15 653.66748 10.69395 . . . . . 51056 1 17 . 1 1 20 20 HIS N N 15 941.36012 80.84263 . . . . . 51056 1 18 . 1 1 21 21 LEU N N 15 671.05194 16.67902 . . . . . 51056 1 19 . 1 1 22 22 ASP N N 15 690.14805 15.64597 . . . . . 51056 1 20 . 1 1 23 23 SER N N 15 838.46220 37.0941 . . . . . 51056 1 21 . 1 1 24 24 SER N N 15 799.15542 32.78519 . . . . . 51056 1 22 . 1 1 25 25 ASP N N 15 804.50995 10.75499 . . . . . 51056 1 23 . 1 1 26 26 MET N N 15 914.96108 12.17496 . . . . . 51056 1 24 . 1 1 27 27 PHE N N 15 955.60758 27.31683 . . . . . 51056 1 25 . 1 1 28 28 ASP N N 15 1019.45157 22.64965 . . . . . 51056 1 26 . 1 1 29 29 VAL N N 15 972.04579 25.5383 . . . . . 51056 1 27 . 1 1 30 30 ASP N N 15 933.52568 53.4601 . . . . . 51056 1 28 . 1 1 31 31 GLU N N 15 965.80133 16.86384 . . . . . 51056 1 29 . 1 1 32 32 LEU N N 15 955.18190 8.97226 . . . . . 51056 1 30 . 1 1 33 33 LEU N N 15 969.17226 19.75557 . . . . . 51056 1 31 . 1 1 34 34 ARG N N 15 974.72444 13.31933 . . . . . 51056 1 32 . 1 1 35 35 ASP N N 15 954.97472 9.16756 . . . . . 51056 1 33 . 1 1 36 36 LEU N N 15 964.81332 16.78871 . . . . . 51056 1 34 . 1 1 37 37 ASN N N 15 884.10605 9.38815 . . . . . 51056 1 35 . 1 1 38 38 GLY N N 15 755.64722 9.49905 . . . . . 51056 1 36 . 1 1 39 39 ASP N N 15 699.75253 4.13282 . . . . . 51056 1 37 . 1 1 40 40 ASP N N 15 671.00880 5.06311 . . . . . 51056 1 38 . 1 1 41 41 VAL N N 15 738.78304 5.96608 . . . . . 51056 1 39 . 1 1 42 42 PHE N N 15 671.57973 3.43162 . . . . . 51056 1 40 . 1 1 43 43 ALA N N 15 831.09196 10.87567 . . . . . 51056 1 41 . 1 1 44 44 GLY N N 15 1354.44357 12.40506 . . . . . 51056 1 stop_ save_ save_heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Entry_ID 51056 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Name '13C15N RCD1-RST T1' _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 ms _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 9 'T1/R1 relaxation' . . . 51056 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 $software_1 . . 51056 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 . 2 2 4 4 THR N N 15 876.62967 83.5617 . . . . . 51056 2 2 . 2 2 5 5 ARG N N 15 786.14279 15.38114 . . . . . 51056 2 3 . 2 2 7 7 LYS N N 15 694.71784 9.26677 . . . . . 51056 2 4 . 2 2 8 8 SER N N 15 815.21023 22.04111 . . . . . 51056 2 5 . 2 2 10 10 TRP N N 15 959.17818 8.47925 . . . . . 51056 2 6 . 2 2 11 11 MET N N 15 1052.75612 18.78298 . . . . . 51056 2 7 . 2 2 13 13 PHE N N 15 970.29711 15.46074 . . . . . 51056 2 8 . 2 2 15 15 THR N N 15 988.88225 15.45173 . . . . . 51056 2 9 . 2 2 16 16 LEU N N 15 947.55320 12.40572 . . . . . 51056 2 10 . 2 2 17 17 PHE N N 15 1055.51862 15.45559 . . . . . 51056 2 11 . 2 2 18 18 ALA N N 15 936.67705 9.63266 . . . . . 51056 2 12 . 2 2 19 19 ALA N N 15 978.65988 7.92335 . . . . . 51056 2 13 . 2 2 20 20 ILE N N 15 973.22584 13.0334 . . . . . 51056 2 14 . 2 2 21 21 SER N N 15 954.25269 9.30974 . . . . . 51056 2 15 . 2 2 23 23 LYS N N 15 952.71826 9.88251 . . . . . 51056 2 16 . 2 2 24 24 VAL N N 15 1091.60693 8.45919 . . . . . 51056 2 17 . 2 2 25 25 ALA N N 15 1007.11358 9.06958 . . . . . 51056 2 18 . 2 2 26 26 GLU N N 15 910.56755 17.73309 . . . . . 51056 2 19 . 2 2 27 27 ASN N N 15 956.19243 23.05153 . . . . . 51056 2 20 . 2 2 28 28 ASP N N 15 989.20988 9.25087 . . . . . 51056 2 21 . 2 2 29 29 MET N N 15 962.69766 7.64493 . . . . . 51056 2 22 . 2 2 30 30 LEU N N 15 940.56952 29.81237 . . . . . 51056 2 23 . 2 2 31 31 LEU N N 15 961.73525 8.82516 . . . . . 51056 2 24 . 2 2 32 32 ILE N N 15 972.68816 10.63716 . . . . . 51056 2 25 . 2 2 33 33 ASN N N 15 938.91329 6.12047 . . . . . 51056 2 26 . 2 2 34 34 ALA N N 15 922.32361 8.91485 . . . . . 51056 2 27 . 2 2 35 35 ASP N N 15 975.20946 7.84506 . . . . . 51056 2 28 . 2 2 36 36 TYR N N 15 918.52912 9.19344 . . . . . 51056 2 29 . 2 2 37 37 GLN N N 15 984.91956 10.32227 . . . . . 51056 2 30 . 2 2 38 38 GLN N N 15 991.46361 4.1491 . . . . . 51056 2 31 . 2 2 39 39 LEU N N 15 963.63453 12.13357 . . . . . 51056 2 32 . 2 2 40 40 ARG N N 15 942.13178 8.15605 . . . . . 51056 2 33 . 2 2 41 41 ASP N N 15 1022.40362 6.13733 . . . . . 51056 2 34 . 2 2 42 42 LYS N N 15 909.92149 7.55153 . . . . . 51056 2 35 . 2 2 43 43 LYS N N 15 987.15807 9.46072 . . . . . 51056 2 36 . 2 2 44 44 MET N N 15 1066.4419 10.49304 . . . . . 51056 2 37 . 2 2 45 45 THR N N 15 961.43245 10.12654 . . . . . 51056 2 38 . 2 2 46 46 ARG N N 15 870.37430 12.23746 . . . . . 51056 2 39 . 2 2 47 47 ALA N N 15 912.70438 5.84935 . . . . . 51056 2 40 . 2 2 48 48 GLU N N 15 1022.29277 11.03356 . . . . . 51056 2 41 . 2 2 49 49 PHE N N 15 948.45778 10.6989 . . . . . 51056 2 42 . 2 2 50 50 VAL N N 15 969.87150 11.83822 . . . . . 51056 2 43 . 2 2 51 51 ARG N N 15 955.23352 8.48673 . . . . . 51056 2 44 . 2 2 52 52 LYS N N 15 1009.13676 8.42928 . . . . . 51056 2 45 . 2 2 53 53 LEU N N 15 974.10302 10.16046 . . . . . 51056 2 46 . 2 2 54 54 ARG N N 15 953.86676 8.19526 . . . . . 51056 2 47 . 2 2 55 55 VAL N N 15 1000.0074 9.00619 . . . . . 51056 2 48 . 2 2 56 56 ILE N N 15 974.53214 7.29637 . . . . . 51056 2 49 . 2 2 57 57 VAL N N 15 951.76114 10.33788 . . . . . 51056 2 50 . 2 2 58 58 GLY N N 15 985.06888 10.2716 . . . . . 51056 2 51 . 2 2 59 59 ASP N N 15 1043.0293 7.67025 . . . . . 51056 2 52 . 2 2 60 60 ASP N N 15 909.33064 9.86444 . . . . . 51056 2 53 . 2 2 61 61 LEU N N 15 882.94838 8.78176 . . . . . 51056 2 54 . 2 2 62 62 LEU N N 15 939.45722 9.74343 . . . . . 51056 2 55 . 2 2 63 63 ARG N N 15 999.16026 11.30177 . . . . . 51056 2 56 . 2 2 64 64 SER N N 15 949.66836 9.93863 . . . . . 51056 2 57 . 2 2 65 65 THR N N 15 939.49935 9.49525 . . . . . 51056 2 58 . 2 2 66 66 ILE N N 15 924.26536 11.96112 . . . . . 51056 2 59 . 2 2 67 67 THR N N 15 991.96028 12.29898 . . . . . 51056 2 60 . 2 2 68 68 THR N N 15 960.61435 11.56525 . . . . . 51056 2 61 . 2 2 69 69 LEU N N 15 921.10633 9.26558 . . . . . 51056 2 62 . 2 2 70 70 GLN N N 15 932.20917 10.76269 . . . . . 51056 2 63 . 2 2 71 71 ASN N N 15 848.77657 14.9977 . . . . . 51056 2 64 . 2 2 72 72 GLN N N 15 696.23197 12.17781 . . . . . 51056 2 65 . 2 2 74 74 LYS N N 15 741.87108 15.92454 . . . . . 51056 2 66 . 2 2 75 75 SER N N 15 887.74981 6.74246 . . . . . 51056 2 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Entry_ID 51056 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Name '13C15N DREB2A 234-276 T2' _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'no calibration applied' _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units ms _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details 13C _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/R2 relaxation' . . . 51056 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 $software_1 . . 51056 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 3 3 ASP N N 15 307.824 6.644 . . . . . . . 51056 1 2 . 1 1 4 4 SER N N 15 264.438 3.242 . . . . . . . 51056 1 3 . 1 1 5 5 LEU N N 15 237.011 2.543 . . . . . . . 51056 1 4 . 1 1 6 6 SER N N 15 157.293 2.068 . . . . . . . 51056 1 5 . 1 1 7 7 VAL N N 15 207.176 1.916 . . . . . . . 51056 1 6 . 1 1 8 8 ALA N N 15 115.555 1.514 . . . . . . . 51056 1 7 . 1 1 9 9 ASP N N 15 163.53 1.916 . . . . . . . 51056 1 8 . 1 1 10 10 TYR N N 15 99.17 1.17 . . . . . . . 51056 1 9 . 1 1 11 11 GLY N N 15 127.703 2.037 . . . . . . . 51056 1 10 . 1 1 12 12 TRP N N 15 149.083 1.209 . . . . . . . 51056 1 11 . 1 1 14 14 ASN N N 15 142.44 1.427 . . . . . . . 51056 1 12 . 1 1 15 15 ASP N N 15 125.691 1.082 . . . . . . . 51056 1 13 . 1 1 16 16 VAL N N 15 150.697 1.098 . . . . . . . 51056 1 14 . 1 1 17 17 ASP N N 15 121.213 1.304 . . . . . . . 51056 1 15 . 1 1 18 18 GLN N N 15 125.138 1.81 . . . . . . . 51056 1 16 . 1 1 19 19 SER N N 15 127.032 1.705 . . . . . . . 51056 1 17 . 1 1 20 20 HIS N N 15 218.334 32.606 . . . . . . . 51056 1 18 . 1 1 21 21 LEU N N 15 101.266 1.375 . . . . . . . 51056 1 19 . 1 1 22 22 ASP N N 15 98.362 1.714 . . . . . . . 51056 1 20 . 1 1 23 23 SER N N 15 93.445 7.56 . . . . . . . 51056 1 21 . 1 1 24 24 SER N N 15 87.91 3.162 . . . . . . . 51056 1 22 . 1 1 25 25 ASP N N 15 74.244 1.514 . . . . . . . 51056 1 23 . 1 1 26 26 MET N N 15 77.963 1.733 . . . . . . . 51056 1 24 . 1 1 27 27 PHE N N 15 79.309 1.336 . . . . . . . 51056 1 25 . 1 1 28 28 ASP N N 15 79.707 2.368 . . . . . . . 51056 1 26 . 1 1 29 29 VAL N N 15 54.781 4.002 . . . . . . . 51056 1 27 . 1 1 30 30 ASP N N 15 79.174 0.969 . . . . . . . 51056 1 28 . 1 1 31 31 GLU N N 15 72.06 1.14 . . . . . . . 51056 1 29 . 1 1 32 32 LEU N N 15 70.499 1.266 . . . . . . . 51056 1 30 . 1 1 33 33 LEU N N 15 72.357 1.362 . . . . . . . 51056 1 31 . 1 1 34 34 ARG N N 15 71.031 0.821 . . . . . . . 51056 1 32 . 1 1 35 35 ASP N N 15 73.416 0.763 . . . . . . . 51056 1 33 . 1 1 36 36 LEU N N 15 74.864 0.705 . . . . . . . 51056 1 34 . 1 1 37 37 ASN N N 15 92.835 0.815 . . . . . . . 51056 1 35 . 1 1 38 38 GLY N N 15 117.327 0.951 . . . . . . . 51056 1 36 . 1 1 39 39 ASP N N 15 157.451 1.454 . . . . . . . 51056 1 37 . 1 1 40 40 ASP N N 15 194.784 1.833 . . . . . . . 51056 1 38 . 1 1 41 41 VAL N N 15 202.04 0.619 . . . . . . . 51056 1 39 . 1 1 42 42 PHE N N 15 209.01 1.756 . . . . . . . 51056 1 40 . 1 1 43 43 ALA N N 15 149.876 1.484 . . . . . . . 51056 1 41 . 1 1 44 44 GLY N N 15 672.09 17.548 . . . . . . . 51056 1 stop_ save_ save_heteronucl_T2_relaxation_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronucl_T2_relaxation_2 _Heteronucl_T2_list.Entry_ID 51056 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Name '13C15N RCD1-RST T2' _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'no calibration applied' _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units ms _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 10 'T2/R2 relaxation' . . . 51056 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 $software_1 . . 51056 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 . 2 2 4 4 THR N N 15 261.87916 25.66418 . . . . . . . 51056 2 2 . 2 2 5 5 ARG N N 15 228.11804 4.94299 . . . . . . . 51056 2 3 . 2 2 7 7 LYS N N 15 157.8042 1.60853 . . . . . . . 51056 2 4 . 2 2 8 8 SER N N 15 122.61525 2.87952 . . . . . . . 51056 2 5 . 2 2 10 10 TRP N N 15 80.62163 1.35407 . . . . . . . 51056 2 6 . 2 2 11 11 MET N N 15 78.54176 1.37784 . . . . . . . 51056 2 7 . 2 2 13 13 PHE N N 15 69.97655 1.94274 . . . . . . . 51056 2 8 . 2 2 15 15 THR N N 15 78.24007 1.55302 . . . . . . . 51056 2 9 . 2 2 16 16 LEU N N 15 74.81685 0.91084 . . . . . . . 51056 2 10 . 2 2 17 17 PHE N N 15 75.86997 0.75577 . . . . . . . 51056 2 11 . 2 2 18 18 ALA N N 15 70.31237 0.83589 . . . . . . . 51056 2 12 . 2 2 19 19 ALA N N 15 74.75013 0.56433 . . . . . . . 51056 2 13 . 2 2 20 20 ILE N N 15 74.05189 1.32972 . . . . . . . 51056 2 14 . 2 2 21 21 SER N N 15 75.81886 0.83209 . . . . . . . 51056 2 15 . 2 2 23 23 LYS N N 15 83.23394 0.57427 . . . . . . . 51056 2 16 . 2 2 24 24 VAL N N 15 91.31308 0.81356 . . . . . . . 51056 2 17 . 2 2 25 25 ALA N N 15 83.4801 1.10075 . . . . . . . 51056 2 18 . 2 2 26 26 GLU N N 15 79.99779 1.30676 . . . . . . . 51056 2 19 . 2 2 27 27 ASN N N 15 78.12115 1.01575 . . . . . . . 51056 2 20 . 2 2 28 28 ASP N N 15 77.31911 0.76577 . . . . . . . 51056 2 21 . 2 2 29 29 MET N N 15 73.24256 0.63599 . . . . . . . 51056 2 22 . 2 2 30 30 LEU N N 15 64.5163 4.45622 . . . . . . . 51056 2 23 . 2 2 31 31 LEU N N 15 72.89203 1.05715 . . . . . . . 51056 2 24 . 2 2 32 32 ILE N N 15 77.6026 0.90207 . . . . . . . 51056 2 25 . 2 2 33 33 ASN N N 15 74.79115 0.93281 . . . . . . . 51056 2 26 . 2 2 34 34 ALA N N 15 72.00397 0.71144 . . . . . . . 51056 2 27 . 2 2 35 35 ASP N N 15 73.85918 0.75599 . . . . . . . 51056 2 28 . 2 2 36 36 TYR N N 15 69.91416 0.87032 . . . . . . . 51056 2 29 . 2 2 37 37 GLN N N 15 72.75454 0.66286 . . . . . . . 51056 2 30 . 2 2 38 38 GLN N N 15 77.64648 0.96933 . . . . . . . 51056 2 31 . 2 2 39 39 LEU N N 15 79.07151 1.31578 . . . . . . . 51056 2 32 . 2 2 40 40 ARG N N 15 70.91409 0.4879 . . . . . . . 51056 2 33 . 2 2 41 41 ASP N N 15 77.79796 0.75512 . . . . . . . 51056 2 34 . 2 2 42 42 LYS N N 15 78.15674 1.1216 . . . . . . . 51056 2 35 . 2 2 43 43 LYS N N 15 82.52679 0.80083 . . . . . . . 51056 2 36 . 2 2 44 44 MET N N 15 83.5477 0.65587 . . . . . . . 51056 2 37 . 2 2 45 45 THR N N 15 79.06619 1.33548 . . . . . . . 51056 2 38 . 2 2 46 46 ARG N N 15 72.35081 1.12528 . . . . . . . 51056 2 39 . 2 2 47 47 ALA N N 15 72.2102 0.52683 . . . . . . . 51056 2 40 . 2 2 48 48 GLU N N 15 71.31114 0.82948 . . . . . . . 51056 2 41 . 2 2 49 49 PHE N N 15 69.61361 0.66735 . . . . . . . 51056 2 42 . 2 2 50 50 VAL N N 15 70.98133 0.84986 . . . . . . . 51056 2 43 . 2 2 51 51 ARG N N 15 72.49316 0.7261 . . . . . . . 51056 2 44 . 2 2 52 52 LYS N N 15 72.00241 0.64364 . . . . . . . 51056 2 45 . 2 2 53 53 LEU N N 15 71.35341 0.67879 . . . . . . . 51056 2 46 . 2 2 54 54 ARG N N 15 76.82858 0.88967 . . . . . . . 51056 2 47 . 2 2 55 55 VAL N N 15 74.18188 1.08655 . . . . . . . 51056 2 48 . 2 2 56 56 ILE N N 15 73.86007 0.59904 . . . . . . . 51056 2 49 . 2 2 57 57 VAL N N 15 76.96190 0.87869 . . . . . . . 51056 2 50 . 2 2 58 58 GLY N N 15 76.92972 0.81239 . . . . . . . 51056 2 51 . 2 2 59 59 ASP N N 15 76.36421 0.81821 . . . . . . . 51056 2 52 . 2 2 60 60 ASP N N 15 71.19736 0.64961 . . . . . . . 51056 2 53 . 2 2 61 61 LEU N N 15 75.83665 1.06324 . . . . . . . 51056 2 54 . 2 2 62 62 LEU N N 15 73.42047 1.83191 . . . . . . . 51056 2 55 . 2 2 63 63 ARG N N 15 70.66273 1.01518 . . . . . . . 51056 2 56 . 2 2 64 64 SER N N 15 75.62441 0.88409 . . . . . . . 51056 2 57 . 2 2 65 65 THR N N 15 71.15446 1.00132 . . . . . . . 51056 2 58 . 2 2 66 66 ILE N N 15 69.17791 1.35564 . . . . . . . 51056 2 59 . 2 2 67 67 THR N N 15 74.80399 0.95137 . . . . . . . 51056 2 60 . 2 2 68 68 THR N N 15 74.31063 0.88241 . . . . . . . 51056 2 61 . 2 2 69 69 LEU N N 15 73.39473 0.88118 . . . . . . . 51056 2 62 . 2 2 70 70 GLN N N 15 82.95440 0.56294 . . . . . . . 51056 2 63 . 2 2 71 71 ASN N N 15 93.70890 1.30271 . . . . . . . 51056 2 64 . 2 2 72 72 GLN N N 15 142.20278 1.3139 . . . . . . . 51056 2 65 . 2 2 74 74 LYS N N 15 210.16903 2.16775 . . . . . . . 51056 2 66 . 2 2 75 75 SER N N 15 434.62702 5.23658 . . . . . . . 51056 2 stop_ save_