data_27571 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27571 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the bHLHZip c-MYC:MAX complex. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-08-06 _Entry.Accession_date 2018-08-06 _Entry.Last_release_date 2018-08-06 _Entry.Original_release_date 2018-08-06 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 . _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 Mark Bycroft . . . . 27571 2 Giovanna Zinzalla . . . . 27571 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Karolinska Institutet' . 27571 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 27571 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 466 27571 '15N chemical shifts' 149 27571 '1H chemical shifts' 149 27571 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 4 . . 2019-07-15 2018-08-06 update author 'update entry citation' 27571 3 . . 2019-04-05 2018-08-06 update author 'update assignments' 27571 2 . . 2019-01-04 2018-08-06 update BMRB 'update entry citation' 27571 1 . . 2018-09-18 2018-08-06 original author 'original release' 27571 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6G6J '2.25A X-ray crystal structure.' 27571 PDB 6G6K '1.35A X-ray crystal structure.' 27571 PDB 6G6L '2.2 X-ray crystal structure.' 27571 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 27571 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 31260268 _Citation.Full_citation . _Citation.Title ; Crystal Structures and Nuclear Magnetic Resonance Studies of the Apo Form of the c-MYC:MAX bHLHZip Complex Reveal a Helical Basic Region in the Absence of DNA ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _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 2019 _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 Susan Sammak S. . . . 27571 1 2 Najoua Hamdani N. . . . 27571 1 3 Fabrice Gorrec F. . . . 27571 1 4 Mark Allen M. D. . . 27571 1 5 Stefan Freund S. D. . . 27571 1 6 Mark Bycroft M. . . . 27571 1 7 Giovanna Zinzalla G. . . . 27571 1 stop_ save_ save_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode citation_2 _Citation.Entry_ID 27571 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30222246 _Citation.Full_citation . _Citation.Title ; The structure of INI1/hSNF5 RPT1 and its interactions with the c-MYC:MAX heterodimer provide insights into the interplay between MYC and the SWI/SNF chromatin remodeling complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS J.' _Citation.Journal_name_full . _Citation.Journal_volume 285 _Citation.Journal_issue 22 _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 4165 _Citation.Page_last 4180 _Citation.Year 2018 _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 Susan Sammak S. . . . 27571 2 2 Mark Allen M. D. . . 27571 2 3 Najoua Hamdani N. . . . 27571 2 4 Mark Bycroft M. . . . 27571 2 5 Giovanna Zinzalla G. . . . 27571 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27571 _Assembly.ID 1 _Assembly.Name c-MYC/MAX _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details 'c-MYC/MAX bHlHzip complex' _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 c-MYC 1 $c-MYC A . yes native no no . . . 27571 1 2 MAX 2 $MAX B . yes native no no . . . 27571 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_c-MYC _Entity.Sf_category entity _Entity.Sf_framecode c-MYC _Entity.Entry_ID 27571 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name c-MYC _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 ; GSSHHHHHHSSGLVPRGSHM NVKRRTHNVLERQRRNELKR SFFALRDQIPELENNEKAPK VVILKKATAYILSVQAEEQK LISEEDLLRKRREQLKHKLE QLRNS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Residues 1-20 represent a non-native affinity tag, residues 20-105 are residues 352-437 of the human Myc proto-oncogene protein. ; _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 105 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'HlHzip domain' _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_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes SP P01106 . c-MYC . . . . . . . . . . . . . . 27571 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 27571 1 2 . SER . 27571 1 3 . SER . 27571 1 4 . HIS . 27571 1 5 . HIS . 27571 1 6 . HIS . 27571 1 7 . HIS . 27571 1 8 . HIS . 27571 1 9 . HIS . 27571 1 10 . SER . 27571 1 11 . SER . 27571 1 12 . GLY . 27571 1 13 . LEU . 27571 1 14 . VAL . 27571 1 15 . PRO . 27571 1 16 . ARG . 27571 1 17 . GLY . 27571 1 18 . SER . 27571 1 19 . HIS . 27571 1 20 . MET . 27571 1 21 . ASN . 27571 1 22 . VAL . 27571 1 23 . LYS . 27571 1 24 . ARG . 27571 1 25 . ARG . 27571 1 26 . THR . 27571 1 27 . HIS . 27571 1 28 . ASN . 27571 1 29 . VAL . 27571 1 30 . LEU . 27571 1 31 . GLU . 27571 1 32 . ARG . 27571 1 33 . GLN . 27571 1 34 . ARG . 27571 1 35 . ARG . 27571 1 36 . ASN . 27571 1 37 . GLU . 27571 1 38 . LEU . 27571 1 39 . LYS . 27571 1 40 . ARG . 27571 1 41 . SER . 27571 1 42 . PHE . 27571 1 43 . PHE . 27571 1 44 . ALA . 27571 1 45 . LEU . 27571 1 46 . ARG . 27571 1 47 . ASP . 27571 1 48 . GLN . 27571 1 49 . ILE . 27571 1 50 . PRO . 27571 1 51 . GLU . 27571 1 52 . LEU . 27571 1 53 . GLU . 27571 1 54 . ASN . 27571 1 55 . ASN . 27571 1 56 . GLU . 27571 1 57 . LYS . 27571 1 58 . ALA . 27571 1 59 . PRO . 27571 1 60 . LYS . 27571 1 61 . VAL . 27571 1 62 . VAL . 27571 1 63 . ILE . 27571 1 64 . LEU . 27571 1 65 . LYS . 27571 1 66 . LYS . 27571 1 67 . ALA . 27571 1 68 . THR . 27571 1 69 . ALA . 27571 1 70 . TYR . 27571 1 71 . ILE . 27571 1 72 . LEU . 27571 1 73 . SER . 27571 1 74 . VAL . 27571 1 75 . GLN . 27571 1 76 . ALA . 27571 1 77 . GLU . 27571 1 78 . GLU . 27571 1 79 . GLN . 27571 1 80 . LYS . 27571 1 81 . LEU . 27571 1 82 . ILE . 27571 1 83 . SER . 27571 1 84 . GLU . 27571 1 85 . GLU . 27571 1 86 . ASP . 27571 1 87 . LEU . 27571 1 88 . LEU . 27571 1 89 . ARG . 27571 1 90 . LYS . 27571 1 91 . ARG . 27571 1 92 . ARG . 27571 1 93 . GLU . 27571 1 94 . GLN . 27571 1 95 . LEU . 27571 1 96 . LYS . 27571 1 97 . HIS . 27571 1 98 . LYS . 27571 1 99 . LEU . 27571 1 100 . GLU . 27571 1 101 . GLN . 27571 1 102 . LEU . 27571 1 103 . ARG . 27571 1 104 . ASN . 27571 1 105 . SER . 27571 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 27571 1 . SER 2 2 27571 1 . SER 3 3 27571 1 . HIS 4 4 27571 1 . HIS 5 5 27571 1 . HIS 6 6 27571 1 . HIS 7 7 27571 1 . HIS 8 8 27571 1 . HIS 9 9 27571 1 . SER 10 10 27571 1 . SER 11 11 27571 1 . GLY 12 12 27571 1 . LEU 13 13 27571 1 . VAL 14 14 27571 1 . PRO 15 15 27571 1 . ARG 16 16 27571 1 . GLY 17 17 27571 1 . SER 18 18 27571 1 . HIS 19 19 27571 1 . MET 20 20 27571 1 . ASN 21 21 27571 1 . VAL 22 22 27571 1 . LYS 23 23 27571 1 . ARG 24 24 27571 1 . ARG 25 25 27571 1 . THR 26 26 27571 1 . HIS 27 27 27571 1 . ASN 28 28 27571 1 . VAL 29 29 27571 1 . LEU 30 30 27571 1 . GLU 31 31 27571 1 . ARG 32 32 27571 1 . GLN 33 33 27571 1 . ARG 34 34 27571 1 . ARG 35 35 27571 1 . ASN 36 36 27571 1 . GLU 37 37 27571 1 . LEU 38 38 27571 1 . LYS 39 39 27571 1 . ARG 40 40 27571 1 . SER 41 41 27571 1 . PHE 42 42 27571 1 . PHE 43 43 27571 1 . ALA 44 44 27571 1 . LEU 45 45 27571 1 . ARG 46 46 27571 1 . ASP 47 47 27571 1 . GLN 48 48 27571 1 . ILE 49 49 27571 1 . PRO 50 50 27571 1 . GLU 51 51 27571 1 . LEU 52 52 27571 1 . GLU 53 53 27571 1 . ASN 54 54 27571 1 . ASN 55 55 27571 1 . GLU 56 56 27571 1 . LYS 57 57 27571 1 . ALA 58 58 27571 1 . PRO 59 59 27571 1 . LYS 60 60 27571 1 . VAL 61 61 27571 1 . VAL 62 62 27571 1 . ILE 63 63 27571 1 . LEU 64 64 27571 1 . LYS 65 65 27571 1 . LYS 66 66 27571 1 . ALA 67 67 27571 1 . THR 68 68 27571 1 . ALA 69 69 27571 1 . TYR 70 70 27571 1 . ILE 71 71 27571 1 . LEU 72 72 27571 1 . SER 73 73 27571 1 . VAL 74 74 27571 1 . GLN 75 75 27571 1 . ALA 76 76 27571 1 . GLU 77 77 27571 1 . GLU 78 78 27571 1 . GLN 79 79 27571 1 . LYS 80 80 27571 1 . LEU 81 81 27571 1 . ILE 82 82 27571 1 . SER 83 83 27571 1 . GLU 84 84 27571 1 . GLU 85 85 27571 1 . ASP 86 86 27571 1 . LEU 87 87 27571 1 . LEU 88 88 27571 1 . ARG 89 89 27571 1 . LYS 90 90 27571 1 . ARG 91 91 27571 1 . ARG 92 92 27571 1 . GLU 93 93 27571 1 . GLN 94 94 27571 1 . LEU 95 95 27571 1 . LYS 96 96 27571 1 . HIS 97 97 27571 1 . LYS 98 98 27571 1 . LEU 99 99 27571 1 . GLU 100 100 27571 1 . GLN 101 101 27571 1 . LEU 102 102 27571 1 . ARG 103 103 27571 1 . ASN 104 104 27571 1 . SER 105 105 27571 1 stop_ save_ save_MAX _Entity.Sf_category entity _Entity.Sf_framecode MAX _Entity.Entry_ID 27571 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name MAX _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 ; ADKRAHHNALERKRRDHIKD SFHSLRDSVPSLQGEKASRA QILDKATEYIQYMRRKNHTH QQDIDDLKRQNALLEQQVRA LE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 22-103 of human MAX protein.' _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 82 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'HlHzip domain' _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_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes SP P61244 . MAX . . . . . . . . . . . . . . 27571 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ALA . 27571 2 2 . ASP . 27571 2 3 . LYS . 27571 2 4 . ARG . 27571 2 5 . ALA . 27571 2 6 . HIS . 27571 2 7 . HIS . 27571 2 8 . ASN . 27571 2 9 . ALA . 27571 2 10 . LEU . 27571 2 11 . GLU . 27571 2 12 . ARG . 27571 2 13 . LYS . 27571 2 14 . ARG . 27571 2 15 . ARG . 27571 2 16 . ASP . 27571 2 17 . HIS . 27571 2 18 . ILE . 27571 2 19 . LYS . 27571 2 20 . ASP . 27571 2 21 . SER . 27571 2 22 . PHE . 27571 2 23 . HIS . 27571 2 24 . SER . 27571 2 25 . LEU . 27571 2 26 . ARG . 27571 2 27 . ASP . 27571 2 28 . SER . 27571 2 29 . VAL . 27571 2 30 . PRO . 27571 2 31 . SER . 27571 2 32 . LEU . 27571 2 33 . GLN . 27571 2 34 . GLY . 27571 2 35 . GLU . 27571 2 36 . LYS . 27571 2 37 . ALA . 27571 2 38 . SER . 27571 2 39 . ARG . 27571 2 40 . ALA . 27571 2 41 . GLN . 27571 2 42 . ILE . 27571 2 43 . LEU . 27571 2 44 . ASP . 27571 2 45 . LYS . 27571 2 46 . ALA . 27571 2 47 . THR . 27571 2 48 . GLU . 27571 2 49 . TYR . 27571 2 50 . ILE . 27571 2 51 . GLN . 27571 2 52 . TYR . 27571 2 53 . MET . 27571 2 54 . ARG . 27571 2 55 . ARG . 27571 2 56 . LYS . 27571 2 57 . ASN . 27571 2 58 . HIS . 27571 2 59 . THR . 27571 2 60 . HIS . 27571 2 61 . GLN . 27571 2 62 . GLN . 27571 2 63 . ASP . 27571 2 64 . ILE . 27571 2 65 . ASP . 27571 2 66 . ASP . 27571 2 67 . LEU . 27571 2 68 . LYS . 27571 2 69 . ARG . 27571 2 70 . GLN . 27571 2 71 . ASN . 27571 2 72 . ALA . 27571 2 73 . LEU . 27571 2 74 . LEU . 27571 2 75 . GLU . 27571 2 76 . GLN . 27571 2 77 . GLN . 27571 2 78 . VAL . 27571 2 79 . ARG . 27571 2 80 . ALA . 27571 2 81 . LEU . 27571 2 82 . GLU . 27571 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 . ALA 1 1 27571 2 . ASP 2 2 27571 2 . LYS 3 3 27571 2 . ARG 4 4 27571 2 . ALA 5 5 27571 2 . HIS 6 6 27571 2 . HIS 7 7 27571 2 . ASN 8 8 27571 2 . ALA 9 9 27571 2 . LEU 10 10 27571 2 . GLU 11 11 27571 2 . ARG 12 12 27571 2 . LYS 13 13 27571 2 . ARG 14 14 27571 2 . ARG 15 15 27571 2 . ASP 16 16 27571 2 . HIS 17 17 27571 2 . ILE 18 18 27571 2 . LYS 19 19 27571 2 . ASP 20 20 27571 2 . SER 21 21 27571 2 . PHE 22 22 27571 2 . HIS 23 23 27571 2 . SER 24 24 27571 2 . LEU 25 25 27571 2 . ARG 26 26 27571 2 . ASP 27 27 27571 2 . SER 28 28 27571 2 . VAL 29 29 27571 2 . PRO 30 30 27571 2 . SER 31 31 27571 2 . LEU 32 32 27571 2 . GLN 33 33 27571 2 . GLY 34 34 27571 2 . GLU 35 35 27571 2 . LYS 36 36 27571 2 . ALA 37 37 27571 2 . SER 38 38 27571 2 . ARG 39 39 27571 2 . ALA 40 40 27571 2 . GLN 41 41 27571 2 . ILE 42 42 27571 2 . LEU 43 43 27571 2 . ASP 44 44 27571 2 . LYS 45 45 27571 2 . ALA 46 46 27571 2 . THR 47 47 27571 2 . GLU 48 48 27571 2 . TYR 49 49 27571 2 . ILE 50 50 27571 2 . GLN 51 51 27571 2 . TYR 52 52 27571 2 . MET 53 53 27571 2 . ARG 54 54 27571 2 . ARG 55 55 27571 2 . LYS 56 56 27571 2 . ASN 57 57 27571 2 . HIS 58 58 27571 2 . THR 59 59 27571 2 . HIS 60 60 27571 2 . GLN 61 61 27571 2 . GLN 62 62 27571 2 . ASP 63 63 27571 2 . ILE 64 64 27571 2 . ASP 65 65 27571 2 . ASP 66 66 27571 2 . LEU 67 67 27571 2 . LYS 68 68 27571 2 . ARG 69 69 27571 2 . GLN 70 70 27571 2 . ASN 71 71 27571 2 . ALA 72 72 27571 2 . LEU 73 73 27571 2 . LEU 74 74 27571 2 . GLU 75 75 27571 2 . GLN 76 76 27571 2 . GLN 77 77 27571 2 . VAL 78 78 27571 2 . ARG 79 79 27571 2 . ALA 80 80 27571 2 . LEU 81 81 27571 2 . GLU 82 82 27571 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 27571 _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 $c-MYC . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27571 1 2 2 $MAX . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27571 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 27571 _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 $c-MYC . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET24a . . . 27571 1 2 2 $MAX . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET24a . . . 27571 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27571 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 c-MYC '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $c-MYC . . 250 200 300 uM . . . . 27571 1 2 MAX '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 2 $MAX . . 250 200 300 uM . . . . 27571 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27571 1 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 27571 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27571 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 27571 1 pH 7.0 . pH 27571 1 pressure 1 . atm 27571 1 temperature 298 . K 27571 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27571 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 27571 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27571 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27571 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model ARX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27571 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker ARX . 800 . . . 27571 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27571 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27571 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27571 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27571 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27571 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27571 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27571 _Chem_shift_reference.ID 1 _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 0.00 na indirect 0.251449530 . . . . . 27571 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27571 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27571 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27571 _Assigned_chem_shift_list.ID 1 _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 $chemical_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' . . . 27571 1 2 '3D 1H-15N NOESY' . . . 27571 1 3 '3D CBCA(CO)NH' . . . 27571 1 4 '3D HNCACB' . . . 27571 1 5 '3D HNCO' . . . 27571 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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 13 13 LEU H H 1 7.95 . . . . . . . . 14 L H . 27571 1 2 . 1 1 13 13 LEU C C 13 177.36 . . . . . . . . 14 L CO . 27571 1 3 . 1 1 13 13 LEU CA C 13 54.94 . . . . . . . . 14 L CA . 27571 1 4 . 1 1 13 13 LEU CB C 13 41.58 . . . . . . . . 14 L CB . 27571 1 5 . 1 1 13 13 LEU N N 15 121.641 . . . . . . . . 14 L N . 27571 1 6 . 1 1 14 14 VAL H H 1 7.99 . . . . . . . . 15 V H . 27571 1 7 . 1 1 14 14 VAL CA C 13 59.58 . . . . . . . . 15 V CA . 27571 1 8 . 1 1 14 14 VAL CB C 13 32.00 . . . . . . . . 15 V CB . 27571 1 9 . 1 1 14 14 VAL N N 15 122.67 . . . . . . . . 15 V N . 27571 1 10 . 1 1 15 15 PRO C C 13 177.19 . . . . . . . . 16 P CO . 27571 1 11 . 1 1 15 15 PRO CA C 13 62.92 . . . . . . . . 16 P CA . 27571 1 12 . 1 1 15 15 PRO CB C 13 31.45 . . . . . . . . 16 P CB . 27571 1 13 . 1 1 16 16 ARG H H 1 8.39 . . . . . . . . 17 R H . 27571 1 14 . 1 1 16 16 ARG C C 13 177.27 . . . . . . . . 17 R CO . 27571 1 15 . 1 1 16 16 ARG CA C 13 56.18 . . . . . . . . 17 R CA . 27571 1 16 . 1 1 16 16 ARG CB C 13 30.09 . . . . . . . . 17 R CB . 27571 1 17 . 1 1 16 16 ARG N N 15 122.00 . . . . . . . . 17 R N . 27571 1 18 . 1 1 21 21 ASN C C 13 175.404 . . . . . . . . 21 N CO . 27571 1 19 . 1 1 21 21 ASN CA C 13 53.225 . . . . . . . . 21 N CA . 27571 1 20 . 1 1 21 21 ASN CB C 13 38.366 . . . . . . . . 21 N CB . 27571 1 21 . 1 1 22 22 VAL H H 1 7.925 . . . . . . . . 22 V H . 27571 1 22 . 1 1 22 22 VAL C C 13 176.43 . . . . . . . . 22 V CO . 27571 1 23 . 1 1 22 22 VAL CA C 13 62.37 . . . . . . . . 22 V CA . 27571 1 24 . 1 1 22 22 VAL CB C 13 31.96 . . . . . . . . 22 V CB . 27571 1 25 . 1 1 22 22 VAL N N 15 120.495 . . . . . . . . 22 V N . 27571 1 26 . 1 1 23 23 LYS H H 1 8.255 . . . . . . . . 23 K H . 27571 1 27 . 1 1 23 23 LYS C C 13 177.09 . . . . . . . . 23 K CO . 27571 1 28 . 1 1 23 23 LYS CA C 13 56.3 . . . . . . . . 23 K CA . 27571 1 29 . 1 1 23 23 LYS CB C 13 32.08 . . . . . . . . 23 K CB . 27571 1 30 . 1 1 23 23 LYS N N 15 124.795 . . . . . . . . 23 K N . 27571 1 31 . 1 1 24 24 ARG H H 1 8.321 . . . . . . . . 24 R H . 27571 1 32 . 1 1 24 24 ARG CA C 13 56.15 . . . . . . . . 24 R CA . 27571 1 33 . 1 1 24 24 ARG CB C 13 29.69 . . . . . . . . 24 R CB . 27571 1 34 . 1 1 24 24 ARG N N 15 121.722 . . . . . . . . 24 R N . 27571 1 35 . 1 1 26 26 THR C C 13 175.56 . . . . . . . . 26 T CO . 27571 1 36 . 1 1 26 26 THR CB C 13 68.97 . . . . . . . . 26 T CB . 27571 1 37 . 1 1 27 27 HIS H H 1 8.205 . . . . . . . . 27 H H . 27571 1 38 . 1 1 27 27 HIS C C 13 175.81 . . . . . . . . 27 H CO . 27571 1 39 . 1 1 27 27 HIS CA C 13 55.33 . . . . . . . . 27 H CA . 27571 1 40 . 1 1 27 27 HIS CB C 13 28.98 . . . . . . . . 27 H CB . 27571 1 41 . 1 1 27 27 HIS N N 15 122.535 . . . . . . . . 27 H N . 27571 1 42 . 1 1 28 28 ASN H H 1 8.107 . . . . . . . . 28 N H . 27571 1 43 . 1 1 28 28 ASN C C 13 174.9 . . . . . . . . 28 N CO . 27571 1 44 . 1 1 28 28 ASN CA C 13 53.74 . . . . . . . . 28 N CA . 27571 1 45 . 1 1 28 28 ASN CB C 13 37.63 . . . . . . . . 28 N CB . 27571 1 46 . 1 1 28 28 ASN N N 15 123.795 . . . . . . . . 28 N N . 27571 1 47 . 1 1 29 29 VAL H H 1 8.078 . . . . . . . . 29 V H . 27571 1 48 . 1 1 29 29 VAL C C 13 177.28 . . . . . . . . 29 V CO . 27571 1 49 . 1 1 29 29 VAL CA C 13 64 . . . . . . . . 29 V CA . 27571 1 50 . 1 1 29 29 VAL CB C 13 31.62 . . . . . . . . 29 V CB . 27571 1 51 . 1 1 29 29 VAL N N 15 121.195 . . . . . . . . 29 V N . 27571 1 52 . 1 1 30 30 LEU H H 1 8.071 . . . . . . . . 30 L H . 27571 1 53 . 1 1 30 30 LEU C C 13 178.76 . . . . . . . . 30 L CO . 27571 1 54 . 1 1 30 30 LEU CA C 13 56.29 . . . . . . . . 30 L CA . 27571 1 55 . 1 1 30 30 LEU CB C 13 40.99 . . . . . . . . 30 L CB . 27571 1 56 . 1 1 30 30 LEU N N 15 123.485 . . . . . . . . 30 L N . 27571 1 57 . 1 1 31 31 GLU H H 1 8.155 . . . . . . . . 31 E H . 27571 1 58 . 1 1 31 31 GLU C C 13 178.17 . . . . . . . . 31 E CO . 27571 1 59 . 1 1 31 31 GLU CA C 13 57.88 . . . . . . . . 31 E CA . 27571 1 60 . 1 1 31 31 GLU CB C 13 29.1 . . . . . . . . 31 E CB . 27571 1 61 . 1 1 31 31 GLU N N 15 120.835 . . . . . . . . 31 E N . 27571 1 62 . 1 1 32 32 ARG H H 1 8.05 . . . . . . . . 32 R H . 27571 1 63 . 1 1 32 32 ARG C C 13 177.863 . . . . . . . . 32 R CO . 27571 1 64 . 1 1 32 32 ARG CA C 13 57.89 . . . . . . . . 32 R CA . 27571 1 65 . 1 1 32 32 ARG CB C 13 29.41 . . . . . . . . 32 R CB . 27571 1 66 . 1 1 32 32 ARG N N 15 120.445 . . . . . . . . 32 R N . 27571 1 67 . 1 1 33 33 GLN H H 1 8.114 . . . . . . . . 33 Q H . 27571 1 68 . 1 1 33 33 GLN C C 13 177.93 . . . . . . . . 33 Q CO . 27571 1 69 . 1 1 33 33 GLN CA C 13 57.5 . . . . . . . . 33 Q CA . 27571 1 70 . 1 1 33 33 GLN CB C 13 29.14 . . . . . . . . 33 Q CB . 27571 1 71 . 1 1 33 33 GLN N N 15 119.955 . . . . . . . . 33 Q N . 27571 1 72 . 1 1 34 34 ARG H H 1 8.23 . . . . . . . . 34 R H . 27571 1 73 . 1 1 34 34 ARG CA C 13 57.97 . . . . . . . . 34 R CA . 27571 1 74 . 1 1 34 34 ARG CB C 13 29.64 . . . . . . . . 34 R CB . 27571 1 75 . 1 1 34 34 ARG N N 15 120.89 . . . . . . . . 34 R N . 27571 1 76 . 1 1 38 38 LEU C C 13 178.48 . . . . . . . . 38 L CO . 27571 1 77 . 1 1 38 38 LEU CA C 13 57.04 . . . . . . . . 38 L CA . 27571 1 78 . 1 1 38 38 LEU CB C 13 40.84 . . . . . . . . 38 L CB . 27571 1 79 . 1 1 39 39 LYS H H 1 7.775 . . . . . . . . 39 K H . 27571 1 80 . 1 1 39 39 LYS C C 13 178.101 . . . . . . . . 39 K CO . 27571 1 81 . 1 1 39 39 LYS CA C 13 60.164 . . . . . . . . 39 K CA . 27571 1 82 . 1 1 39 39 LYS CB C 13 31.495 . . . . . . . . 39 K CB . 27571 1 83 . 1 1 39 39 LYS N N 15 119.715 . . . . . . . . 39 K N . 27571 1 84 . 1 1 40 40 ARG H H 1 7.866 . . . . . . . . 40 R H . 27571 1 85 . 1 1 40 40 ARG C C 13 180.153 . . . . . . . . 40 R CO . 27571 1 86 . 1 1 40 40 ARG CA C 13 59.374 . . . . . . . . 40 R CA . 27571 1 87 . 1 1 40 40 ARG CB C 13 28.738 . . . . . . . . 40 R CB . 27571 1 88 . 1 1 40 40 ARG N N 15 117.282 . . . . . . . . 40 R N . 27571 1 89 . 1 1 41 41 SER H H 1 8.171 . . . . . . . . 41 S H . 27571 1 90 . 1 1 41 41 SER C C 13 177.473 . . . . . . . . 41 S CO . 27571 1 91 . 1 1 41 41 SER CA C 13 63.315 . . . . . . . . 41 S CA . 27571 1 92 . 1 1 41 41 SER CB C 13 62.538 . . . . . . . . 41 S CB . 27571 1 93 . 1 1 41 41 SER N N 15 118.019 . . . . . . . . 41 S N . 27571 1 94 . 1 1 42 42 PHE H H 1 8.605 . . . . . . . . 42 F H . 27571 1 95 . 1 1 42 42 PHE C C 13 178.9 . . . . . . . . 42 F CO . 27571 1 96 . 1 1 42 42 PHE CA C 13 63.487 . . . . . . . . 42 F CA . 27571 1 97 . 1 1 42 42 PHE CB C 13 38.81 . . . . . . . . 42 F CB . 27571 1 98 . 1 1 42 42 PHE N N 15 123.225 . . . . . . . . 42 F N . 27571 1 99 . 1 1 43 43 PHE H H 1 8.228 . . . . . . . . 43 F H . 27571 1 100 . 1 1 43 43 PHE C C 13 177.368 . . . . . . . . 43 F CO . 27571 1 101 . 1 1 43 43 PHE CA C 13 58.223 . . . . . . . . 43 F CA . 27571 1 102 . 1 1 43 43 PHE CB C 13 36.615 . . . . . . . . 43 F CB . 27571 1 103 . 1 1 43 43 PHE N N 15 118.585 . . . . . . . . 43 F N . 27571 1 104 . 1 1 44 44 ALA H H 1 8.04 . . . . . . . . 44 A H . 27571 1 105 . 1 1 44 44 ALA C C 13 180.009 . . . . . . . . 44 A CO . 27571 1 106 . 1 1 44 44 ALA CA C 13 54.672 . . . . . . . . 44 A CA . 27571 1 107 . 1 1 44 44 ALA CB C 13 17.612 . . . . . . . . 44 A CB . 27571 1 108 . 1 1 44 44 ALA N N 15 121.377 . . . . . . . . 44 A N . 27571 1 109 . 1 1 45 45 LEU H H 1 7.294 . . . . . . . . 45 L H . 27571 1 110 . 1 1 45 45 LEU C C 13 178.805 . . . . . . . . 45 L CO . 27571 1 111 . 1 1 45 45 LEU CA C 13 57.689 . . . . . . . . 45 L CA . 27571 1 112 . 1 1 45 45 LEU CB C 13 40.061 . . . . . . . . 45 L CB . 27571 1 113 . 1 1 45 45 LEU N N 15 119.082 . . . . . . . . 45 L N . 27571 1 114 . 1 1 46 46 ARG H H 1 8.204 . . . . . . . . 46 R H . 27571 1 115 . 1 1 46 46 ARG C C 13 177.745 . . . . . . . . 46 R CO . 27571 1 116 . 1 1 46 46 ARG CA C 13 59.441 . . . . . . . . 46 R CA . 27571 1 117 . 1 1 46 46 ARG CB C 13 29.188 . . . . . . . . 46 R CB . 27571 1 118 . 1 1 46 46 ARG N N 15 118.397 . . . . . . . . 46 R N . 27571 1 119 . 1 1 47 47 ASP H H 1 7.605 . . . . . . . . 47 D H . 27571 1 120 . 1 1 47 47 ASP C C 13 177.279 . . . . . . . . 47 D CO . 27571 1 121 . 1 1 47 47 ASP CA C 13 55.729 . . . . . . . . 47 D CA . 27571 1 122 . 1 1 47 47 ASP CB C 13 39.343 . . . . . . . . 47 D CB . 27571 1 123 . 1 1 47 47 ASP N N 15 113.031 . . . . . . . . 47 D N . 27571 1 124 . 1 1 48 48 GLN H H 1 7.824 . . . . . . . . 48 Q H . 27571 1 125 . 1 1 48 48 GLN C C 13 174.705 . . . . . . . . 48 Q CO . 27571 1 126 . 1 1 48 48 GLN CA C 13 54.443 . . . . . . . . 48 Q CA . 27571 1 127 . 1 1 48 48 GLN CB C 13 28.035 . . . . . . . . 48 Q CB . 27571 1 128 . 1 1 48 48 GLN N N 15 117.248 . . . . . . . . 48 Q N . 27571 1 129 . 1 1 49 49 ILE H H 1 7.54 . . . . . . . . 49 I H . 27571 1 130 . 1 1 49 49 ILE C C 13 174.966 . . . . . . . . 49 I CO . 27571 1 131 . 1 1 49 49 ILE CA C 13 56.747 . . . . . . . . 49 I CA . 27571 1 132 . 1 1 49 49 ILE CB C 13 36.966 . . . . . . . . 49 I CB . 27571 1 133 . 1 1 49 49 ILE N N 15 120.838 . . . . . . . . 49 I N . 27571 1 134 . 1 1 50 50 PRO C C 13 179.51 . . . . . . . . 50 P CO . 27571 1 135 . 1 1 50 50 PRO CA C 13 65.95 . . . . . . . . 50 P CA . 27571 1 136 . 1 1 50 50 PRO CB C 13 31.33 . . . . . . . . 50 P CB . 27571 1 137 . 1 1 51 51 GLU H H 1 8.73 . . . . . . . . 51 E H . 27571 1 138 . 1 1 51 51 GLU C C 13 177.124 . . . . . . . . 51 E CO . 27571 1 139 . 1 1 51 51 GLU CA C 13 58.346 . . . . . . . . 51 E CA . 27571 1 140 . 1 1 51 51 GLU CB C 13 29.287 . . . . . . . . 51 E CB . 27571 1 141 . 1 1 51 51 GLU N N 15 113.777 . . . . . . . . 51 E N . 27571 1 142 . 1 1 52 52 LEU H H 1 7.837 . . . . . . . . 52 L H . 27571 1 143 . 1 1 52 52 LEU C C 13 176.292 . . . . . . . . 52 L CO . 27571 1 144 . 1 1 52 52 LEU CA C 13 53.549 . . . . . . . . 52 L CA . 27571 1 145 . 1 1 52 52 LEU CB C 13 43.071 . . . . . . . . 52 L CB . 27571 1 146 . 1 1 52 52 LEU N N 15 116.825 . . . . . . . . 52 L N . 27571 1 147 . 1 1 53 53 GLU H H 1 7.335 . . . . . . . . 53 E H . 27571 1 148 . 1 1 53 53 GLU C C 13 177.568 . . . . . . . . 53 E CO . 27571 1 149 . 1 1 53 53 GLU CA C 13 58.118 . . . . . . . . 53 E CA . 27571 1 150 . 1 1 53 53 GLU CB C 13 28.682 . . . . . . . . 53 E CB . 27571 1 151 . 1 1 53 53 GLU N N 15 121.4 . . . . . . . . 53 E N . 27571 1 152 . 1 1 54 54 ASN H H 1 8.859 . . . . . . . . 54 N H . 27571 1 153 . 1 1 54 54 ASN C C 13 174.273 . . . . . . . . 54 N CO . 27571 1 154 . 1 1 54 54 ASN CA C 13 54.453 . . . . . . . . 54 N CA . 27571 1 155 . 1 1 54 54 ASN CB C 13 37.923 . . . . . . . . 54 N CB . 27571 1 156 . 1 1 54 54 ASN N N 15 117.458 . . . . . . . . 54 N N . 27571 1 157 . 1 1 55 55 ASN H H 1 7.895 . . . . . . . . 55 N H . 27571 1 158 . 1 1 55 55 ASN C C 13 175.682 . . . . . . . . 55 N CO . 27571 1 159 . 1 1 55 55 ASN CA C 13 52.054 . . . . . . . . 55 N CA . 27571 1 160 . 1 1 55 55 ASN CB C 13 37.051 . . . . . . . . 55 N CB . 27571 1 161 . 1 1 55 55 ASN N N 15 117.201 . . . . . . . . 55 N N . 27571 1 162 . 1 1 56 56 GLU H H 1 8.548 . . . . . . . . 56 E H . 27571 1 163 . 1 1 56 56 GLU C C 13 177.218 . . . . . . . . 56 E CO . 27571 1 164 . 1 1 56 56 GLU CA C 13 57.87 . . . . . . . . 56 E CA . 27571 1 165 . 1 1 56 56 GLU CB C 13 28.822 . . . . . . . . 56 E CB . 27571 1 166 . 1 1 56 56 GLU N N 15 124.332 . . . . . . . . 56 E N . 27571 1 167 . 1 1 57 57 LYS H H 1 7.931 . . . . . . . . 57 K H . 27571 1 168 . 1 1 57 57 LYS C C 13 176.802 . . . . . . . . 57 K CO . 27571 1 169 . 1 1 57 57 LYS CA C 13 55.053 . . . . . . . . 57 K CA . 27571 1 170 . 1 1 57 57 LYS CB C 13 31.354 . . . . . . . . 57 K CB . 27571 1 171 . 1 1 57 57 LYS N N 15 117.109 . . . . . . . . 57 K N . 27571 1 172 . 1 1 58 58 ALA H H 1 7.001 . . . . . . . . 58 A H . 27571 1 173 . 1 1 58 58 ALA C C 13 175.227 . . . . . . . . 58 A CO . 27571 1 174 . 1 1 58 58 ALA CA C 13 50.303 . . . . . . . . 58 A CA . 27571 1 175 . 1 1 58 58 ALA CB C 13 17.204 . . . . . . . . 58 A CB . 27571 1 176 . 1 1 58 58 ALA N N 15 124.783 . . . . . . . . 58 A N . 27571 1 177 . 1 1 60 60 LYS C C 13 178.846 . . . . . . . . 60 K CO . 27571 1 178 . 1 1 60 60 LYS CA C 13 60.44 . . . . . . . . 60 K CA . 27571 1 179 . 1 1 60 60 LYS CB C 13 31.664 . . . . . . . . 60 K CB . 27571 1 180 . 1 1 61 61 VAL H H 1 8.562 . . . . . . . . 61 V H . 27571 1 181 . 1 1 61 61 VAL C C 13 176.802 . . . . . . . . 61 V CO . 27571 1 182 . 1 1 61 61 VAL CA C 13 65.657 . . . . . . . . 61 V CA . 27571 1 183 . 1 1 61 61 VAL CB C 13 30.721 . . . . . . . . 61 V CB . 27571 1 184 . 1 1 61 61 VAL N N 15 114.732 . . . . . . . . 61 V N . 27571 1 185 . 1 1 62 62 VAL H H 1 6.53 . . . . . . . . 62 V H . 27571 1 186 . 1 1 62 62 VAL C C 13 177.879 . . . . . . . . 62 V CO . 27571 1 187 . 1 1 62 62 VAL CA C 13 65.629 . . . . . . . . 62 V CA . 27571 1 188 . 1 1 62 62 VAL CB C 13 30.974 . . . . . . . . 62 V CB . 27571 1 189 . 1 1 62 62 VAL N N 15 120.89 . . . . . . . . 62 V N . 27571 1 190 . 1 1 63 63 ILE H H 1 7.747 . . . . . . . . 63 I H . 27571 1 191 . 1 1 63 63 ILE C C 13 177.673 . . . . . . . . 63 I CO . 27571 1 192 . 1 1 63 63 ILE CA C 13 66.133 . . . . . . . . 63 I CA . 27571 1 193 . 1 1 63 63 ILE CB C 13 37.318 . . . . . . . . 63 I CB . 27571 1 194 . 1 1 63 63 ILE N N 15 119.889 . . . . . . . . 63 I N . 27571 1 195 . 1 1 64 64 LEU H H 1 7.811 . . . . . . . . 64 L H . 27571 1 196 . 1 1 64 64 LEU C C 13 180.214 . . . . . . . . 64 L CO . 27571 1 197 . 1 1 64 64 LEU CA C 13 58.232 . . . . . . . . 64 L CA . 27571 1 198 . 1 1 64 64 LEU CB C 13 41.791 . . . . . . . . 64 L CB . 27571 1 199 . 1 1 64 64 LEU N N 15 115.26 . . . . . . . . 64 L N . 27571 1 200 . 1 1 65 65 LYS H H 1 8.34 . . . . . . . . 65 K H . 27571 1 201 . 1 1 65 65 LYS C C 13 181.196 . . . . . . . . 65 K CO . 27571 1 202 . 1 1 65 65 LYS CA C 13 60.145 . . . . . . . . 65 K CA . 27571 1 203 . 1 1 65 65 LYS CB C 13 32.029 . . . . . . . . 65 K CB . 27571 1 204 . 1 1 65 65 LYS N N 15 120.379 . . . . . . . . 65 K N . 27571 1 205 . 1 1 66 66 LYS H H 1 9.091 . . . . . . . . 66 K H . 27571 1 206 . 1 1 66 66 LYS C C 13 180.258 . . . . . . . . 66 K CO . 27571 1 207 . 1 1 66 66 LYS CA C 13 58.384 . . . . . . . . 66 K CA . 27571 1 208 . 1 1 66 66 LYS CB C 13 30.848 . . . . . . . . 66 K CB . 27571 1 209 . 1 1 66 66 LYS N N 15 119.548 . . . . . . . . 66 K N . 27571 1 210 . 1 1 67 67 ALA H H 1 8.685 . . . . . . . . 67 A H . 27571 1 211 . 1 1 67 67 ALA C C 13 178.849 . . . . . . . . 67 A CO . 27571 1 212 . 1 1 67 67 ALA CA C 13 55.586 . . . . . . . . 67 A CA . 27571 1 213 . 1 1 67 67 ALA CB C 13 18.569 . . . . . . . . 67 A CB . 27571 1 214 . 1 1 67 67 ALA N N 15 123.578 . . . . . . . . 67 A N . 27571 1 215 . 1 1 68 68 THR H H 1 7.747 . . . . . . . . 68 T H . 27571 1 216 . 1 1 68 68 THR C C 13 182.117 . . . . . . . . 68 T CO . 27571 1 217 . 1 1 68 68 THR CA C 13 67.19 . . . . . . . . 68 T CA . 27571 1 218 . 1 1 68 68 THR CB C 13 68.234 . . . . . . . . 68 T CB . 27571 1 219 . 1 1 68 68 THR N N 15 115.222 . . . . . . . . 68 T N . 27571 1 220 . 1 1 69 69 ALA H H 1 7.589 . . . . . . . . 69 A H . 27571 1 221 . 1 1 69 69 ALA C C 13 177.191 . . . . . . . . 69 A CO . 27571 1 222 . 1 1 69 69 ALA CA C 13 54.805 . . . . . . . . 69 A CA . 27571 1 223 . 1 1 69 69 ALA CB C 13 17.668 . . . . . . . . 69 A CB . 27571 1 224 . 1 1 69 69 ALA N N 15 120.859 . . . . . . . . 69 A N . 27571 1 225 . 1 1 70 70 TYR H H 1 8.526 . . . . . . . . 70 Y H . 27571 1 226 . 1 1 70 70 TYR C C 13 178.467 . . . . . . . . 70 Y CO . 27571 1 227 . 1 1 70 70 TYR CA C 13 61.25 . . . . . . . . 70 Y CA . 27571 1 228 . 1 1 70 70 TYR CB C 13 38.415 . . . . . . . . 70 Y CB . 27571 1 229 . 1 1 70 70 TYR N N 15 121.12 . . . . . . . . 70 Y N . 27571 1 230 . 1 1 71 71 ILE H H 1 8.574 . . . . . . . . 71 I H . 27571 1 231 . 1 1 71 71 ILE C C 13 178.134 . . . . . . . . 71 I CO . 27571 1 232 . 1 1 71 71 ILE CA C 13 66.371 . . . . . . . . 71 I CA . 27571 1 233 . 1 1 71 71 ILE CB C 13 36.84 . . . . . . . . 71 I CB . 27571 1 234 . 1 1 71 71 ILE N N 15 121.984 . . . . . . . . 71 I N . 27571 1 235 . 1 1 72 72 LEU H H 1 7.929 . . . . . . . . 72 L H . 27571 1 236 . 1 1 72 72 LEU C C 13 181.44 . . . . . . . . 72 L CO . 27571 1 237 . 1 1 72 72 LEU CA C 13 58.032 . . . . . . . . 72 L CA . 27571 1 238 . 1 1 72 72 LEU CB C 13 40.223 . . . . . . . . 72 L CB . 27571 1 239 . 1 1 72 72 LEU N N 15 118.956 . . . . . . . . 72 L N . 27571 1 240 . 1 1 73 73 SER H H 1 8.07 . . . . . . . . 73 S H . 27571 1 241 . 1 1 73 73 SER C C 13 177.997 . . . . . . . . 73 S CO . 27571 1 242 . 1 1 73 73 SER CA C 13 61.745 . . . . . . . . 73 S CA . 27571 1 243 . 1 1 73 73 SER CB C 13 62.524 . . . . . . . . 73 S CB . 27571 1 244 . 1 1 73 73 SER N N 15 117.001 . . . . . . . . 73 S N . 27571 1 245 . 1 1 74 74 VAL H H 1 8.598 . . . . . . . . 74 V H . 27571 1 246 . 1 1 74 74 VAL C C 13 179.554 . . . . . . . . 74 V CO . 27571 1 247 . 1 1 74 74 VAL CA C 13 65.105 . . . . . . . . 74 V CA . 27571 1 248 . 1 1 74 74 VAL CB C 13 30.721 . . . . . . . . 74 V CB . 27571 1 249 . 1 1 74 74 VAL N N 15 121.074 . . . . . . . . 74 V N . 27571 1 250 . 1 1 75 75 GLN H H 1 8.072 . . . . . . . . 75 Q H . 27571 1 251 . 1 1 75 75 GLN C C 13 179.571 . . . . . . . . 75 Q CO . 27571 1 252 . 1 1 75 75 GLN CA C 13 58.984 . . . . . . . . 75 Q CA . 27571 1 253 . 1 1 75 75 GLN CB C 13 27.5 . . . . . . . . 75 Q CB . 27571 1 254 . 1 1 75 75 GLN N N 15 122.551 . . . . . . . . 75 Q N . 27571 1 255 . 1 1 76 76 ALA H H 1 7.915 . . . . . . . . 76 A H . 27571 1 256 . 1 1 76 76 ALA C C 13 181.429 . . . . . . . . 76 A CO . 27571 1 257 . 1 1 76 76 ALA CA C 13 54.843 . . . . . . . . 76 A CA . 27571 1 258 . 1 1 76 76 ALA CB C 13 17.007 . . . . . . . . 76 A CB . 27571 1 259 . 1 1 76 76 ALA N N 15 123.85 . . . . . . . . 76 A N . 27571 1 260 . 1 1 77 77 GLU H H 1 8.29 . . . . . . . . 77 E H . 27571 1 261 . 1 1 77 77 GLU C C 13 178.213 . . . . . . . . 77 E CO . 27571 1 262 . 1 1 77 77 GLU CA C 13 58.927 . . . . . . . . 77 E CA . 27571 1 263 . 1 1 77 77 GLU CB C 13 28.93 . . . . . . . . 77 E CB . 27571 1 264 . 1 1 77 77 GLU N N 15 121.225 . . . . . . . . 77 E N . 27571 1 265 . 1 1 78 78 GLU H H 1 8.011 . . . . . . . . 78 E H . 27571 1 266 . 1 1 78 78 GLU C C 13 178.522 . . . . . . . . 78 E CO . 27571 1 267 . 1 1 78 78 GLU CA C 13 59.841 . . . . . . . . 78 E CA . 27571 1 268 . 1 1 78 78 GLU CB C 13 28.436 . . . . . . . . 78 E CB . 27571 1 269 . 1 1 78 78 GLU N N 15 120.281 . . . . . . . . 78 E N . 27571 1 270 . 1 1 79 79 GLN H H 1 7.465 . . . . . . . . 79 Q H . 27571 1 271 . 1 1 79 79 GLN C C 13 179.288 . . . . . . . . 79 Q CO . 27571 1 272 . 1 1 79 79 GLN CA C 13 58.499 . . . . . . . . 79 Q CA . 27571 1 273 . 1 1 79 79 GLN CB C 13 27.5 . . . . . . . . 79 Q CB . 27571 1 274 . 1 1 79 79 GLN N N 15 114.896 . . . . . . . . 79 Q N . 27571 1 275 . 1 1 80 80 LYS H H 1 7.65 . . . . . . . . 80 K H . 27571 1 276 . 1 1 80 80 LYS C C 13 179.892 . . . . . . . . 80 K CO . 27571 1 277 . 1 1 80 80 LYS CA C 13 59.289 . . . . . . . . 80 K CA . 27571 1 278 . 1 1 80 80 LYS CB C 13 31.481 . . . . . . . . 80 K CB . 27571 1 279 . 1 1 80 80 LYS N N 15 121.081 . . . . . . . . 80 K N . 27571 1 280 . 1 1 81 81 LEU H H 1 8.338 . . . . . . . . 81 L H . 27571 1 281 . 1 1 81 81 LEU C C 13 179.338 . . . . . . . . 81 L CO . 27571 1 282 . 1 1 81 81 LEU CA C 13 57.651 . . . . . . . . 81 L CA . 27571 1 283 . 1 1 81 81 LEU CB C 13 39.927 . . . . . . . . 81 L CB . 27571 1 284 . 1 1 81 81 LEU N N 15 122.067 . . . . . . . . 81 L N . 27571 1 285 . 1 1 82 82 ILE H H 1 8.5 . . . . . . . . 82 I H . 27571 1 286 . 1 1 82 82 ILE C C 13 179.299 . . . . . . . . 82 I CO . 27571 1 287 . 1 1 82 82 ILE CA C 13 65.486 . . . . . . . . 82 I CA . 27571 1 288 . 1 1 82 82 ILE CB C 13 37.613 . . . . . . . . 82 I CB . 27571 1 289 . 1 1 82 82 ILE N N 15 120.183 . . . . . . . . 82 I N . 27571 1 290 . 1 1 83 83 SER H H 1 7.598 . . . . . . . . 83 S H . 27571 1 291 . 1 1 83 83 SER C C 13 176.986 . . . . . . . . 83 S CO . 27571 1 292 . 1 1 83 83 SER CA C 13 61.564 . . . . . . . . 83 S CA . 27571 1 293 . 1 1 83 83 SER CB C 13 62.58 . . . . . . . . 83 S CB . 27571 1 294 . 1 1 83 83 SER N N 15 114.564 . . . . . . . . 83 S N . 27571 1 295 . 1 1 84 84 GLU H H 1 7.999 . . . . . . . . 84 E H . 27571 1 296 . 1 1 84 84 GLU C C 13 178.94 . . . . . . . . 84 E CO . 27571 1 297 . 1 1 84 84 GLU CA C 13 59.441 . . . . . . . . 84 E CA . 27571 1 298 . 1 1 84 84 GLU CB C 13 28.977 . . . . . . . . 84 E CB . 27571 1 299 . 1 1 84 84 GLU N N 15 123.475 . . . . . . . . 84 E N . 27571 1 300 . 1 1 85 85 GLU H H 1 8.642 . . . . . . . . 85 E H . 27571 1 301 . 1 1 85 85 GLU C C 13 178.3 . . . . . . . . 85 E CO . 27571 1 302 . 1 1 85 85 GLU CA C 13 60.231 . . . . . . . . 85 E CA . 27571 1 303 . 1 1 85 85 GLU CB C 13 28.949 . . . . . . . . 85 E CB . 27571 1 304 . 1 1 85 85 GLU N N 15 120.292 . . . . . . . . 85 E N . 27571 1 305 . 1 1 86 86 ASP H H 1 8.099 . . . . . . . . 86 D H . 27571 1 306 . 1 1 86 86 ASP C C 13 179.11 . . . . . . . . 86 D CO . 27571 1 307 . 1 1 86 86 ASP CA C 13 57.67 . . . . . . . . 86 D CA . 27571 1 308 . 1 1 86 86 ASP CB C 13 41.059 . . . . . . . . 86 D CB . 27571 1 309 . 1 1 86 86 ASP N N 15 118.147 . . . . . . . . 86 D N . 27571 1 310 . 1 1 87 87 LEU H H 1 7.689 . . . . . . . . 87 L H . 27571 1 311 . 1 1 87 87 LEU C C 13 181.107 . . . . . . . . 87 L CO . 27571 1 312 . 1 1 87 87 LEU CA C 13 58.137 . . . . . . . . 87 L CA . 27571 1 313 . 1 1 87 87 LEU CB C 13 41.003 . . . . . . . . 87 L CB . 27571 1 314 . 1 1 87 87 LEU N N 15 119.584 . . . . . . . . 87 L N . 27571 1 315 . 1 1 88 88 LEU H H 1 8.259 . . . . . . . . 88 L H . 27571 1 316 . 1 1 88 88 LEU C C 13 180.475 . . . . . . . . 88 L CO . 27571 1 317 . 1 1 88 88 LEU CA C 13 57.67 . . . . . . . . 88 L CA . 27571 1 318 . 1 1 88 88 LEU CB C 13 42.53 . . . . . . . . 88 L CB . 27571 1 319 . 1 1 88 88 LEU N N 15 121.176 . . . . . . . . 88 L N . 27571 1 320 . 1 1 89 89 ARG H H 1 8.79 . . . . . . . . 89 R H . 27571 1 321 . 1 1 89 89 ARG C C 13 179.865 . . . . . . . . 89 R CO . 27571 1 322 . 1 1 89 89 ARG CA C 13 60.25 . . . . . . . . 89 R CA . 27571 1 323 . 1 1 89 89 ARG CB C 13 29.202 . . . . . . . . 89 R CB . 27571 1 324 . 1 1 89 89 ARG N N 15 121.798 . . . . . . . . 89 R N . 27571 1 325 . 1 1 90 90 LYS H H 1 8.097 . . . . . . . . 90 K H . 27571 1 326 . 1 1 90 90 LYS C C 13 179.881 . . . . . . . . 90 K CO . 27571 1 327 . 1 1 90 90 LYS CA C 13 59.47 . . . . . . . . 90 K CA . 27571 1 328 . 1 1 90 90 LYS CB C 13 31.5 . . . . . . . . 90 K CB . 27571 1 329 . 1 1 90 90 LYS N N 15 121.572 . . . . . . . . 90 K N . 27571 1 330 . 1 1 91 91 ARG H H 1 8.01 . . . . . . . . 91 R H . 27571 1 331 . 1 1 91 91 ARG C C 13 177.757 . . . . . . . . 91 R CO . 27571 1 332 . 1 1 91 91 ARG CA C 13 58.242 . . . . . . . . 91 R CA . 27571 1 333 . 1 1 91 91 ARG CB C 13 28.626 . . . . . . . . 91 R CB . 27571 1 334 . 1 1 91 91 ARG N N 15 121.362 . . . . . . . . 91 R N . 27571 1 335 . 1 1 92 92 ARG H H 1 8.228 . . . . . . . . 92 R H . 27571 1 336 . 1 1 92 92 ARG C C 13 178.772 . . . . . . . . 92 R CO . 27571 1 337 . 1 1 92 92 ARG CA C 13 60.184 . . . . . . . . 92 R CA . 27571 1 338 . 1 1 92 92 ARG CB C 13 29.202 . . . . . . . . 92 R CB . 27571 1 339 . 1 1 92 92 ARG N N 15 121.523 . . . . . . . . 92 R N . 27571 1 340 . 1 1 93 93 GLU H H 1 7.707 . . . . . . . . 93 E H . 27571 1 341 . 1 1 93 93 GLU C C 13 179.709 . . . . . . . . 93 E CO . 27571 1 342 . 1 1 93 93 GLU CA C 13 58.794 . . . . . . . . 93 E CA . 27571 1 343 . 1 1 93 93 GLU CB C 13 28.752 . . . . . . . . 93 E CB . 27571 1 344 . 1 1 93 93 GLU N N 15 116.762 . . . . . . . . 93 E N . 27571 1 345 . 1 1 94 94 GLN H H 1 7.876 . . . . . . . . 94 Q H . 27571 1 346 . 1 1 94 94 GLN C C 13 180.053 . . . . . . . . 94 Q CO . 27571 1 347 . 1 1 94 94 GLN CA C 13 58.794 . . . . . . . . 94 Q CA . 27571 1 348 . 1 1 94 94 GLN CB C 13 27.95 . . . . . . . . 94 Q CB . 27571 1 349 . 1 1 94 94 GLN N N 15 119.717 . . . . . . . . 94 Q N . 27571 1 350 . 1 1 95 95 LEU H H 1 8.544 . . . . . . . . 95 L H . 27571 1 351 . 1 1 95 95 LEU C C 13 179.021 . . . . . . . . 95 L CO . 27571 1 352 . 1 1 95 95 LEU CA C 13 57.889 . . . . . . . . 95 L CA . 27571 1 353 . 1 1 95 95 LEU CB C 13 42.663 . . . . . . . . 95 L CB . 27571 1 354 . 1 1 95 95 LEU N N 15 122.005 . . . . . . . . 95 L N . 27571 1 355 . 1 1 96 96 LYS H H 1 8.57 . . . . . . . . 96 K H . 27571 1 356 . 1 1 96 96 LYS C C 13 179.909 . . . . . . . . 96 K CO . 27571 1 357 . 1 1 96 96 LYS CA C 13 60.041 . . . . . . . . 96 K CA . 27571 1 358 . 1 1 96 96 LYS CB C 13 31.354 . . . . . . . . 96 K CB . 27571 1 359 . 1 1 96 96 LYS N N 15 118.649 . . . . . . . . 96 K N . 27571 1 360 . 1 1 97 97 HIS H H 1 8.032 . . . . . . . . 97 H H . 27571 1 361 . 1 1 97 97 HIS C C 13 177.962 . . . . . . . . 97 H CO . 27571 1 362 . 1 1 97 97 HIS CA C 13 59.117 . . . . . . . . 97 H CA . 27571 1 363 . 1 1 97 97 HIS CB C 13 29.23 . . . . . . . . 97 H CB . 27571 1 364 . 1 1 97 97 HIS N N 15 118.508 . . . . . . . . 97 H N . 27571 1 365 . 1 1 98 98 LYS H H 1 7.935 . . . . . . . . 98 K H . 27571 1 366 . 1 1 98 98 LYS C C 13 178.91 . . . . . . . . 98 K CO . 27571 1 367 . 1 1 98 98 LYS CA C 13 58.75 . . . . . . . . 98 K CA . 27571 1 368 . 1 1 98 98 LYS CB C 13 31.37 . . . . . . . . 98 K CB . 27571 1 369 . 1 1 98 98 LYS N N 15 120.515 . . . . . . . . 98 K N . 27571 1 370 . 1 1 99 99 LEU H H 1 8.104 . . . . . . . . 99 L H . 27571 1 371 . 1 1 99 99 LEU C C 13 178.949 . . . . . . . . 99 L CO . 27571 1 372 . 1 1 99 99 LEU CA C 13 57.709 . . . . . . . . 99 L CA . 27571 1 373 . 1 1 99 99 LEU CB C 13 41.045 . . . . . . . . 99 L CB . 27571 1 374 . 1 1 99 99 LEU N N 15 119.023 . . . . . . . . 99 L N . 27571 1 375 . 1 1 100 100 GLU H H 1 7.787 . . . . . . . . 100 E H . 27571 1 376 . 1 1 100 100 GLU C C 13 179.06 . . . . . . . . 100 E CO . 27571 1 377 . 1 1 100 100 GLU CA C 13 58.603 . . . . . . . . 100 E CA . 27571 1 378 . 1 1 100 100 GLU CB C 13 28.794 . . . . . . . . 100 E CB . 27571 1 379 . 1 1 100 100 GLU N N 15 118.054 . . . . . . . . 100 E N . 27571 1 380 . 1 1 101 101 GLN H H 1 7.775 . . . . . . . . 101 Q H . 27571 1 381 . 1 1 101 101 GLN C C 13 178.7 . . . . . . . . 101 Q CO . 27571 1 382 . 1 1 101 101 GLN CA C 13 57.651 . . . . . . . . 101 Q CA . 27571 1 383 . 1 1 101 101 GLN CB C 13 28.161 . . . . . . . . 101 Q CB . 27571 1 384 . 1 1 101 101 GLN N N 15 117.724 . . . . . . . . 101 Q N . 27571 1 385 . 1 1 102 102 LEU H H 1 7.944 . . . . . . . . 102 L H . 27571 1 386 . 1 1 102 102 LEU C C 13 179.055 . . . . . . . . 102 L CO . 27571 1 387 . 1 1 102 102 LEU CA C 13 56.404 . . . . . . . . 102 L CA . 27571 1 388 . 1 1 102 102 LEU CB C 13 41.777 . . . . . . . . 102 L CB . 27571 1 389 . 1 1 102 102 LEU N N 15 119.733 . . . . . . . . 102 L N . 27571 1 390 . 1 1 103 103 ARG H H 1 7.919 . . . . . . . . 103 R H . 27571 1 391 . 1 1 103 103 ARG C C 13 176.78 . . . . . . . . 103 R CO . 27571 1 392 . 1 1 103 103 ARG CA C 13 57.175 . . . . . . . . 103 R CA . 27571 1 393 . 1 1 103 103 ARG CB C 13 29.962 . . . . . . . . 103 R CB . 27571 1 394 . 1 1 103 103 ARG N N 15 118.843 . . . . . . . . 103 R N . 27571 1 395 . 1 1 104 104 ASN H H 1 7.862 . . . . . . . . 104 N H . 27571 1 396 . 1 1 104 104 ASN C C 13 174.545 . . . . . . . . 104 N CO . 27571 1 397 . 1 1 104 104 ASN CA C 13 53.168 . . . . . . . . 104 N CA . 27571 1 398 . 1 1 104 104 ASN CB C 13 38.936 . . . . . . . . 104 N CB . 27571 1 399 . 1 1 104 104 ASN N N 15 118.607 . . . . . . . . 104 N N . 27571 1 400 . 1 1 105 105 SER H H 1 7.646 . . . . . . . . 105 S H . 27571 1 401 . 1 1 105 105 SER CA C 13 60.203 . . . . . . . . 105 S CA . 27571 1 402 . 1 1 105 105 SER CB C 13 64.844 . . . . . . . . 105 S CB . 27571 1 403 . 1 1 105 105 SER N N 15 121.36 . . . . . . . . 105 S N . 27571 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 27571 _Assigned_chem_shift_list.ID 2 _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 $chemical_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' . . . 27571 2 2 '3D 1H-15N NOESY' . . . 27571 2 3 '3D CBCA(CO)NH' . . . 27571 2 4 '3D HNCACB' . . . 27571 2 5 '3D HNCO' . . . 27571 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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 ASP H H 1 7.955 . . . . . . . . 2 D H . 27571 2 2 . 2 2 2 2 ASP CA C 13 54.93 . . . . . . . . 2 D CA . 27571 2 3 . 2 2 2 2 ASP CB C 13 41.16 . . . . . . . . 2 D CB . 27571 2 4 . 2 2 2 2 ASP N N 15 120.82 . . . . . . . . 2 D N . 27571 2 5 . 2 2 3 3 LYS H H 1 8.13 . . . . . . . . 3 K H . 27571 2 6 . 2 2 3 3 LYS C C 13 177.107 . . . . . . . . 3 K CO . 27571 2 7 . 2 2 3 3 LYS CA C 13 56.899 . . . . . . . . 3 K CA . 27571 2 8 . 2 2 3 3 LYS CB C 13 31.973 . . . . . . . . 3 K CB . 27571 2 9 . 2 2 3 3 LYS N N 15 121.78 . . . . . . . . 3 K N . 27571 2 10 . 2 2 4 4 ARG H H 1 8.314 . . . . . . . . 4 R H . 27571 2 11 . 2 2 4 4 ARG C C 13 176.59 . . . . . . . . 4 R CO . 27571 2 12 . 2 2 4 4 ARG CA C 13 56.16 . . . . . . . . 4 R CA . 27571 2 13 . 2 2 4 4 ARG CB C 13 29.75 . . . . . . . . 4 R CB . 27571 2 14 . 2 2 4 4 ARG N N 15 121.819 . . . . . . . . 4 R N . 27571 2 15 . 2 2 5 5 ALA H H 1 8.139 . . . . . . . . 5 A H . 27571 2 16 . 2 2 5 5 ALA C C 13 178.029 . . . . . . . . 5 A CO . 27571 2 17 . 2 2 5 5 ALA CA C 13 52.56 . . . . . . . . 5 A CA . 27571 2 18 . 2 2 5 5 ALA CB C 13 18.48 . . . . . . . . 5 A CB . 27571 2 19 . 2 2 5 5 ALA N N 15 124.475 . . . . . . . . 5 A N . 27571 2 20 . 2 2 8 8 ASN C C 13 175.78 . . . . . . . . 8 N CO . 27571 2 21 . 2 2 8 8 ASN CA C 13 54.13 . . . . . . . . 8 N CA . 27571 2 22 . 2 2 8 8 ASN CB C 13 38.36 . . . . . . . . 8 N CB . 27571 2 23 . 2 2 9 9 ALA H H 1 8.225 . . . . . . . . 9 A H . 27571 2 24 . 2 2 9 9 ALA C C 13 178.8 . . . . . . . . 9 A CO . 27571 2 25 . 2 2 9 9 ALA CA C 13 53.491 . . . . . . . . 9 A CA . 27571 2 26 . 2 2 9 9 ALA CB C 13 18.31 . . . . . . . . 9 A CB . 27571 2 27 . 2 2 9 9 ALA N N 15 124.26 . . . . . . . . 9 A N . 27571 2 28 . 2 2 10 10 LEU H H 1 7.995 . . . . . . . . 10 L H . 27571 2 29 . 2 2 10 10 LEU C C 13 178.52 . . . . . . . . 10 L CO . 27571 2 30 . 2 2 10 10 LEU CA C 13 55.976 . . . . . . . . 10 L CA . 27571 2 31 . 2 2 10 10 LEU CB C 13 41.09 . . . . . . . . 10 L CB . 27571 2 32 . 2 2 10 10 LEU N N 15 119.985 . . . . . . . . 10 L N . 27571 2 33 . 2 2 11 11 GLU H H 1 8.055 . . . . . . . . 11 E H . 27571 2 34 . 2 2 11 11 GLU C C 13 177.46 . . . . . . . . 11 E CO . 27571 2 35 . 2 2 11 11 GLU CA C 13 57.11 . . . . . . . . 11 E CA . 27571 2 36 . 2 2 11 11 GLU CB C 13 29.3 . . . . . . . . 11 E CB . 27571 2 37 . 2 2 11 11 GLU N N 15 120.975 . . . . . . . . 11 E N . 27571 2 38 . 2 2 12 12 ARG H H 1 8.09 . . . . . . . . 12 R H . 27571 2 39 . 2 2 12 12 ARG C C 13 178.21 . . . . . . . . 12 R CO . 27571 2 40 . 2 2 12 12 ARG CA C 13 57.00 . . . . . . . . 12 R CA . 27571 2 41 . 2 2 12 12 ARG CB C 13 29.75 . . . . . . . . 12 R CB . 27571 2 42 . 2 2 12 12 ARG N N 15 121.48 . . . . . . . . 12 R N . 27571 2 43 . 2 2 13 13 LYS H H 1 8.05 . . . . . . . . 13 K H . 27571 2 44 . 2 2 13 13 LYS C C 13 177.546 . . . . . . . . 13 K CO . 27571 2 45 . 2 2 13 13 LYS CA C 13 56.91 . . . . . . . . 13 K CA . 27571 2 46 . 2 2 13 13 LYS CB C 13 31.90 . . . . . . . . 13 K CB . 27571 2 47 . 2 2 13 13 LYS N N 15 121.26 . . . . . . . . 13 K N . 27571 2 48 . 2 2 14 14 ARG H H 1 8.144 . . . . . . . . 14 R H . 27571 2 49 . 2 2 14 14 ARG C C 13 177.33 . . . . . . . . 14 R CO . 27571 2 50 . 2 2 14 14 ARG CA C 13 56.90 . . . . . . . . 14 R CA . 27571 2 51 . 2 2 14 14 ARG CB C 13 29.88 . . . . . . . . 14 R CB . 27571 2 52 . 2 2 14 14 ARG N N 15 121.75 . . . . . . . . 14 R N . 27571 2 53 . 2 2 18 18 ILE C C 13 177.38 . . . . . . . . 18 I CO . 27571 2 54 . 2 2 18 18 ILE CA C 13 64.91 . . . . . . . . 18 I CA . 27571 2 55 . 2 2 18 18 ILE CB C 13 36.68 . . . . . . . . 18 I CB . 27571 2 56 . 2 2 19 19 LYS H H 1 8.06 . . . . . . . . 19 K H . 27571 2 57 . 2 2 19 19 LYS C C 13 178.837 . . . . . . . . 19 K CO . 27571 2 58 . 2 2 19 19 LYS CA C 13 59.84 . . . . . . . . 19 K CA . 27571 2 59 . 2 2 19 19 LYS CB C 13 31.48 . . . . . . . . 19 K CB . 27571 2 60 . 2 2 19 19 LYS N N 15 123.38 . . . . . . . . 19 K N . 27571 2 61 . 2 2 20 20 ASP H H 1 8.297 . . . . . . . . 20 D H . 27571 2 62 . 2 2 20 20 ASP C C 13 179.50 . . . . . . . . 20 D CO . 27571 2 63 . 2 2 20 20 ASP CA C 13 57.023 . . . . . . . . 20 D CA . 27571 2 64 . 2 2 20 20 ASP CB C 13 40.005 . . . . . . . . 20 D CB . 27571 2 65 . 2 2 20 20 ASP N N 15 118.503 . . . . . . . . 20 D N . 27571 2 66 . 2 2 21 21 SER H H 1 8.15 . . . . . . . . 21 S H . 27571 2 67 . 2 2 21 21 SER C C 13 177.64 . . . . . . . . 21 S CO . 27571 2 68 . 2 2 21 21 SER CA C 13 62.26 . . . . . . . . 21 S CA . 27571 2 69 . 2 2 21 21 SER CB C 13 62.79 . . . . . . . . 21 S CB . 27571 2 70 . 2 2 21 21 SER N N 15 114.55 . . . . . . . . 21 S N . 27571 2 71 . 2 2 22 22 PHE H H 1 8.645 . . . . . . . . 22 F H . 27571 2 72 . 2 2 22 22 PHE C C 13 178.777 . . . . . . . . 22 F CO . 27571 2 73 . 2 2 22 22 PHE CA C 13 63.687 . . . . . . . . 22 F CA . 27571 2 74 . 2 2 22 22 PHE CB C 13 38.654 . . . . . . . . 22 F CB . 27571 2 75 . 2 2 22 22 PHE N N 15 124.1 . . . . . . . . 22 F N . 27571 2 76 . 2 2 23 23 HIS H H 1 8.182 . . . . . . . . 23 H H . 27571 2 77 . 2 2 23 23 HIS C C 13 177.451 . . . . . . . . 23 H CO . 27571 2 78 . 2 2 23 23 HIS CA C 13 58.775 . . . . . . . . 23 H CA . 27571 2 79 . 2 2 23 23 HIS CB C 13 29.16 . . . . . . . . 23 H CB . 27571 2 80 . 2 2 23 23 HIS N N 15 119.234 . . . . . . . . 23 H N . 27571 2 81 . 2 2 24 24 SER H H 1 8.148 . . . . . . . . 24 S H . 27571 2 82 . 2 2 24 24 SER C C 13 176.613 . . . . . . . . 24 S CO . 27571 2 83 . 2 2 24 24 SER CA C 13 61.821 . . . . . . . . 24 S CA . 27571 2 84 . 2 2 24 24 SER CB C 13 62.538 . . . . . . . . 24 S CB . 27571 2 85 . 2 2 24 24 SER N N 15 114.556 . . . . . . . . 24 S N . 27571 2 86 . 2 2 25 25 LEU H H 1 7.482 . . . . . . . . 25 L H . 27571 2 87 . 2 2 25 25 LEU C C 13 179.099 . . . . . . . . 25 L CO . 27571 2 88 . 2 2 25 25 LEU CA C 13 57.842 . . . . . . . . 25 L CA . 27571 2 89 . 2 2 25 25 LEU CB C 13 40.201 . . . . . . . . 25 L CB . 27571 2 90 . 2 2 25 25 LEU N N 15 122.969 . . . . . . . . 25 L N . 27571 2 91 . 2 2 26 26 ARG H H 1 8.398 . . . . . . . . 26 R H . 27571 2 92 . 2 2 26 26 ARG C C 13 177.851 . . . . . . . . 26 R CO . 27571 2 93 . 2 2 26 26 ARG CA C 13 59.26 . . . . . . . . 26 R CA . 27571 2 94 . 2 2 26 26 ARG CB C 13 28.935 . . . . . . . . 26 R CB . 27571 2 95 . 2 2 26 26 ARG N N 15 119.937 . . . . . . . . 26 R N . 27571 2 96 . 2 2 27 27 ASP H H 1 7.901 . . . . . . . . 27 D H . 27571 2 97 . 2 2 27 27 ASP C C 13 177.107 . . . . . . . . 27 D CO . 27571 2 98 . 2 2 27 27 ASP CA C 13 55.871 . . . . . . . . 27 D CA . 27571 2 99 . 2 2 27 27 ASP CB C 13 39.695 . . . . . . . . 27 D CB . 27571 2 100 . 2 2 27 27 ASP N N 15 114.165 . . . . . . . . 27 D N . 27571 2 101 . 2 2 28 28 SER H H 1 7.774 . . . . . . . . 28 S H . 27571 2 102 . 2 2 28 28 SER C C 13 172.995 . . . . . . . . 28 S CO . 27571 2 103 . 2 2 28 28 SER CA C 13 59.66 . . . . . . . . 28 S CA . 27571 2 104 . 2 2 28 28 SER CB C 13 63.916 . . . . . . . . 28 S CB . 27571 2 105 . 2 2 28 28 SER N N 15 115.503 . . . . . . . . 28 S N . 27571 2 106 . 2 2 29 29 VAL H H 1 7.099 . . . . . . . . 29 V H . 27571 2 107 . 2 2 29 29 VAL C C 13 175.549 . . . . . . . . 29 V CO . 27571 2 108 . 2 2 29 29 VAL CA C 13 59.346 . . . . . . . . 29 V CA . 27571 2 109 . 2 2 29 29 VAL CB C 13 31.917 . . . . . . . . 29 V CB . 27571 2 110 . 2 2 29 29 VAL N N 15 122.909 . . . . . . . . 29 V N . 27571 2 111 . 2 2 31 31 SER C C 13 175.26 . . . . . . . . 31 S CO . 27571 2 112 . 2 2 31 31 SER CA C 13 59.38 . . . . . . . . 31 S CA . 27571 2 113 . 2 2 31 31 SER CB C 13 68.28 . . . . . . . . 31 S CB . 27571 2 114 . 2 2 32 32 LEU H H 1 7.575 . . . . . . . . 32 L H . 27571 2 115 . 2 2 32 32 LEU C C 13 177.2 . . . . . . . . 32 L CO . 27571 2 116 . 2 2 32 32 LEU CA C 13 54.09 . . . . . . . . 32 L CA . 27571 2 117 . 2 2 32 32 LEU CB C 13 42.48 . . . . . . . . 32 L CB . 27571 2 118 . 2 2 32 32 LEU N N 15 120.585 . . . . . . . . 32 L N . 27571 2 119 . 2 2 33 33 GLN H H 1 7.335 . . . . . . . . 33 Q H . 27571 2 120 . 2 2 33 33 GLN C C 13 177.64 . . . . . . . . 33 Q CO . 27571 2 121 . 2 2 33 33 GLN CA C 13 57.36 . . . . . . . . 33 Q CA . 27571 2 122 . 2 2 33 33 GLN CB C 13 27.57 . . . . . . . . 33 Q CB . 27571 2 123 . 2 2 33 33 GLN N N 15 120.015 . . . . . . . . 33 Q N . 27571 2 124 . 2 2 34 34 GLY H H 1 8.695 . . . . . . . . 34 G H . 27571 2 125 . 2 2 34 34 GLY C C 13 174.242 . . . . . . . . 34 G CO . 27571 2 126 . 2 2 34 34 GLY CA C 13 45.46 . . . . . . . . 34 G CA . 27571 2 127 . 2 2 34 34 GLY N N 15 112.505 . . . . . . . . 34 G N . 27571 2 128 . 2 2 35 35 GLU H H 1 7.767 . . . . . . . . 35 E H . 27571 2 129 . 2 2 35 35 GLU C C 13 176.808 . . . . . . . . 35 E CO . 27571 2 130 . 2 2 35 35 GLU CA C 13 55.053 . . . . . . . . 35 E CA . 27571 2 131 . 2 2 35 35 GLU CB C 13 30.64 . . . . . . . . 35 E CB . 27571 2 132 . 2 2 35 35 GLU N N 15 119.624 . . . . . . . . 35 E N . 27571 2 133 . 2 2 36 36 LYS H H 1 8.515 . . . . . . . . 36 K H . 27571 2 134 . 2 2 36 36 LYS C C 13 176.009 . . . . . . . . 36 K CO . 27571 2 135 . 2 2 36 36 LYS CA C 13 55.643 . . . . . . . . 36 K CA . 27571 2 136 . 2 2 36 36 LYS CB C 13 30.623 . . . . . . . . 36 K CB . 27571 2 137 . 2 2 36 36 LYS N N 15 123.651 . . . . . . . . 36 K N . 27571 2 138 . 2 2 37 37 ALA H H 1 7.688 . . . . . . . . 37 A H . 27571 2 139 . 2 2 37 37 ALA C C 13 176.985 . . . . . . . . 37 A CO . 27571 2 140 . 2 2 37 37 ALA CA C 13 51.093 . . . . . . . . 37 A CA . 27571 2 141 . 2 2 37 37 ALA CB C 13 21.058 . . . . . . . . 37 A CB . 27571 2 142 . 2 2 37 37 ALA N N 15 125.4 . . . . . . . . 37 A N . 27571 2 143 . 2 2 38 38 SER H H 1 8.567 . . . . . . . . 38 S H . 27571 2 144 . 2 2 38 38 SER C C 13 174.511 . . . . . . . . 38 S CO . 27571 2 145 . 2 2 38 38 SER CA C 13 56.623 . . . . . . . . 38 S CA . 27571 2 146 . 2 2 38 38 SER CB C 13 64.591 . . . . . . . . 38 S CB . 27571 2 147 . 2 2 38 38 SER N N 15 118.481 . . . . . . . . 38 S N . 27571 2 148 . 2 2 39 39 ARG H H 1 8.595 . . . . . . . . 39 R H . 27571 2 149 . 2 2 39 39 ARG C C 13 177.968 . . . . . . . . 39 R CO . 27571 2 150 . 2 2 39 39 ARG CA C 13 60.602 . . . . . . . . 39 R CA . 27571 2 151 . 2 2 39 39 ARG CB C 13 29.251 . . . . . . . . 39 R CB . 27571 2 152 . 2 2 39 39 ARG N N 15 119.949 . . . . . . . . 39 R N . 27571 2 153 . 2 2 40 40 ALA H H 1 8.241 . . . . . . . . 40 A H . 27571 2 154 . 2 2 40 40 ALA C C 13 178.994 . . . . . . . . 40 A CO . 27571 2 155 . 2 2 40 40 ALA CA C 13 55.405 . . . . . . . . 40 A CA . 27571 2 156 . 2 2 40 40 ALA CB C 13 17.528 . . . . . . . . 40 A CB . 27571 2 157 . 2 2 40 40 ALA N N 15 119.038 . . . . . . . . 40 A N . 27571 2 158 . 2 2 41 41 GLN H H 1 7.32 . . . . . . . . 41 Q H . 27571 2 159 . 2 2 41 41 GLN C C 13 179.077 . . . . . . . . 41 Q CO . 27571 2 160 . 2 2 41 41 GLN CA C 13 58.499 . . . . . . . . 41 Q CA . 27571 2 161 . 2 2 41 41 GLN CB C 13 28.415 . . . . . . . . 41 Q CB . 27571 2 162 . 2 2 41 41 GLN N N 15 115.856 . . . . . . . . 41 Q N . 27571 2 163 . 2 2 42 42 ILE H H 1 8.268 . . . . . . . . 42 I H . 27571 2 164 . 2 2 42 42 ILE C C 13 177.546 . . . . . . . . 42 I CO . 27571 2 165 . 2 2 42 42 ILE CA C 13 65.41 . . . . . . . . 42 I CA . 27571 2 166 . 2 2 42 42 ILE CB C 13 37.388 . . . . . . . . 42 I CB . 27571 2 167 . 2 2 42 42 ILE N N 15 119.596 . . . . . . . . 42 I N . 27571 2 168 . 2 2 43 43 LEU H H 1 7.679 . . . . . . . . 43 L H . 27571 2 169 . 2 2 43 43 LEU C C 13 179.437 . . . . . . . . 43 L CO . 27571 2 170 . 2 2 43 43 LEU CA C 13 57.975 . . . . . . . . 43 L CA . 27571 2 171 . 2 2 43 43 LEU CB C 13 41.088 . . . . . . . . 43 L CB . 27571 2 172 . 2 2 43 43 LEU N N 15 116.441 . . . . . . . . 43 L N . 27571 2 173 . 2 2 44 44 ASP H H 1 8.584 . . . . . . . . 44 D H . 27571 2 174 . 2 2 44 44 ASP C C 13 180.22 . . . . . . . . 44 D CO . 27571 2 175 . 2 2 44 44 ASP CA C 13 57.366 . . . . . . . . 44 D CA . 27571 2 176 . 2 2 44 44 ASP CB C 13 39.4 . . . . . . . . 44 D CB . 27571 2 177 . 2 2 44 44 ASP N N 15 119.823 . . . . . . . . 44 D N . 27571 2 178 . 2 2 45 45 LYS H H 1 8.768 . . . . . . . . 45 K H . 27571 2 179 . 2 2 45 45 LYS C C 13 180.514 . . . . . . . . 45 K CO . 27571 2 180 . 2 2 45 45 LYS CA C 13 57.899 . . . . . . . . 45 K CA . 27571 2 181 . 2 2 45 45 LYS CB C 13 30.173 . . . . . . . . 45 K CB . 27571 2 182 . 2 2 45 45 LYS N N 15 119.864 . . . . . . . . 45 K N . 27571 2 183 . 2 2 46 46 ALA H H 1 8.457 . . . . . . . . 46 A H . 27571 2 184 . 2 2 46 46 ALA C C 13 178.844 . . . . . . . . 46 A CO . 27571 2 185 . 2 2 46 46 ALA CA C 13 55.928 . . . . . . . . 46 A CA . 27571 2 186 . 2 2 46 46 ALA CB C 13 17.781 . . . . . . . . 46 A CB . 27571 2 187 . 2 2 46 46 ALA N N 15 124.593 . . . . . . . . 46 A N . 27571 2 188 . 2 2 47 47 THR H H 1 8.4 . . . . . . . . 47 T H . 27571 2 189 . 2 2 47 47 THR C C 13 176.561 . . . . . . . . 47 T CO . 27571 2 190 . 2 2 47 47 THR CA C 13 67.75 . . . . . . . . 47 T CA . 27571 2 191 . 2 2 47 47 THR N N 15 117.614 . . . . . . . . 47 T N . 27571 2 192 . 2 2 48 48 GLU H H 1 7.826 . . . . . . . . 48 E H . 27571 2 193 . 2 2 48 48 GLU C C 13 179.16 . . . . . . . . 48 E CO . 27571 2 194 . 2 2 48 48 GLU CA C 13 59.003 . . . . . . . . 48 E CA . 27571 2 195 . 2 2 48 48 GLU CB C 13 29.92 . . . . . . . . 48 E CB . 27571 2 196 . 2 2 48 48 GLU N N 15 119.887 . . . . . . . . 48 E N . 27571 2 197 . 2 2 49 49 TYR H H 1 8.422 . . . . . . . . 49 Y H . 27571 2 198 . 2 2 49 49 TYR C C 13 177.684 . . . . . . . . 49 Y CO . 27571 2 199 . 2 2 49 49 TYR CA C 13 61.107 . . . . . . . . 49 Y CA . 27571 2 200 . 2 2 49 49 TYR CB C 13 38.542 . . . . . . . . 49 Y CB . 27571 2 201 . 2 2 49 49 TYR N N 15 121.717 . . . . . . . . 49 Y N . 27571 2 202 . 2 2 50 50 ILE H H 1 8.592 . . . . . . . . 50 I H . 27571 2 203 . 2 2 50 50 ILE C C 13 178.045 . . . . . . . . 50 I CO . 27571 2 204 . 2 2 50 50 ILE CA C 13 66.952 . . . . . . . . 50 I CA . 27571 2 205 . 2 2 50 50 ILE CB C 13 37.494 . . . . . . . . 50 I CB . 27571 2 206 . 2 2 50 50 ILE N N 15 119.976 . . . . . . . . 50 I N . 27571 2 207 . 2 2 51 51 GLN H H 1 7.837 . . . . . . . . 51 Q H . 27571 2 208 . 2 2 51 51 GLN C C 13 179.193 . . . . . . . . 51 Q CO . 27571 2 209 . 2 2 51 51 GLN CA C 13 59.641 . . . . . . . . 51 Q CA . 27571 2 210 . 2 2 51 51 GLN CB C 13 28.499 . . . . . . . . 51 Q CB . 27571 2 211 . 2 2 51 51 GLN N N 15 117.536 . . . . . . . . 51 Q N . 27571 2 212 . 2 2 52 52 TYR H H 1 8.229 . . . . . . . . 52 Y H . 27571 2 213 . 2 2 52 52 TYR C C 13 177.951 . . . . . . . . 52 Y CO . 27571 2 214 . 2 2 52 52 TYR CA C 13 60.526 . . . . . . . . 52 Y CA . 27571 2 215 . 2 2 52 52 TYR CB C 13 37.613 . . . . . . . . 52 Y CB . 27571 2 216 . 2 2 52 52 TYR N N 15 121.228 . . . . . . . . 52 Y N . 27571 2 217 . 2 2 53 53 MET H H 1 8.641 . . . . . . . . 53 M H . 27571 2 218 . 2 2 53 53 MET C C 13 179.243 . . . . . . . . 53 M CO . 27571 2 219 . 2 2 53 53 MET CA C 13 55.338 . . . . . . . . 53 M CA . 27571 2 220 . 2 2 53 53 MET CB C 13 29.849 . . . . . . . . 53 M CB . 27571 2 221 . 2 2 53 53 MET N N 15 119.734 . . . . . . . . 53 M N . 27571 2 222 . 2 2 54 54 ARG H H 1 8.617 . . . . . . . . 54 R H . 27571 2 223 . 2 2 54 54 ARG C C 13 180.464 . . . . . . . . 54 R CO . 27571 2 224 . 2 2 54 54 ARG CA C 13 59.803 . . . . . . . . 54 R CA . 27571 2 225 . 2 2 54 54 ARG CB C 13 29.385 . . . . . . . . 54 R CB . 27571 2 226 . 2 2 54 54 ARG N N 15 119.784 . . . . . . . . 54 R N . 27571 2 227 . 2 2 55 55 ARG H H 1 7.427 . . . . . . . . 55 R H . 27571 2 228 . 2 2 55 55 ARG C C 13 179.071 . . . . . . . . 55 R CO . 27571 2 229 . 2 2 55 55 ARG CA C 13 59.003 . . . . . . . . 55 R CA . 27571 2 230 . 2 2 55 55 ARG CB C 13 29.174 . . . . . . . . 55 R CB . 27571 2 231 . 2 2 55 55 ARG N N 15 119.262 . . . . . . . . 55 R N . 27571 2 232 . 2 2 56 56 LYS H H 1 8.441 . . . . . . . . 56 K H . 27571 2 233 . 2 2 56 56 LYS C C 13 179.332 . . . . . . . . 56 K CO . 27571 2 234 . 2 2 56 56 LYS CA C 13 59.489 . . . . . . . . 56 K CA . 27571 2 235 . 2 2 56 56 LYS CB C 13 31.959 . . . . . . . . 56 K CB . 27571 2 236 . 2 2 56 56 LYS N N 15 123.456 . . . . . . . . 56 K N . 27571 2 237 . 2 2 57 57 ASN H H 1 8.742 . . . . . . . . 57 N H . 27571 2 238 . 2 2 57 57 ASN C C 13 178.888 . . . . . . . . 57 N CO . 27571 2 239 . 2 2 57 57 ASN CA C 13 55.624 . . . . . . . . 57 N CA . 27571 2 240 . 2 2 57 57 ASN CB C 13 36.122 . . . . . . . . 57 N CB . 27571 2 241 . 2 2 57 57 ASN N N 15 119.017 . . . . . . . . 57 N N . 27571 2 242 . 2 2 58 58 HIS H H 1 7.82 . . . . . . . . 58 H H . 27571 2 243 . 2 2 58 58 HIS C C 13 178.3 . . . . . . . . 58 H CO . 27571 2 244 . 2 2 58 58 HIS CA C 13 59.907 . . . . . . . . 58 H CA . 27571 2 245 . 2 2 58 58 HIS CB C 13 29.427 . . . . . . . . 58 H CB . 27571 2 246 . 2 2 58 58 HIS N N 15 121.873 . . . . . . . . 58 H N . 27571 2 247 . 2 2 59 59 THR H H 1 8.178 . . . . . . . . 59 T H . 27571 2 248 . 2 2 59 59 THR C C 13 176.552 . . . . . . . . 59 T CO . 27571 2 249 . 2 2 59 59 THR CA C 13 66.647 . . . . . . . . 59 T CA . 27571 2 250 . 2 2 59 59 THR CB C 13 68.02 . . . . . . . . 59 T CB . 27571 2 251 . 2 2 59 59 THR N N 15 117.623 . . . . . . . . 59 T N . 27571 2 252 . 2 2 60 60 HIS H H 1 8.413 . . . . . . . . 60 H H . 27571 2 253 . 2 2 60 60 HIS C C 13 177.923 . . . . . . . . 60 H CO . 27571 2 254 . 2 2 60 60 HIS CA C 13 58.613 . . . . . . . . 60 H CA . 27571 2 255 . 2 2 60 60 HIS CB C 13 29.98 . . . . . . . . 60 H CB . 27571 2 256 . 2 2 60 60 HIS N N 15 119.644 . . . . . . . . 60 H N . 27571 2 257 . 2 2 61 61 GLN H H 1 8.163 . . . . . . . . 61 Q H . 27571 2 258 . 2 2 61 61 GLN C C 13 178.173 . . . . . . . . 61 Q CO . 27571 2 259 . 2 2 61 61 GLN CA C 13 58.603 . . . . . . . . 61 Q CA . 27571 2 260 . 2 2 61 61 GLN CB C 13 27.852 . . . . . . . . 61 Q CB . 27571 2 261 . 2 2 61 61 GLN N N 15 117.562 . . . . . . . . 61 Q N . 27571 2 262 . 2 2 62 62 GLN H H 1 7.876 . . . . . . . . 62 Q H . 27571 2 263 . 2 2 62 62 GLN C C 13 179.265 . . . . . . . . 62 Q CO . 27571 2 264 . 2 2 62 62 GLN CA C 13 58.651 . . . . . . . . 62 Q CA . 27571 2 265 . 2 2 62 62 GLN CB C 13 27.852 . . . . . . . . 62 Q CB . 27571 2 266 . 2 2 62 62 GLN N N 15 119.178 . . . . . . . . 62 Q N . 27571 2 267 . 2 2 63 63 ASP H H 1 8.302 . . . . . . . . 63 D H . 27571 2 268 . 2 2 63 63 ASP C C 13 179.981 . . . . . . . . 63 D CO . 27571 2 269 . 2 2 63 63 ASP CA C 13 57.575 . . . . . . . . 63 D CA . 27571 2 270 . 2 2 63 63 ASP CB C 13 39.076 . . . . . . . . 63 D CB . 27571 2 271 . 2 2 63 63 ASP N N 15 122.229 . . . . . . . . 63 D N . 27571 2 272 . 2 2 64 64 ILE H H 1 8.618 . . . . . . . . 64 I H . 27571 2 273 . 2 2 64 64 ILE C C 13 177.59 . . . . . . . . 64 I CO . 27571 2 274 . 2 2 64 64 ILE CA C 13 65.762 . . . . . . . . 64 I CA . 27571 2 275 . 2 2 64 64 ILE CB C 13 37.6 . . . . . . . . 64 I CB . 27571 2 276 . 2 2 64 64 ILE N N 15 123.322 . . . . . . . . 64 I N . 27571 2 277 . 2 2 65 65 ASP H H 1 8.426 . . . . . . . . 65 D H . 27571 2 278 . 2 2 65 65 ASP C C 13 179.859 . . . . . . . . 65 D CO . 27571 2 279 . 2 2 65 65 ASP CA C 13 57.785 . . . . . . . . 65 D CA . 27571 2 280 . 2 2 65 65 ASP CB C 13 39.54 . . . . . . . . 65 D CB . 27571 2 281 . 2 2 65 65 ASP N N 15 121.206 . . . . . . . . 65 D N . 27571 2 282 . 2 2 66 66 ASP H H 1 8.034 . . . . . . . . 66 D H . 27571 2 283 . 2 2 66 66 ASP C C 13 178.971 . . . . . . . . 66 D CO . 27571 2 284 . 2 2 66 66 ASP CA C 13 57.556 . . . . . . . . 66 D CA . 27571 2 285 . 2 2 66 66 ASP CB C 13 41.07 . . . . . . . . 66 D CB . 27571 2 286 . 2 2 66 66 ASP N N 15 120.571 . . . . . . . . 66 D N . 27571 2 287 . 2 2 67 67 LEU H H 1 8.277 . . . . . . . . 67 L H . 27571 2 288 . 2 2 67 67 LEU C C 13 179.565 . . . . . . . . 67 L CO . 27571 2 289 . 2 2 67 67 LEU CA C 13 58.299 . . . . . . . . 67 L CA . 27571 2 290 . 2 2 67 67 LEU CB C 13 42.48 . . . . . . . . 67 L CB . 27571 2 291 . 2 2 67 67 LEU N N 15 122.043 . . . . . . . . 67 L N . 27571 2 292 . 2 2 68 68 LYS H H 1 8.7 . . . . . . . . 68 K H . 27571 2 293 . 2 2 68 68 LYS C C 13 180.778 . . . . . . . . 68 K CO . 27571 2 294 . 2 2 68 68 LYS CA C 13 60.64 . . . . . . . . 68 K CA . 27571 2 295 . 2 2 68 68 LYS CB C 13 31.818 . . . . . . . . 68 K CB . 27571 2 296 . 2 2 68 68 LYS N N 15 118.687 . . . . . . . . 68 K N . 27571 2 297 . 2 2 69 69 ARG H H 1 7.703 . . . . . . . . 69 R H . 27571 2 298 . 2 2 69 69 ARG C C 13 179.681 . . . . . . . . 69 R CO . 27571 2 299 . 2 2 69 69 ARG CA C 13 59.451 . . . . . . . . 69 R CA . 27571 2 300 . 2 2 69 69 ARG CB C 13 29.399 . . . . . . . . 69 R CB . 27571 2 301 . 2 2 69 69 ARG N N 15 120.77 . . . . . . . . 69 R N . 27571 2 302 . 2 2 70 70 GLN H H 1 8.48 . . . . . . . . 70 Q H . 27571 2 303 . 2 2 70 70 GLN C C 13 179.931 . . . . . . . . 70 Q CO . 27571 2 304 . 2 2 70 70 GLN CA C 13 59.108 . . . . . . . . 70 Q CA . 27571 2 305 . 2 2 70 70 GLN CB C 13 28.274 . . . . . . . . 70 Q CB . 27571 2 306 . 2 2 70 70 GLN N N 15 119.829 . . . . . . . . 70 Q N . 27571 2 307 . 2 2 71 71 ASN H H 1 8.892 . . . . . . . . 71 N H . 27571 2 308 . 2 2 71 71 ASN C C 13 177.94 . . . . . . . . 71 N CO . 27571 2 309 . 2 2 71 71 ASN CA C 13 55.367 . . . . . . . . 71 N CA . 27571 2 310 . 2 2 71 71 ASN CB C 13 36.615 . . . . . . . . 71 N CB . 27571 2 311 . 2 2 71 71 ASN N N 15 120.391 . . . . . . . . 71 N N . 27571 2 312 . 2 2 72 72 ALA H H 1 7.814 . . . . . . . . 72 A H . 27571 2 313 . 2 2 72 72 ALA C C 13 181.257 . . . . . . . . 72 A CO . 27571 2 314 . 2 2 72 72 ALA CA C 13 54.967 . . . . . . . . 72 A CA . 27571 2 315 . 2 2 72 72 ALA CB C 13 17.106 . . . . . . . . 72 A CB . 27571 2 316 . 2 2 72 72 ALA N N 15 122.873 . . . . . . . . 72 A N . 27571 2 317 . 2 2 73 73 LEU H H 1 7.456 . . . . . . . . 73 L H . 27571 2 318 . 2 2 73 73 LEU C C 13 180.48 . . . . . . . . 73 L CO . 27571 2 319 . 2 2 73 73 LEU CA C 13 57.67 . . . . . . . . 73 L CA . 27571 2 320 . 2 2 73 73 LEU CB C 13 40.947 . . . . . . . . 73 L CB . 27571 2 321 . 2 2 73 73 LEU N N 15 119.324 . . . . . . . . 73 L N . 27571 2 322 . 2 2 74 74 LEU H H 1 7.963 . . . . . . . . 74 L H . 27571 2 323 . 2 2 74 74 LEU C C 13 179.571 . . . . . . . . 74 L CO . 27571 2 324 . 2 2 74 74 LEU CA C 13 57.946 . . . . . . . . 74 L CA . 27571 2 325 . 2 2 74 74 LEU CB C 13 42.466 . . . . . . . . 74 L CB . 27571 2 326 . 2 2 74 74 LEU N N 15 120.855 . . . . . . . . 74 L N . 27571 2 327 . 2 2 75 75 GLU H H 1 8.695 . . . . . . . . 75 E H . 27571 2 328 . 2 2 75 75 GLU C C 13 180.758 . . . . . . . . 75 E CO . 27571 2 329 . 2 2 75 75 GLU CA C 13 59.612 . . . . . . . . 75 E CA . 27571 2 330 . 2 2 75 75 GLU CB C 13 28.822 . . . . . . . . 75 E CB . 27571 2 331 . 2 2 75 75 GLU N N 15 118.687 . . . . . . . . 75 E N . 27571 2 332 . 2 2 76 76 GLN H H 1 7.553 . . . . . . . . 76 Q H . 27571 2 333 . 2 2 76 76 GLN C C 13 178.799 . . . . . . . . 76 Q CO . 27571 2 334 . 2 2 76 76 GLN CA C 13 58.461 . . . . . . . . 76 Q CA . 27571 2 335 . 2 2 76 76 GLN CB C 13 27.838 . . . . . . . . 76 Q CB . 27571 2 336 . 2 2 76 76 GLN N N 15 117.512 . . . . . . . . 76 Q N . 27571 2 337 . 2 2 77 77 GLN H H 1 7.787 . . . . . . . . 77 Q H . 27571 2 338 . 2 2 77 77 GLN C C 13 179.071 . . . . . . . . 77 Q CO . 27571 2 339 . 2 2 77 77 GLN CA C 13 58.451 . . . . . . . . 77 Q CA . 27571 2 340 . 2 2 77 77 GLN CB C 13 28.766 . . . . . . . . 77 Q CB . 27571 2 341 . 2 2 77 77 GLN N N 15 118.862 . . . . . . . . 77 Q N . 27571 2 342 . 2 2 78 78 VAL H H 1 8.114 . . . . . . . . 78 V H . 27571 2 343 . 2 2 78 78 VAL C C 13 177.812 . . . . . . . . 78 V CO . 27571 2 344 . 2 2 78 78 VAL CA C 13 64.972 . . . . . . . . 78 V CA . 27571 2 345 . 2 2 78 78 VAL CB C 13 31.256 . . . . . . . . 78 V CB . 27571 2 346 . 2 2 78 78 VAL N N 15 117.98 . . . . . . . . 78 V N . 27571 2 347 . 2 2 79 79 ARG H H 1 7.63 . . . . . . . . 79 R H . 27571 2 348 . 2 2 79 79 ARG C C 13 176.531 . . . . . . . . 79 R CO . 27571 2 349 . 2 2 79 79 ARG CA C 13 57.471 . . . . . . . . 79 R CA . 27571 2 350 . 2 2 79 79 ARG CB C 13 29.68 . . . . . . . . 79 R CB . 27571 2 351 . 2 2 79 79 ARG N N 15 118.49 . . . . . . . . 79 R N . 27571 2 352 . 2 2 80 80 ALA H H 1 7.385 . . . . . . . . 80 A H . 27571 2 353 . 2 2 80 80 ALA C C 13 177.024 . . . . . . . . 80 A CO . 27571 2 354 . 2 2 80 80 ALA CA C 13 52.121 . . . . . . . . 80 A CA . 27571 2 355 . 2 2 80 80 ALA CB C 13 18.737 . . . . . . . . 80 A CB . 27571 2 356 . 2 2 80 80 ALA N N 15 121.424 . . . . . . . . 80 A N . 27571 2 357 . 2 2 81 81 LEU H H 1 7.242 . . . . . . . . 81 L H . 27571 2 358 . 2 2 81 81 LEU C C 13 182.583 . . . . . . . . 81 L CO . 27571 2 359 . 2 2 81 81 LEU CA C 13 56.661 . . . . . . . . 81 L CA . 27571 2 360 . 2 2 81 81 LEU CB C 13 42.719 . . . . . . . . 81 L CB . 27571 2 361 . 2 2 81 81 LEU N N 15 126.135 . . . . . . . . 81 L N . 27571 2 stop_ save_