data_51262 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51262 _Entry.Title ; histone H3 H4 N-tail in nucleosome ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-01-06 _Entry.Accession_date 2022-01-06 _Entry.Last_release_date 2022-01-09 _Entry.Original_release_date 2022-01-09 _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 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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 Ayako Furukawa . . . . 51262 2 Yoshihumi Nishimura . . . . 51262 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 51262 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 127 51262 '15N chemical shifts' 46 51262 '1H chemical shifts' 46 51262 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 . . 2022-02-07 . original BMRB . 51262 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50367 'histone H3H4ac N-tail in H4acnuc' 51262 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51262 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Acetylated histone H4 tail enhances histone H3 tail acetylation by altering their mutual dynamics in the nucleosome ; _Citation.Status submitted _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 Ayako Furukawa . . . . 51262 1 2 Masatoshi Wakamori . . . . 51262 1 3 Yasuhiro Arimura . . . . 51262 1 4 Hideaki Ohtomo . . . . 51262 1 5 Yasuo Tsunaka . . . . 51262 1 6 Hitoshi Kurumizaka . . . . 51262 1 7 Takashi Umehara . . . . 51262 1 8 Yoshihumi Nishimura . . . . 51262 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51262 _Assembly.ID 1 _Assembly.Name nucleosome _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 no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 H3 1 $entity_1 . . yes native no no . . . 51262 1 2 H4 2 $entity_2 . . yes native no no . . . 51262 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51262 _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 ; ARTKQTARKSTGGKAPRKQL ATKAARKSAPATGGVKKPHR YRPGTVALREIRRYQKSTEL LIRKLPFQRLVREIAQDFKT DLRFQSAAIHAKRVTIMPKD IQLARRIRGERA ; _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 112 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _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 . ALA . 51262 1 2 . ARG . 51262 1 3 . THR . 51262 1 4 . LYS . 51262 1 5 . GLN . 51262 1 6 . THR . 51262 1 7 . ALA . 51262 1 8 . ARG . 51262 1 9 . LYS . 51262 1 10 . SER . 51262 1 11 . THR . 51262 1 12 . GLY . 51262 1 13 . GLY . 51262 1 14 . LYS . 51262 1 15 . ALA . 51262 1 16 . PRO . 51262 1 17 . ARG . 51262 1 18 . LYS . 51262 1 19 . GLN . 51262 1 20 . LEU . 51262 1 21 . ALA . 51262 1 22 . THR . 51262 1 23 . LYS . 51262 1 24 . ALA . 51262 1 25 . ALA . 51262 1 26 . ARG . 51262 1 27 . LYS . 51262 1 28 . SER . 51262 1 29 . ALA . 51262 1 30 . PRO . 51262 1 31 . ALA . 51262 1 32 . THR . 51262 1 33 . GLY . 51262 1 34 . GLY . 51262 1 35 . VAL . 51262 1 36 . LYS . 51262 1 37 . LYS . 51262 1 38 . PRO . 51262 1 39 . HIS . 51262 1 40 . ARG . 51262 1 41 . TYR . 51262 1 42 . ARG . 51262 1 43 . PRO . 51262 1 44 . GLY . 51262 1 45 . THR . 51262 1 46 . VAL . 51262 1 47 . ALA . 51262 1 48 . LEU . 51262 1 49 . ARG . 51262 1 50 . GLU . 51262 1 51 . ILE . 51262 1 52 . ARG . 51262 1 53 . ARG . 51262 1 54 . TYR . 51262 1 55 . GLN . 51262 1 56 . LYS . 51262 1 57 . SER . 51262 1 58 . THR . 51262 1 59 . GLU . 51262 1 60 . LEU . 51262 1 61 . LEU . 51262 1 62 . ILE . 51262 1 63 . ARG . 51262 1 64 . LYS . 51262 1 65 . LEU . 51262 1 66 . PRO . 51262 1 67 . PHE . 51262 1 68 . GLN . 51262 1 69 . ARG . 51262 1 70 . LEU . 51262 1 71 . VAL . 51262 1 72 . ARG . 51262 1 73 . GLU . 51262 1 74 . ILE . 51262 1 75 . ALA . 51262 1 76 . GLN . 51262 1 77 . ASP . 51262 1 78 . PHE . 51262 1 79 . LYS . 51262 1 80 . THR . 51262 1 81 . ASP . 51262 1 82 . LEU . 51262 1 83 . ARG . 51262 1 84 . PHE . 51262 1 85 . GLN . 51262 1 86 . SER . 51262 1 87 . ALA . 51262 1 88 . ALA . 51262 1 89 . ILE . 51262 1 90 . HIS . 51262 1 91 . ALA . 51262 1 92 . LYS . 51262 1 93 . ARG . 51262 1 94 . VAL . 51262 1 95 . THR . 51262 1 96 . ILE . 51262 1 97 . MET . 51262 1 98 . PRO . 51262 1 99 . LYS . 51262 1 100 . ASP . 51262 1 101 . ILE . 51262 1 102 . GLN . 51262 1 103 . LEU . 51262 1 104 . ALA . 51262 1 105 . ARG . 51262 1 106 . ARG . 51262 1 107 . ILE . 51262 1 108 . ARG . 51262 1 109 . GLY . 51262 1 110 . GLU . 51262 1 111 . ARG . 51262 1 112 . ALA . 51262 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 51262 1 . ARG 2 2 51262 1 . THR 3 3 51262 1 . LYS 4 4 51262 1 . GLN 5 5 51262 1 . THR 6 6 51262 1 . ALA 7 7 51262 1 . ARG 8 8 51262 1 . LYS 9 9 51262 1 . SER 10 10 51262 1 . THR 11 11 51262 1 . GLY 12 12 51262 1 . GLY 13 13 51262 1 . LYS 14 14 51262 1 . ALA 15 15 51262 1 . PRO 16 16 51262 1 . ARG 17 17 51262 1 . LYS 18 18 51262 1 . GLN 19 19 51262 1 . LEU 20 20 51262 1 . ALA 21 21 51262 1 . THR 22 22 51262 1 . LYS 23 23 51262 1 . ALA 24 24 51262 1 . ALA 25 25 51262 1 . ARG 26 26 51262 1 . LYS 27 27 51262 1 . SER 28 28 51262 1 . ALA 29 29 51262 1 . PRO 30 30 51262 1 . ALA 31 31 51262 1 . THR 32 32 51262 1 . GLY 33 33 51262 1 . GLY 34 34 51262 1 . VAL 35 35 51262 1 . LYS 36 36 51262 1 . LYS 37 37 51262 1 . PRO 38 38 51262 1 . HIS 39 39 51262 1 . ARG 40 40 51262 1 . TYR 41 41 51262 1 . ARG 42 42 51262 1 . PRO 43 43 51262 1 . GLY 44 44 51262 1 . THR 45 45 51262 1 . VAL 46 46 51262 1 . ALA 47 47 51262 1 . LEU 48 48 51262 1 . ARG 49 49 51262 1 . GLU 50 50 51262 1 . ILE 51 51 51262 1 . ARG 52 52 51262 1 . ARG 53 53 51262 1 . TYR 54 54 51262 1 . GLN 55 55 51262 1 . LYS 56 56 51262 1 . SER 57 57 51262 1 . THR 58 58 51262 1 . GLU 59 59 51262 1 . LEU 60 60 51262 1 . LEU 61 61 51262 1 . ILE 62 62 51262 1 . ARG 63 63 51262 1 . LYS 64 64 51262 1 . LEU 65 65 51262 1 . PRO 66 66 51262 1 . PHE 67 67 51262 1 . GLN 68 68 51262 1 . ARG 69 69 51262 1 . LEU 70 70 51262 1 . VAL 71 71 51262 1 . ARG 72 72 51262 1 . GLU 73 73 51262 1 . ILE 74 74 51262 1 . ALA 75 75 51262 1 . GLN 76 76 51262 1 . ASP 77 77 51262 1 . PHE 78 78 51262 1 . LYS 79 79 51262 1 . THR 80 80 51262 1 . ASP 81 81 51262 1 . LEU 82 82 51262 1 . ARG 83 83 51262 1 . PHE 84 84 51262 1 . GLN 85 85 51262 1 . SER 86 86 51262 1 . ALA 87 87 51262 1 . ALA 88 88 51262 1 . ILE 89 89 51262 1 . HIS 90 90 51262 1 . ALA 91 91 51262 1 . LYS 92 92 51262 1 . ARG 93 93 51262 1 . VAL 94 94 51262 1 . THR 95 95 51262 1 . ILE 96 96 51262 1 . MET 97 97 51262 1 . PRO 98 98 51262 1 . LYS 99 99 51262 1 . ASP 100 100 51262 1 . ILE 101 101 51262 1 . GLN 102 102 51262 1 . LEU 103 103 51262 1 . ALA 104 104 51262 1 . ARG 105 105 51262 1 . ARG 106 106 51262 1 . ILE 107 107 51262 1 . ARG 108 108 51262 1 . GLY 109 109 51262 1 . GLU 110 110 51262 1 . ARG 111 111 51262 1 . ALA 112 112 51262 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 51262 _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 ; SGRGKGGKGLGKGGAKRHRK VLRDNIQGITKPAIRRLARR GGVKRISGLIYEETRGVLKV FLENVIRDAVTYTEHAKRKT VTAMDVVYALKRQGRTLYGF GG ; _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 102 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . SER . 51262 2 2 . GLY . 51262 2 3 . ARG . 51262 2 4 . GLY . 51262 2 5 . LYS . 51262 2 6 . GLY . 51262 2 7 . GLY . 51262 2 8 . LYS . 51262 2 9 . GLY . 51262 2 10 . LEU . 51262 2 11 . GLY . 51262 2 12 . LYS . 51262 2 13 . GLY . 51262 2 14 . GLY . 51262 2 15 . ALA . 51262 2 16 . LYS . 51262 2 17 . ARG . 51262 2 18 . HIS . 51262 2 19 . ARG . 51262 2 20 . LYS . 51262 2 21 . VAL . 51262 2 22 . LEU . 51262 2 23 . ARG . 51262 2 24 . ASP . 51262 2 25 . ASN . 51262 2 26 . ILE . 51262 2 27 . GLN . 51262 2 28 . GLY . 51262 2 29 . ILE . 51262 2 30 . THR . 51262 2 31 . LYS . 51262 2 32 . PRO . 51262 2 33 . ALA . 51262 2 34 . ILE . 51262 2 35 . ARG . 51262 2 36 . ARG . 51262 2 37 . LEU . 51262 2 38 . ALA . 51262 2 39 . ARG . 51262 2 40 . ARG . 51262 2 41 . GLY . 51262 2 42 . GLY . 51262 2 43 . VAL . 51262 2 44 . LYS . 51262 2 45 . ARG . 51262 2 46 . ILE . 51262 2 47 . SER . 51262 2 48 . GLY . 51262 2 49 . LEU . 51262 2 50 . ILE . 51262 2 51 . TYR . 51262 2 52 . GLU . 51262 2 53 . GLU . 51262 2 54 . THR . 51262 2 55 . ARG . 51262 2 56 . GLY . 51262 2 57 . VAL . 51262 2 58 . LEU . 51262 2 59 . LYS . 51262 2 60 . VAL . 51262 2 61 . PHE . 51262 2 62 . LEU . 51262 2 63 . GLU . 51262 2 64 . ASN . 51262 2 65 . VAL . 51262 2 66 . ILE . 51262 2 67 . ARG . 51262 2 68 . ASP . 51262 2 69 . ALA . 51262 2 70 . VAL . 51262 2 71 . THR . 51262 2 72 . TYR . 51262 2 73 . THR . 51262 2 74 . GLU . 51262 2 75 . HIS . 51262 2 76 . ALA . 51262 2 77 . LYS . 51262 2 78 . ARG . 51262 2 79 . LYS . 51262 2 80 . THR . 51262 2 81 . VAL . 51262 2 82 . THR . 51262 2 83 . ALA . 51262 2 84 . MET . 51262 2 85 . ASP . 51262 2 86 . VAL . 51262 2 87 . VAL . 51262 2 88 . TYR . 51262 2 89 . ALA . 51262 2 90 . LEU . 51262 2 91 . LYS . 51262 2 92 . ARG . 51262 2 93 . GLN . 51262 2 94 . GLY . 51262 2 95 . ARG . 51262 2 96 . THR . 51262 2 97 . LEU . 51262 2 98 . TYR . 51262 2 99 . GLY . 51262 2 100 . PHE . 51262 2 101 . GLY . 51262 2 102 . GLY . 51262 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 . SER 1 1 51262 2 . GLY 2 2 51262 2 . ARG 3 3 51262 2 . GLY 4 4 51262 2 . LYS 5 5 51262 2 . GLY 6 6 51262 2 . GLY 7 7 51262 2 . LYS 8 8 51262 2 . GLY 9 9 51262 2 . LEU 10 10 51262 2 . GLY 11 11 51262 2 . LYS 12 12 51262 2 . GLY 13 13 51262 2 . GLY 14 14 51262 2 . ALA 15 15 51262 2 . LYS 16 16 51262 2 . ARG 17 17 51262 2 . HIS 18 18 51262 2 . ARG 19 19 51262 2 . LYS 20 20 51262 2 . VAL 21 21 51262 2 . LEU 22 22 51262 2 . ARG 23 23 51262 2 . ASP 24 24 51262 2 . ASN 25 25 51262 2 . ILE 26 26 51262 2 . GLN 27 27 51262 2 . GLY 28 28 51262 2 . ILE 29 29 51262 2 . THR 30 30 51262 2 . LYS 31 31 51262 2 . PRO 32 32 51262 2 . ALA 33 33 51262 2 . ILE 34 34 51262 2 . ARG 35 35 51262 2 . ARG 36 36 51262 2 . LEU 37 37 51262 2 . ALA 38 38 51262 2 . ARG 39 39 51262 2 . ARG 40 40 51262 2 . GLY 41 41 51262 2 . GLY 42 42 51262 2 . VAL 43 43 51262 2 . LYS 44 44 51262 2 . ARG 45 45 51262 2 . ILE 46 46 51262 2 . SER 47 47 51262 2 . GLY 48 48 51262 2 . LEU 49 49 51262 2 . ILE 50 50 51262 2 . TYR 51 51 51262 2 . GLU 52 52 51262 2 . GLU 53 53 51262 2 . THR 54 54 51262 2 . ARG 55 55 51262 2 . GLY 56 56 51262 2 . VAL 57 57 51262 2 . LEU 58 58 51262 2 . LYS 59 59 51262 2 . VAL 60 60 51262 2 . PHE 61 61 51262 2 . LEU 62 62 51262 2 . GLU 63 63 51262 2 . ASN 64 64 51262 2 . VAL 65 65 51262 2 . ILE 66 66 51262 2 . ARG 67 67 51262 2 . ASP 68 68 51262 2 . ALA 69 69 51262 2 . VAL 70 70 51262 2 . THR 71 71 51262 2 . TYR 72 72 51262 2 . THR 73 73 51262 2 . GLU 74 74 51262 2 . HIS 75 75 51262 2 . ALA 76 76 51262 2 . LYS 77 77 51262 2 . ARG 78 78 51262 2 . LYS 79 79 51262 2 . THR 80 80 51262 2 . VAL 81 81 51262 2 . THR 82 82 51262 2 . ALA 83 83 51262 2 . MET 84 84 51262 2 . ASP 85 85 51262 2 . VAL 86 86 51262 2 . VAL 87 87 51262 2 . TYR 88 88 51262 2 . ALA 89 89 51262 2 . LEU 90 90 51262 2 . LYS 91 91 51262 2 . ARG 92 92 51262 2 . GLN 93 93 51262 2 . GLY 94 94 51262 2 . ARG 95 95 51262 2 . THR 96 96 51262 2 . LEU 97 97 51262 2 . TYR 98 98 51262 2 . GLY 99 99 51262 2 . PHE 100 100 51262 2 . GLY 101 101 51262 2 . GLY 102 102 51262 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 51262 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51262 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51262 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 51262 _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 . . . plasmid . . pET-22b . . . 51262 1 2 2 $entity_2 . 'cell free synthesis' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pCR2.1 . . . 51262 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51262 _Sample.ID 1 _Sample.Name '13C 15N 2H H3 histone' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'H3 histone tail' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 70 . . uM . . . . 51262 1 2 'H4 histone tail' '[U-100% 13C; U-100% 15N]' . . 2 $entity_2 . . 70 . . uM . . . . 51262 1 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 51262 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51262 _Sample.ID 2 _Sample.Name '13C 15N H4 histone' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'H3 histone tail' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 70 . . uM . . . . 51262 2 2 'H4 histone tail' '[U-100% 13C; U-100% 15N]' . . 2 $entity_2 . . 70 . . uM . . . . 51262 2 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 51262 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 51262 _Sample_condition_list.ID 1 _Sample_condition_list.Name H3histone_298K _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' 25 . mM 51262 1 pH 6 . pH 51262 1 temperature 298 . K 51262 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 51262 _Sample_condition_list.ID 2 _Sample_condition_list.Name H4histone_298K _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' 25 . mM 51262 2 pH 6 . pH 51262 2 temperature 298 . K 51262 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51262 _Software.ID 1 _Software.Type . _Software.Name MagRO-NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51262 1 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 51262 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 950MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 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 51262 _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 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 1 2 '3D HN(CO)CA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 1 3 '3D HNCA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 1 4 '3D HN(COCA)CB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 1 5 3DHN(CA)CO no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 1 6 '3D HNCACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51262 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 51262 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name H3H4histone _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 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51262 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 51262 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name H3histonetailNuc _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 '3D HNCO' . . . 51262 1 2 '3D HN(CO)CA' . . . 51262 1 3 '3D HNCA' . . . 51262 1 4 '3D HN(COCA)CB' . . . 51262 1 5 3DHN(CA)CO . . . 51262 1 6 '3D HNCACB' . . . 51262 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 . . 51262 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 1 1 ALA C C 13 173.754 0.300 . 1 . . . . . 1 ALA C . 51262 1 2 . 1 . 1 1 1 ALA CA C 13 51.210 0.300 . 1 . . . . . 1 ALA CA . 51262 1 3 . 1 . 1 1 1 ALA CB C 13 18.927 0.300 . 1 . . . . . 1 ALA CB . 51262 1 4 . 1 . 1 2 2 ARG H H 1 8.734 0.030 . 1 . . . . . 2 ARG H . 51262 1 5 . 1 . 1 2 2 ARG C C 13 176.400 0.300 . 1 . . . . . 2 ARG C . 51262 1 6 . 1 . 1 2 2 ARG CA C 13 55.894 0.300 . 1 . . . . . 2 ARG CA . 51262 1 7 . 1 . 1 2 2 ARG CB C 13 30.045 0.300 . 1 . . . . . 2 ARG CB . 51262 1 8 . 1 . 1 2 2 ARG N N 15 121.054 0.300 . 1 . . . . . 2 ARG N . 51262 1 9 . 1 . 1 3 3 THR H H 1 8.326 0.030 . 1 . . . . . 3 THR H . 51262 1 10 . 1 . 1 3 3 THR C C 13 174.463 0.300 . 1 . . . . . 3 THR C . 51262 1 11 . 1 . 1 3 3 THR CA C 13 61.647 0.300 . 1 . . . . . 3 THR CA . 51262 1 12 . 1 . 1 3 3 THR CB C 13 69.578 0.300 . 1 . . . . . 3 THR CB . 51262 1 13 . 1 . 1 3 3 THR N N 15 116.949 0.300 . 1 . . . . . 3 THR N . 51262 1 14 . 1 . 1 4 4 LYS H H 1 8.478 0.030 . 1 . . . . . 4 LYS H . 51262 1 15 . 1 . 1 4 4 LYS C C 13 176.590 0.300 . 1 . . . . . 4 LYS C . 51262 1 16 . 1 . 1 4 4 LYS CA C 13 56.220 0.300 . 1 . . . . . 4 LYS CA . 51262 1 17 . 1 . 1 4 4 LYS CB C 13 32.394 0.300 . 1 . . . . . 4 LYS CB . 51262 1 18 . 1 . 1 4 4 LYS N N 15 124.334 0.300 . 1 . . . . . 4 LYS N . 51262 1 19 . 1 . 1 5 5 GLN H H 1 8.560 0.030 . 1 . . . . . 5 GLN H . 51262 1 20 . 1 . 1 5 5 GLN C C 13 176.234 0.300 . 1 . . . . . 5 GLN C . 51262 1 21 . 1 . 1 5 5 GLN CA C 13 55.806 0.300 . 1 . . . . . 5 GLN CA . 51262 1 22 . 1 . 1 5 5 GLN CB C 13 28.872 0.300 . 1 . . . . . 5 GLN CB . 51262 1 23 . 1 . 1 5 5 GLN N N 15 122.422 0.300 . 1 . . . . . 5 GLN N . 51262 1 24 . 1 . 1 6 6 THR H H 1 8.119 0.030 . 1 . . . . . 6 THR H . 51262 1 25 . 1 . 1 6 6 THR C C 13 174.333 0.300 . 1 . . . . . 6 THR C . 51262 1 26 . 1 . 1 6 6 THR CA C 13 61.607 0.300 . 1 . . . . . 6 THR CA . 51262 1 27 . 1 . 1 6 6 THR CB C 13 69.573 0.300 . 1 . . . . . 6 THR CB . 51262 1 28 . 1 . 1 6 6 THR N N 15 115.801 0.300 . 1 . . . . . 6 THR N . 51262 1 29 . 1 . 1 7 7 ALA H H 1 8.323 0.030 . 1 . . . . . 7 ALA H . 51262 1 30 . 1 . 1 7 7 ALA C C 13 177.684 0.300 . 1 . . . . . 7 ALA C . 51262 1 31 . 1 . 1 7 7 ALA CA C 13 51.973 0.300 . 1 . . . . . 7 ALA CA . 51262 1 32 . 1 . 1 7 7 ALA CB C 13 18.738 0.300 . 1 . . . . . 7 ALA CB . 51262 1 33 . 1 . 1 7 7 ALA N N 15 126.659 0.300 . 1 . . . . . 7 ALA N . 51262 1 34 . 1 . 1 8 8 ARG H H 1 8.277 0.030 . 1 . . . . . 8 ARG H . 51262 1 35 . 1 . 1 8 8 ARG C C 13 176.472 0.300 . 1 . . . . . 8 ARG C . 51262 1 36 . 1 . 1 8 8 ARG CA C 13 55.790 0.300 . 1 . . . . . 8 ARG CA . 51262 1 37 . 1 . 1 8 8 ARG CB C 13 29.821 0.300 . 1 . . . . . 8 ARG CB . 51262 1 38 . 1 . 1 8 8 ARG N N 15 120.842 0.300 . 1 . . . . . 8 ARG N . 51262 1 39 . 1 . 1 9 9 LYS H H 1 8.396 0.030 . 1 . . . . . 9 LYS H . 51262 1 40 . 1 . 1 9 9 LYS C C 13 176.733 0.300 . 1 . . . . . 9 LYS C . 51262 1 41 . 1 . 1 9 9 LYS CA C 13 56.013 0.300 . 1 . . . . . 9 LYS CA . 51262 1 42 . 1 . 1 9 9 LYS CB C 13 32.394 0.300 . 1 . . . . . 9 LYS CB . 51262 1 43 . 1 . 1 9 9 LYS N N 15 123.210 0.300 . 1 . . . . . 9 LYS N . 51262 1 44 . 1 . 1 10 10 SER H H 1 8.402 0.030 . 1 . . . . . 10 SER H . 51262 1 45 . 1 . 1 10 10 SER C C 13 175.058 0.300 . 1 . . . . . 10 SER C . 51262 1 46 . 1 . 1 10 10 SER CA C 13 57.967 0.300 . 1 . . . . . 10 SER CA . 51262 1 47 . 1 . 1 10 10 SER CB C 13 63.461 0.300 . 1 . . . . . 10 SER CB . 51262 1 48 . 1 . 1 10 10 SER N N 15 117.490 0.300 . 1 . . . . . 10 SER N . 51262 1 49 . 1 . 1 11 11 THR H H 1 8.226 0.030 . 1 . . . . . 11 THR H . 51262 1 50 . 1 . 1 11 11 THR C C 13 175.379 0.300 . 1 . . . . . 11 THR C . 51262 1 51 . 1 . 1 11 11 THR CA C 13 61.503 0.300 . 1 . . . . . 11 THR CA . 51262 1 52 . 1 . 1 11 11 THR CB C 13 69.480 0.300 . 1 . . . . . 11 THR CB . 51262 1 53 . 1 . 1 11 11 THR N N 15 115.695 0.300 . 1 . . . . . 11 THR N . 51262 1 54 . 1 . 1 12 12 GLY H H 1 8.410 0.030 . 1 . . . . . 12 GLY H . 51262 1 55 . 1 . 1 12 12 GLY C C 13 174.689 0.300 . 1 . . . . . 12 GLY C . 51262 1 56 . 1 . 1 12 12 GLY CA C 13 45.164 0.300 . 1 . . . . . 12 GLY CA . 51262 1 57 . 1 . 1 12 12 GLY N N 15 111.280 0.300 . 1 . . . . . 12 GLY N . 51262 1 58 . 1 . 1 13 13 GLY H H 1 8.264 0.030 . 1 . . . . . 13 GLY H . 51262 1 59 . 1 . 1 13 13 GLY C C 13 173.988 0.300 . 1 . . . . . 13 GLY C . 51262 1 60 . 1 . 1 13 13 GLY CA C 13 44.721 0.300 . 1 . . . . . 13 GLY CA . 51262 1 61 . 1 . 1 13 13 GLY N N 15 109.229 0.300 . 1 . . . . . 13 GLY N . 51262 1 62 . 1 . 1 14 14 LYS H H 1 8.142 0.030 . 1 . . . . . 14 LYS H . 51262 1 63 . 1 . 1 14 14 LYS C C 13 176.186 0.300 . 1 . . . . . 14 LYS C . 51262 1 64 . 1 . 1 14 14 LYS CA C 13 55.479 0.300 . 1 . . . . . 14 LYS CA . 51262 1 65 . 1 . 1 14 14 LYS CB C 13 32.413 0.300 . 1 . . . . . 14 LYS CB . 51262 1 66 . 1 . 1 14 14 LYS N N 15 121.193 0.300 . 1 . . . . . 14 LYS N . 51262 1 67 . 1 . 1 15 15 ALA H H 1 8.380 0.030 . 1 . . . . . 15 ALA H . 51262 1 68 . 1 . 1 15 15 ALA C C 13 175.476 0.300 . 1 . . . . . 15 ALA C . 51262 1 69 . 1 . 1 15 15 ALA N N 15 127.170 0.300 . 1 . . . . . 15 ALA N . 51262 1 70 . 1 . 1 16 16 PRO C C 13 177.069 0.300 . 1 . . . . . 16 PRO C . 51262 1 71 . 1 . 1 16 16 PRO CA C 13 62.746 0.300 . 1 . . . . . 16 PRO CA . 51262 1 72 . 1 . 1 16 16 PRO CB C 13 31.462 0.300 . 1 . . . . . 16 PRO CB . 51262 1 73 . 1 . 1 17 17 ARG H H 1 8.429 0.030 . 1 . . . . . 17 ARG H . 51262 1 74 . 1 . 1 17 17 ARG C C 13 176.590 0.300 . 1 . . . . . 17 ARG C . 51262 1 75 . 1 . 1 17 17 ARG CA C 13 55.806 0.300 . 1 . . . . . 17 ARG CA . 51262 1 76 . 1 . 1 17 17 ARG CB C 13 30.115 0.300 . 1 . . . . . 17 ARG CB . 51262 1 77 . 1 . 1 17 17 ARG N N 15 121.880 0.300 . 1 . . . . . 17 ARG N . 51262 1 78 . 1 . 1 18 18 LYS H H 1 8.401 0.030 . 1 . . . . . 18 LYS H . 51262 1 79 . 1 . 1 18 18 LYS C C 13 176.567 0.300 . 1 . . . . . 18 LYS C . 51262 1 80 . 1 . 1 18 18 LYS CA C 13 56.116 0.300 . 1 . . . . . 18 LYS CA . 51262 1 81 . 1 . 1 18 18 LYS CB C 13 32.187 0.300 . 1 . . . . . 18 LYS CB . 51262 1 82 . 1 . 1 18 18 LYS N N 15 123.129 0.300 . 1 . . . . . 18 LYS N . 51262 1 83 . 1 . 1 19 19 GLN H H 1 8.385 0.030 . 1 . . . . . 19 GLN H . 51262 1 84 . 1 . 1 19 19 GLN C C 13 175.961 0.300 . 1 . . . . . 19 GLN C . 51262 1 85 . 1 . 1 19 19 GLN CA C 13 55.635 0.300 . 1 . . . . . 19 GLN CA . 51262 1 86 . 1 . 1 19 19 GLN CB C 13 28.680 0.300 . 1 . . . . . 19 GLN CB . 51262 1 87 . 1 . 1 19 19 GLN N N 15 121.995 0.300 . 1 . . . . . 19 GLN N . 51262 1 88 . 1 . 1 20 20 LEU H H 1 8.282 0.030 . 1 . . . . . 20 LEU H . 51262 1 89 . 1 . 1 20 20 LEU C C 13 177.339 0.300 . 1 . . . . . 20 LEU C . 51262 1 90 . 1 . 1 20 20 LEU CA C 13 54.873 0.300 . 1 . . . . . 20 LEU CA . 51262 1 91 . 1 . 1 20 20 LEU CB C 13 41.407 0.300 . 1 . . . . . 20 LEU CB . 51262 1 92 . 1 . 1 20 20 LEU N N 15 124.026 0.300 . 1 . . . . . 20 LEU N . 51262 1 93 . 1 . 1 21 21 ALA H H 1 8.334 0.030 . 1 . . . . . 21 ALA H . 51262 1 94 . 1 . 1 21 21 ALA C C 13 178.064 0.300 . 1 . . . . . 21 ALA C . 51262 1 95 . 1 . 1 21 21 ALA CA C 13 52.265 0.300 . 1 . . . . . 21 ALA CA . 51262 1 96 . 1 . 1 21 21 ALA CB C 13 18.521 0.300 . 1 . . . . . 21 ALA CB . 51262 1 97 . 1 . 1 21 21 ALA N N 15 124.938 0.300 . 1 . . . . . 21 ALA N . 51262 1 98 . 1 . 1 22 22 THR H H 1 8.006 0.030 . 1 . . . . . 22 THR H . 51262 1 99 . 1 . 1 22 22 THR C C 13 174.808 0.300 . 1 . . . . . 22 THR C . 51262 1 100 . 1 . 1 22 22 THR CA C 13 61.607 0.300 . 1 . . . . . 22 THR CA . 51262 1 101 . 1 . 1 22 22 THR CB C 13 69.273 0.300 . 1 . . . . . 22 THR CB . 51262 1 102 . 1 . 1 22 22 THR N N 15 113.740 0.300 . 1 . . . . . 22 THR N . 51262 1 103 . 1 . 1 23 23 LYS H H 1 8.261 0.030 . 1 . . . . . 23 LYS H . 51262 1 104 . 1 . 1 23 23 LYS C C 13 176.674 0.300 . 1 . . . . . 23 LYS C . 51262 1 105 . 1 . 1 23 23 LYS CA C 13 56.427 0.300 . 1 . . . . . 23 LYS CA . 51262 1 106 . 1 . 1 23 23 LYS CB C 13 32.394 0.300 . 1 . . . . . 23 LYS CB . 51262 1 107 . 1 . 1 23 23 LYS N N 15 123.865 0.300 . 1 . . . . . 23 LYS N . 51262 1 108 . 1 . 1 24 24 ALA H H 1 8.242 0.030 . 1 . . . . . 24 ALA H . 51262 1 109 . 1 . 1 24 24 ALA C C 13 177.743 0.300 . 1 . . . . . 24 ALA C . 51262 1 110 . 1 . 1 24 24 ALA CA C 13 52.180 0.300 . 1 . . . . . 24 ALA CA . 51262 1 111 . 1 . 1 24 24 ALA CB C 13 18.720 0.300 . 1 . . . . . 24 ALA CB . 51262 1 112 . 1 . 1 24 24 ALA N N 15 125.015 0.300 . 1 . . . . . 24 ALA N . 51262 1 113 . 1 . 1 25 25 ALA H H 1 8.147 0.030 . 1 . . . . . 25 ALA H . 51262 1 114 . 1 . 1 25 25 ALA C C 13 178.052 0.300 . 1 . . . . . 25 ALA C . 51262 1 115 . 1 . 1 25 25 ALA CA C 13 52.076 0.300 . 1 . . . . . 25 ALA CA . 51262 1 116 . 1 . 1 25 25 ALA CB C 13 18.513 0.300 . 1 . . . . . 25 ALA CB . 51262 1 117 . 1 . 1 25 25 ALA N N 15 123.421 0.300 . 1 . . . . . 25 ALA N . 51262 1 118 . 1 . 1 26 26 ARG H H 1 8.186 0.030 . 1 . . . . . 26 ARG H . 51262 1 119 . 1 . 1 26 26 ARG C C 13 176.650 0.300 . 1 . . . . . 26 ARG C . 51262 1 120 . 1 . 1 26 26 ARG CA C 13 55.790 0.300 . 1 . . . . . 26 ARG CA . 51262 1 121 . 1 . 1 26 26 ARG CB C 13 29.769 0.300 . 1 . . . . . 26 ARG CB . 51262 1 122 . 1 . 1 26 26 ARG N N 15 120.516 0.300 . 1 . . . . . 26 ARG N . 51262 1 123 . 1 . 1 27 27 LYS H H 1 8.313 0.030 . 1 . . . . . 27 LYS H . 51262 1 124 . 1 . 1 27 27 LYS C C 13 176.640 0.300 . 1 . . . . . 27 LYS C . 51262 1 125 . 1 . 1 27 27 LYS CA C 13 56.116 0.300 . 1 . . . . . 27 LYS CA . 51262 1 126 . 1 . 1 27 27 LYS CB C 13 31.980 0.300 . 1 . . . . . 27 LYS CB . 51262 1 127 . 1 . 1 27 27 LYS N N 15 122.730 0.300 . 1 . . . . . 27 LYS N . 51262 1 128 . 1 . 1 28 28 SER H H 1 8.197 0.030 . 1 . . . . . 28 SER H . 51262 1 129 . 1 . 1 28 28 SER C C 13 173.668 0.300 . 1 . . . . . 28 SER C . 51262 1 130 . 1 . 1 28 28 SER CA C 13 57.863 0.300 . 1 . . . . . 28 SER CA . 51262 1 131 . 1 . 1 28 28 SER CB C 13 63.876 0.300 . 1 . . . . . 28 SER CB . 51262 1 132 . 1 . 1 28 28 SER N N 15 117.174 0.300 . 1 . . . . . 28 SER N . 51262 1 133 . 1 . 1 29 29 ALA H H 1 8.236 0.030 . 1 . . . . . 29 ALA H . 51262 1 134 . 1 . 1 29 29 ALA C C 13 175.405 0.300 . 1 . . . . . 29 ALA C . 51262 1 135 . 1 . 1 29 29 ALA N N 15 127.244 0.300 . 1 . . . . . 29 ALA N . 51262 1 136 . 1 . 1 30 30 PRO C C 13 176.902 0.300 . 1 . . . . . 30 PRO C . 51262 1 137 . 1 . 1 30 30 PRO CA C 13 62.850 0.300 . 1 . . . . . 30 PRO CA . 51262 1 138 . 1 . 1 30 30 PRO CB C 13 31.358 0.300 . 1 . . . . . 30 PRO CB . 51262 1 139 . 1 . 1 31 31 ALA H H 1 8.463 0.030 . 1 . . . . . 31 ALA H . 51262 1 140 . 1 . 1 31 31 ALA C C 13 178.230 0.300 . 1 . . . . . 31 ALA C . 51262 1 141 . 1 . 1 31 31 ALA CA C 13 52.284 0.300 . 1 . . . . . 31 ALA CA . 51262 1 142 . 1 . 1 31 31 ALA CB C 13 18.409 0.300 . 1 . . . . . 31 ALA CB . 51262 1 143 . 1 . 1 31 31 ALA N N 15 124.725 0.300 . 1 . . . . . 31 ALA N . 51262 1 144 . 1 . 1 32 32 THR H H 1 8.042 0.030 . 1 . . . . . 32 THR H . 51262 1 145 . 1 . 1 32 32 THR C C 13 175.319 0.300 . 1 . . . . . 32 THR C . 51262 1 146 . 1 . 1 32 32 THR CA C 13 61.647 0.300 . 1 . . . . . 32 THR CA . 51262 1 147 . 1 . 1 32 32 THR CB C 13 69.111 0.300 . 1 . . . . . 32 THR CB . 51262 1 148 . 1 . 1 32 32 THR N N 15 112.745 0.300 . 1 . . . . . 32 THR N . 51262 1 149 . 1 . 1 33 33 GLY H H 1 8.353 0.030 . 1 . . . . . 33 GLY H . 51262 1 150 . 1 . 1 33 33 GLY C C 13 174.594 0.300 . 1 . . . . . 33 GLY C . 51262 1 151 . 1 . 1 33 33 GLY CA C 13 45.060 0.300 . 1 . . . . . 33 GLY CA . 51262 1 152 . 1 . 1 33 33 GLY N N 15 111.287 0.300 . 1 . . . . . 33 GLY N . 51262 1 153 . 1 . 1 34 34 GLY H H 1 8.227 0.030 . 1 . . . . . 34 GLY H . 51262 1 154 . 1 . 1 34 34 GLY C C 13 173.822 0.300 . 1 . . . . . 34 GLY C . 51262 1 155 . 1 . 1 34 34 GLY CA C 13 44.466 0.300 . 1 . . . . . 34 GLY CA . 51262 1 156 . 1 . 1 34 34 GLY N N 15 109.239 0.300 . 1 . . . . . 34 GLY N . 51262 1 157 . 1 . 1 35 35 VAL H H 1 7.911 0.030 . 1 . . . . . 35 VAL H . 51262 1 158 . 1 . 1 35 35 VAL C C 13 175.925 0.300 . 1 . . . . . 35 VAL C . 51262 1 159 . 1 . 1 35 35 VAL CA C 13 61.584 0.300 . 1 . . . . . 35 VAL CA . 51262 1 160 . 1 . 1 35 35 VAL CB C 13 31.913 0.300 . 1 . . . . . 35 VAL CB . 51262 1 161 . 1 . 1 35 35 VAL N N 15 119.727 0.300 . 1 . . . . . 35 VAL N . 51262 1 162 . 1 . 1 36 36 LYS H H 1 8.319 0.030 . 1 . . . . . 36 LYS H . 51262 1 163 . 1 . 1 36 36 LYS C C 13 177.678 0.300 . 1 . . . . . 36 LYS C . 51262 1 164 . 1 . 1 36 36 LYS N N 15 126.229 0.300 . 1 . . . . . 36 LYS N . 51262 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 51262 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name H4histonetailNuc _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 '3D HNCO' . . . 51262 2 2 '3D HN(CO)CA' . . . 51262 2 3 '3D HNCA' . . . 51262 2 4 '3D HN(COCA)CB' . . . 51262 2 5 3DHN(CA)CO . . . 51262 2 6 '3D HNCACB' . . . 51262 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 . . 51262 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 2 2 GLY C C 13 173.944 0.300 . 1 . . . . . 2 GLY C . 51262 2 2 . 2 . 2 2 2 GLY CA C 13 45.239 0.300 . 1 . . . . . 2 GLY CA . 51262 2 3 . 2 . 2 3 3 ARG H H 1 8.469 0.030 . 1 . . . . . 3 ARG H . 51262 2 4 . 2 . 2 3 3 ARG C C 13 177.066 0.300 . 1 . . . . . 3 ARG C . 51262 2 5 . 2 . 2 3 3 ARG CA C 13 56.360 0.300 . 1 . . . . . 3 ARG CA . 51262 2 6 . 2 . 2 3 3 ARG N N 15 121.304 0.300 . 1 . . . . . 3 ARG N . 51262 2 7 . 2 . 2 4 4 GLY H H 1 8.556 0.030 . 1 . . . . . 4 GLY H . 51262 2 8 . 2 . 2 4 4 GLY C C 13 174.297 0.300 . 1 . . . . . 4 GLY C . 51262 2 9 . 2 . 2 4 4 GLY CA C 13 45.400 0.300 . 1 . . . . . 4 GLY CA . 51262 2 10 . 2 . 2 4 4 GLY N N 15 110.751 0.300 . 1 . . . . . 4 GLY N . 51262 2 11 . 2 . 2 5 5 LYS H H 1 8.334 0.030 . 1 . . . . . 5 LYS H . 51262 2 12 . 2 . 2 5 5 LYS C C 13 177.446 0.300 . 1 . . . . . 5 LYS C . 51262 2 13 . 2 . 2 5 5 LYS CA C 13 56.531 0.300 . 1 . . . . . 5 LYS CA . 51262 2 14 . 2 . 2 5 5 LYS CB C 13 33.016 0.300 . 1 . . . . . 5 LYS CB . 51262 2 15 . 2 . 2 5 5 LYS N N 15 121.365 0.300 . 1 . . . . . 5 LYS N . 51262 2 16 . 2 . 2 6 6 GLY H H 1 8.535 0.030 . 1 . . . . . 6 GLY H . 51262 2 17 . 2 . 2 6 6 GLY C C 13 174.725 0.300 . 1 . . . . . 6 GLY C . 51262 2 18 . 2 . 2 6 6 GLY CA C 13 45.343 0.300 . 1 . . . . . 6 GLY CA . 51262 2 19 . 2 . 2 6 6 GLY N N 15 110.564 0.300 . 1 . . . . . 6 GLY N . 51262 2 20 . 2 . 2 7 7 GLY H H 1 8.298 0.030 . 1 . . . . . 7 GLY H . 51262 2 21 . 2 . 2 7 7 GLY C C 13 174.368 0.300 . 1 . . . . . 7 GLY C . 51262 2 22 . 2 . 2 7 7 GLY CA C 13 45.267 0.300 . 1 . . . . . 7 GLY CA . 51262 2 23 . 2 . 2 7 7 GLY N N 15 109.320 0.300 . 1 . . . . . 7 GLY N . 51262 2 24 . 2 . 2 8 8 LYS H H 1 8.293 0.030 . 1 . . . . . 8 LYS H . 51262 2 25 . 2 . 2 8 8 LYS C C 13 177.375 0.300 . 1 . . . . . 8 LYS C . 51262 2 26 . 2 . 2 8 8 LYS CA C 13 56.427 0.300 . 1 . . . . . 8 LYS CA . 51262 2 27 . 2 . 2 8 8 LYS CB C 13 33.119 0.300 . 1 . . . . . 8 LYS CB . 51262 2 28 . 2 . 2 8 8 LYS N N 15 121.324 0.300 . 1 . . . . . 8 LYS N . 51262 2 29 . 2 . 2 9 9 GLY H H 1 8.509 0.030 . 1 . . . . . 9 GLY H . 51262 2 30 . 2 . 2 9 9 GLY C C 13 174.285 0.300 . 1 . . . . . 9 GLY C . 51262 2 31 . 2 . 2 9 9 GLY CA C 13 45.447 0.300 . 1 . . . . . 9 GLY CA . 51262 2 32 . 2 . 2 9 9 GLY N N 15 110.398 0.300 . 1 . . . . . 9 GLY N . 51262 2 33 . 2 . 2 10 10 LEU H H 1 8.158 0.030 . 1 . . . . . 10 LEU H . 51262 2 34 . 2 . 2 10 10 LEU C C 13 178.159 0.300 . 1 . . . . . 10 LEU C . 51262 2 35 . 2 . 2 10 10 LEU CA C 13 55.184 0.300 . 1 . . . . . 10 LEU CA . 51262 2 36 . 2 . 2 10 10 LEU CB C 13 42.442 0.300 . 1 . . . . . 10 LEU CB . 51262 2 37 . 2 . 2 10 10 LEU N N 15 121.852 0.300 . 1 . . . . . 10 LEU N . 51262 2 38 . 2 . 2 11 11 GLY H H 1 8.471 0.030 . 1 . . . . . 11 GLY H . 51262 2 39 . 2 . 2 11 11 GLY C C 13 174.368 0.300 . 1 . . . . . 11 GLY C . 51262 2 40 . 2 . 2 11 11 GLY N N 15 110.011 0.300 . 1 . . . . . 11 GLY N . 51262 2 41 . 2 . 2 12 12 LYS H H 1 8.294 0.030 . 1 . . . . . 12 LYS H . 51262 2 42 . 2 . 2 12 12 LYS C C 13 176.961 0.300 . 1 . . . . . 12 LYS C . 51262 2 43 . 2 . 2 12 12 LYS CA C 13 56.324 0.300 . 1 . . . . . 12 LYS CA . 51262 2 44 . 2 . 2 12 12 LYS CB C 13 33.119 0.300 . 1 . . . . . 12 LYS CB . 51262 2 45 . 2 . 2 12 12 LYS N N 15 121.188 0.300 . 1 . . . . . 12 LYS N . 51262 2 46 . 2 . 2 13 13 GLY H H 1 8.535 0.030 . 1 . . . . . 13 GLY H . 51262 2 47 . 2 . 2 13 13 GLY C C 13 174.653 0.300 . 1 . . . . . 13 GLY C . 51262 2 48 . 2 . 2 13 13 GLY CA C 13 45.032 0.300 . 1 . . . . . 13 GLY CA . 51262 2 49 . 2 . 2 13 13 GLY N N 15 110.551 0.300 . 1 . . . . . 13 GLY N . 51262 2 50 . 2 . 2 14 14 GLY H H 1 8.190 0.030 . 1 . . . . . 14 GLY H . 51262 2 51 . 2 . 2 14 14 GLY C C 13 173.858 0.300 . 1 . . . . . 14 GLY C . 51262 2 52 . 2 . 2 14 14 GLY N N 15 109.173 0.300 . 1 . . . . . 14 GLY N . 51262 2 53 . 2 . 2 15 15 ALA H H 1 8.185 0.030 . 1 . . . . . 15 ALA H . 51262 2 54 . 2 . 2 15 15 ALA C C 13 177.891 0.300 . 1 . . . . . 15 ALA C . 51262 2 55 . 2 . 2 15 15 ALA N N 15 124.248 0.300 . 1 . . . . . 15 ALA N . 51262 2 stop_ save_