data_5032 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5032 _Entry.Title ; 1H, 13C and 15N Resonance Assignments of the DNA Binding Domain of the Human Forkhead Transcription Factor AFX ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2001-05-28 _Entry.Accession_date 2001-05-29 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Johan Weigelt . . . 5032 2 Isabel Climent . . . 5032 3 K. Dahlman-Wright . . . 5032 4 Mats Wikstrom . . . 5032 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5032 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 75 5032 '13C chemical shifts' 147 5032 '15N chemical shifts' 75 5032 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2010-07-14 2001-05-28 update BMRB 'update DNA residue label to two-letter code' 5032 1 . . 2001-06-05 2001-05-28 original author 'original release' 5032 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 4675 '1H, 13C and 15N resonance assignments of the DNA binding domain of AFX' 5032 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5032 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20377252 _Citation.DOI . _Citation.PubMed_ID 10921784 _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 13C and 15N Resonance Assignments of the DNA Binding Domain of the Human Forkhead Transcription Factor AFX ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 17 _Citation.Journal_issue 2 _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 181 _Citation.Page_last 182 _Citation.Year 2000 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Johan Weigelt . . . 5032 1 2 Isabel Climent . . . 5032 1 3 K. Dahlman-Wright . . . 5032 1 4 Mats Wikstrom . . . 5032 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_AFX-DBD _Assembly.Sf_category assembly _Assembly.Sf_framecode system_AFX-DBD _Assembly.Entry_ID 5032 _Assembly.ID 1 _Assembly.Name 'AFX in complex with DNA' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5032 1 stop_ 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 'AFX DNA binding domain' 1 $AFX-DBD . . . native . . . . . 5032 1 2 '16mer insulin response sequence, strand 1' 2 $dIRSA_1 . . . native . . . . . 5032 1 3 '16mer insulin response sequence, strand 2' 3 $dIRSA_2 . . . native . . . . . 5032 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1e17 . . . . . ; Shorter protein construct used in present study. Present data describe the DNA complexed state. ; 5032 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'AFX in complex with DNA' system 5032 1 AFX-DBD abbreviation 5032 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AFX-DBD _Entity.Sf_category entity _Entity.Sf_framecode AFX-DBD _Entity.Entry_ID 5032 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'AFX DNA binding domain' _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 ; MRGSHHHHHHGSRRNAWGNQ SYAELISQAIESAPEKRLTL AQIYEWMVRTVPYFKDKGDS NSSAGWKNSIRHNLSLHSKF IKVHNEATGKSSWWMLNPEG GKSGKAPR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 108 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _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 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 3L2C . "Crystal Structure Of The Dna Binding Domain Of Foxo4 Bound To Dna" . . . . . 86.11 110 100.00 100.00 4.34e-60 . . . . 5032 1 2 no DBJ BAA86199 . "forkhead protein [Mus musculus]" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 3 no DBJ BAE34214 . "unnamed protein product [Mus musculus]" . . . . . 52.78 200 98.25 100.00 1.94e-31 . . . . 5032 1 4 no DBJ BAG61928 . "unnamed protein product [Homo sapiens]" . . . . . 90.74 398 100.00 100.00 6.50e-63 . . . . 5032 1 5 no DBJ BAG73163 . "forkhead box O4 [synthetic construct]" . . . . . 90.74 505 100.00 100.00 6.23e-63 . . . . 5032 1 6 no EMBL CAA63819 . "AFX [Homo sapiens]" . . . . . 90.74 501 98.98 98.98 2.72e-62 . . . . 5032 1 7 no EMBL CAA72156 . "AFX1 [Homo sapiens]" . . . . . 90.74 504 100.00 100.00 4.21e-63 . . . . 5032 1 8 no GB AAD42108 . "forkhead protein AFXH [Mus musculus]" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 9 no GB AAH99460 . "Forkhead box O4 [Mus musculus]" . . . . . 52.78 200 100.00 100.00 3.96e-32 . . . . 5032 1 10 no GB AAI06762 . "Forkhead box O4 [Homo sapiens]" . . . . . 90.74 505 100.00 100.00 6.23e-63 . . . . 5032 1 11 no GB AAI39276 . "Forkhead box O4 [Mus musculus]" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 12 no GB AAI39305 . "Forkhead box O4 [Mus musculus]" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 13 no REF NP_001094747 . "forkhead box protein O4 [Bos taurus]" . . . . . 90.74 512 100.00 100.00 8.05e-63 . . . . 5032 1 14 no REF NP_001100413 . "forkhead box protein O4 [Rattus norvegicus]" . . . . . 90.74 505 97.96 98.98 8.05e-62 . . . . 5032 1 15 no REF NP_005929 . "forkhead box protein O4 isoform 1 [Homo sapiens]" . . . . . 90.74 505 100.00 100.00 6.23e-63 . . . . 5032 1 16 no REF NP_061259 . "forkhead box protein O4 [Mus musculus]" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 17 no REF XP_002720130 . "PREDICTED: forkhead box protein O4 [Oryctolagus cuniculus]" . . . . . 90.74 506 100.00 100.00 7.61e-63 . . . . 5032 1 18 no SP P98177 . "RecName: Full=Forkhead box protein O4; AltName: Full=Fork head domain transcription factor AFX1 [Homo sapiens]" . . . . . 90.74 505 100.00 100.00 6.23e-63 . . . . 5032 1 19 no SP Q9WVH3 . "RecName: Full=Forkhead box protein O4; AltName: Full=Afxh; AltName: Full=Fork head domain transcription factor AFX1 [Mus muscul" . . . . . 90.74 505 97.96 98.98 1.38e-61 . . . . 5032 1 20 no TPG DAA12928 . "TPA: forkhead box O4 [Bos taurus]" . . . . . 90.74 512 100.00 100.00 8.05e-63 . . . . 5032 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'AFX DNA binding domain' common 5032 1 AFX-DBD abbreviation 5032 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 81 MET . 5032 1 2 82 ARG . 5032 1 3 83 GLY . 5032 1 4 84 SER . 5032 1 5 85 HIS . 5032 1 6 86 HIS . 5032 1 7 87 HIS . 5032 1 8 88 HIS . 5032 1 9 89 HIS . 5032 1 10 90 HIS . 5032 1 11 91 GLY . 5032 1 12 92 SER . 5032 1 13 93 ARG . 5032 1 14 94 ARG . 5032 1 15 95 ASN . 5032 1 16 96 ALA . 5032 1 17 97 TRP . 5032 1 18 98 GLY . 5032 1 19 99 ASN . 5032 1 20 100 GLN . 5032 1 21 101 SER . 5032 1 22 102 TYR . 5032 1 23 103 ALA . 5032 1 24 104 GLU . 5032 1 25 105 LEU . 5032 1 26 106 ILE . 5032 1 27 107 SER . 5032 1 28 108 GLN . 5032 1 29 109 ALA . 5032 1 30 110 ILE . 5032 1 31 111 GLU . 5032 1 32 112 SER . 5032 1 33 113 ALA . 5032 1 34 114 PRO . 5032 1 35 115 GLU . 5032 1 36 116 LYS . 5032 1 37 117 ARG . 5032 1 38 118 LEU . 5032 1 39 119 THR . 5032 1 40 120 LEU . 5032 1 41 121 ALA . 5032 1 42 122 GLN . 5032 1 43 123 ILE . 5032 1 44 124 TYR . 5032 1 45 125 GLU . 5032 1 46 126 TRP . 5032 1 47 127 MET . 5032 1 48 128 VAL . 5032 1 49 129 ARG . 5032 1 50 130 THR . 5032 1 51 131 VAL . 5032 1 52 132 PRO . 5032 1 53 133 TYR . 5032 1 54 134 PHE . 5032 1 55 135 LYS . 5032 1 56 136 ASP . 5032 1 57 137 LYS . 5032 1 58 138 GLY . 5032 1 59 139 ASP . 5032 1 60 140 SER . 5032 1 61 141 ASN . 5032 1 62 142 SER . 5032 1 63 143 SER . 5032 1 64 144 ALA . 5032 1 65 145 GLY . 5032 1 66 146 TRP . 5032 1 67 147 LYS . 5032 1 68 148 ASN . 5032 1 69 149 SER . 5032 1 70 150 ILE . 5032 1 71 151 ARG . 5032 1 72 152 HIS . 5032 1 73 153 ASN . 5032 1 74 154 LEU . 5032 1 75 155 SER . 5032 1 76 156 LEU . 5032 1 77 157 HIS . 5032 1 78 158 SER . 5032 1 79 159 LYS . 5032 1 80 160 PHE . 5032 1 81 161 ILE . 5032 1 82 162 LYS . 5032 1 83 163 VAL . 5032 1 84 164 HIS . 5032 1 85 165 ASN . 5032 1 86 166 GLU . 5032 1 87 167 ALA . 5032 1 88 168 THR . 5032 1 89 169 GLY . 5032 1 90 170 LYS . 5032 1 91 171 SER . 5032 1 92 172 SER . 5032 1 93 173 TRP . 5032 1 94 174 TRP . 5032 1 95 175 MET . 5032 1 96 176 LEU . 5032 1 97 177 ASN . 5032 1 98 178 PRO . 5032 1 99 179 GLU . 5032 1 100 180 GLY . 5032 1 101 181 GLY . 5032 1 102 182 LYS . 5032 1 103 183 SER . 5032 1 104 184 GLY . 5032 1 105 185 LYS . 5032 1 106 186 ALA . 5032 1 107 187 PRO . 5032 1 108 188 ARG . 5032 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 5032 1 . ARG 2 2 5032 1 . GLY 3 3 5032 1 . SER 4 4 5032 1 . HIS 5 5 5032 1 . HIS 6 6 5032 1 . HIS 7 7 5032 1 . HIS 8 8 5032 1 . HIS 9 9 5032 1 . HIS 10 10 5032 1 . GLY 11 11 5032 1 . SER 12 12 5032 1 . ARG 13 13 5032 1 . ARG 14 14 5032 1 . ASN 15 15 5032 1 . ALA 16 16 5032 1 . TRP 17 17 5032 1 . GLY 18 18 5032 1 . ASN 19 19 5032 1 . GLN 20 20 5032 1 . SER 21 21 5032 1 . TYR 22 22 5032 1 . ALA 23 23 5032 1 . GLU 24 24 5032 1 . LEU 25 25 5032 1 . ILE 26 26 5032 1 . SER 27 27 5032 1 . GLN 28 28 5032 1 . ALA 29 29 5032 1 . ILE 30 30 5032 1 . GLU 31 31 5032 1 . SER 32 32 5032 1 . ALA 33 33 5032 1 . PRO 34 34 5032 1 . GLU 35 35 5032 1 . LYS 36 36 5032 1 . ARG 37 37 5032 1 . LEU 38 38 5032 1 . THR 39 39 5032 1 . LEU 40 40 5032 1 . ALA 41 41 5032 1 . GLN 42 42 5032 1 . ILE 43 43 5032 1 . TYR 44 44 5032 1 . GLU 45 45 5032 1 . TRP 46 46 5032 1 . MET 47 47 5032 1 . VAL 48 48 5032 1 . ARG 49 49 5032 1 . THR 50 50 5032 1 . VAL 51 51 5032 1 . PRO 52 52 5032 1 . TYR 53 53 5032 1 . PHE 54 54 5032 1 . LYS 55 55 5032 1 . ASP 56 56 5032 1 . LYS 57 57 5032 1 . GLY 58 58 5032 1 . ASP 59 59 5032 1 . SER 60 60 5032 1 . ASN 61 61 5032 1 . SER 62 62 5032 1 . SER 63 63 5032 1 . ALA 64 64 5032 1 . GLY 65 65 5032 1 . TRP 66 66 5032 1 . LYS 67 67 5032 1 . ASN 68 68 5032 1 . SER 69 69 5032 1 . ILE 70 70 5032 1 . ARG 71 71 5032 1 . HIS 72 72 5032 1 . ASN 73 73 5032 1 . LEU 74 74 5032 1 . SER 75 75 5032 1 . LEU 76 76 5032 1 . HIS 77 77 5032 1 . SER 78 78 5032 1 . LYS 79 79 5032 1 . PHE 80 80 5032 1 . ILE 81 81 5032 1 . LYS 82 82 5032 1 . VAL 83 83 5032 1 . HIS 84 84 5032 1 . ASN 85 85 5032 1 . GLU 86 86 5032 1 . ALA 87 87 5032 1 . THR 88 88 5032 1 . GLY 89 89 5032 1 . LYS 90 90 5032 1 . SER 91 91 5032 1 . SER 92 92 5032 1 . TRP 93 93 5032 1 . TRP 94 94 5032 1 . MET 95 95 5032 1 . LEU 96 96 5032 1 . ASN 97 97 5032 1 . PRO 98 98 5032 1 . GLU 99 99 5032 1 . GLY 100 100 5032 1 . GLY 101 101 5032 1 . LYS 102 102 5032 1 . SER 103 103 5032 1 . GLY 104 104 5032 1 . LYS 105 105 5032 1 . ALA 106 106 5032 1 . PRO 107 107 5032 1 . ARG 108 108 5032 1 stop_ save_ save_dIRSA_1 _Entity.Sf_category entity _Entity.Sf_framecode dIRSA_1 _Entity.Entry_ID 5032 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'Insulin response element from IGFBP-1 promoter' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code CAAGCAAAACAAACCA _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 16 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _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_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Insulin response element from IGFBP-1 promoter' common 5032 2 dIRSA abbreviation 5032 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 . DC . 5032 2 2 . DA . 5032 2 3 . DA . 5032 2 4 . DG . 5032 2 5 . DC . 5032 2 6 . DA . 5032 2 7 . DA . 5032 2 8 . DA . 5032 2 9 . DA . 5032 2 10 . DC . 5032 2 11 . DA . 5032 2 12 . DA . 5032 2 13 . DA . 5032 2 14 . DC . 5032 2 15 . DC . 5032 2 16 . DA . 5032 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 . DC 1 1 5032 2 . DA 2 2 5032 2 . DA 3 3 5032 2 . DG 4 4 5032 2 . DC 5 5 5032 2 . DA 6 6 5032 2 . DA 7 7 5032 2 . DA 8 8 5032 2 . DA 9 9 5032 2 . DC 10 10 5032 2 . DA 11 11 5032 2 . DA 12 12 5032 2 . DA 13 13 5032 2 . DC 14 14 5032 2 . DC 15 15 5032 2 . DA 16 16 5032 2 stop_ save_ save_dIRSA_2 _Entity.Sf_category entity _Entity.Sf_framecode dIRSA_2 _Entity.Entry_ID 5032 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name 'Insulin response element from IGFBP-1 promoter' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code TGGTTTGTTTTGCTTG _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 16 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _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_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Insulin response element from IGFBP-1 promoter' common 5032 3 dIRSA abbreviation 5032 3 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 . DT . 5032 3 2 . DG . 5032 3 3 . DG . 5032 3 4 . DT . 5032 3 5 . DT . 5032 3 6 . DT . 5032 3 7 . DG . 5032 3 8 . DT . 5032 3 9 . DT . 5032 3 10 . DT . 5032 3 11 . DT . 5032 3 12 . DG . 5032 3 13 . DC . 5032 3 14 . DT . 5032 3 15 . DT . 5032 3 16 . DG . 5032 3 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 . DT 1 1 5032 3 . DG 2 2 5032 3 . DG 3 3 5032 3 . DT 4 4 5032 3 . DT 5 5 5032 3 . DT 6 6 5032 3 . DG 7 7 5032 3 . DT 8 8 5032 3 . DT 9 9 5032 3 . DT 10 10 5032 3 . DT 11 11 5032 3 . DG 12 12 5032 3 . DC 13 13 5032 3 . DT 14 14 5032 3 . DT 15 15 5032 3 . DG 16 16 5032 3 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 5032 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $AFX-DBD . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 5032 1 2 2 $dIRSA_1 . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 5032 1 3 3 $dIRSA_2 . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 5032 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 5032 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $AFX-DBD . 'recombinant technology' . 'E. coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 2 2 $dIRSA_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 3 3 $dIRSA_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5032 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'AFX DNA binding domain' '[U-13C; U-15N; U-90% 2H]' . . 1 $AFX-DBD . . 0.5 . . mM . . . . 5032 1 2 'Insulin response element from IGFBP-1 promoter' . . . 2 $dIRSA_1 . . 0.5 . . mM . . . . 5032 1 3 'Insulin response element from IGFBP-1 promoter' . . . 3 $dIRSA_2 . . 0.5 . . mM . . . . 5032 1 4 'sodium phospate' . . . . . . . 20 . . mM . . . . 5032 1 5 NaCl . . . . . . . 50 . . mM . . . . 5032 1 6 MgCl2 . . . . . . . 2 . . mM . . . . 5032 1 7 NaN3 . . . . . . . 0.02 . . '% w/v' . . . . 5032 1 stop_ save_ ####################### # Sample conditions # ####################### save_Exp_cond _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Exp_cond _Sample_condition_list.Entry_ID 5032 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 0.05 n/a 5032 1 temperature 298 0.2 K 5032 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrPipe _Software.Sf_category software _Software.Sf_framecode nmrPipe _Software.Entry_ID 5032 _Software.ID 1 _Software.Name nmrPipe _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 5032 1 stop_ save_ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 5032 _Software.ID 2 _Software.Name ANSIG _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID analysis 5032 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 5032 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5032 _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 NMR_spectrometer Varian INOVA . 800 . . . 5032 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 5032 _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 '1H-15N TROSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 2 '1H-15N HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 3 HNCACB-TROSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 4 HNCA-TROSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5032 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5032 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N TROSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5032 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5032 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCACB-TROSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5032 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCA-TROSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5032 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 H2O proton . . . . ppm 4.773 internal direct . internal cylindrical parallel . . . . . . 5032 1 N 15 H2O proton . . . . ppm 4.773 internal indirect 0.101329118 internal cylindrical parallel . . . . . . 5032 1 C 13 H2O proton . . . . ppm 4.773 internal indirect 0.251449530 internal cylindrical parallel . . . . . . 5032 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5032 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Exp_cond _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 'The reported HN and N chemical shifts reflect TROSY type chemical shifts at 800 MHz.' _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 $sample_1 . 5032 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.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 15 15 ASN CA C 13 57.4 0.10 . 9 . . . . . . . . 5032 1 2 . 1 1 15 15 ASN CB C 13 29.1 0.10 . 9 . . . . . . . . 5032 1 3 . 1 1 16 16 ALA N N 15 123.7 0.10 . 9 . . . . . . . . 5032 1 4 . 1 1 16 16 ALA H H 1 8.06 0.02 . 9 . . . . . . . . 5032 1 5 . 1 1 16 16 ALA CA C 13 51.9 0.10 . 9 . . . . . . . . 5032 1 6 . 1 1 16 16 ALA CB C 13 18.6 0.10 . 9 . . . . . . . . 5032 1 7 . 1 1 18 18 GLY N N 15 111.0 0.10 . 1 . . . . . . . . 5032 1 8 . 1 1 18 18 GLY H H 1 6.88 0.02 . 1 . . . . . . . . 5032 1 9 . 1 1 18 18 GLY CA C 13 44.2 0.10 . 1 . . . . . . . . 5032 1 10 . 1 1 19 19 ASN N N 15 117.8 0.10 . 1 . . . . . . . . 5032 1 11 . 1 1 19 19 ASN H H 1 8.31 0.02 . 1 . . . . . . . . 5032 1 12 . 1 1 19 19 ASN CA C 13 53.3 0.10 . 1 . . . . . . . . 5032 1 13 . 1 1 19 19 ASN CB C 13 38.2 0.10 . 1 . . . . . . . . 5032 1 14 . 1 1 20 20 GLN N N 15 119.5 0.10 . 1 . . . . . . . . 5032 1 15 . 1 1 20 20 GLN H H 1 8.02 0.02 . 1 . . . . . . . . 5032 1 16 . 1 1 20 20 GLN CA C 13 55.8 0.10 . 1 . . . . . . . . 5032 1 17 . 1 1 20 20 GLN CB C 13 30.7 0.10 . 1 . . . . . . . . 5032 1 18 . 1 1 21 21 SER N N 15 119.8 0.10 . 1 . . . . . . . . 5032 1 19 . 1 1 21 21 SER H H 1 8.85 0.02 . 1 . . . . . . . . 5032 1 20 . 1 1 21 21 SER CA C 13 56.5 0.10 . 1 . . . . . . . . 5032 1 21 . 1 1 21 21 SER CB C 13 65.5 0.10 . 1 . . . . . . . . 5032 1 22 . 1 1 22 22 TYR N N 15 118.6 0.10 . 1 . . . . . . . . 5032 1 23 . 1 1 22 22 TYR H H 1 8.73 0.02 . 1 . . . . . . . . 5032 1 24 . 1 1 22 22 TYR CA C 13 64.0 0.10 . 1 . . . . . . . . 5032 1 25 . 1 1 23 23 ALA N N 15 119.2 0.10 . 1 . . . . . . . . 5032 1 26 . 1 1 23 23 ALA H H 1 8.96 0.02 . 1 . . . . . . . . 5032 1 27 . 1 1 23 23 ALA CA C 13 55.6 0.10 . 1 . . . . . . . . 5032 1 28 . 1 1 23 23 ALA CB C 13 17.2 0.10 . 1 . . . . . . . . 5032 1 29 . 1 1 24 24 GLU N N 15 121.6 0.10 . 1 . . . . . . . . 5032 1 30 . 1 1 24 24 GLU H H 1 8.06 0.02 . 1 . . . . . . . . 5032 1 31 . 1 1 24 24 GLU CA C 13 59.3 0.10 . 1 . . . . . . . . 5032 1 32 . 1 1 24 24 GLU CB C 13 29.2 0.10 . 1 . . . . . . . . 5032 1 33 . 1 1 25 25 LEU N N 15 122.0 0.10 . 1 . . . . . . . . 5032 1 34 . 1 1 25 25 LEU H H 1 8.10 0.02 . 1 . . . . . . . . 5032 1 35 . 1 1 25 25 LEU CA C 13 58.1 0.10 . 1 . . . . . . . . 5032 1 36 . 1 1 25 25 LEU CB C 13 41.6 0.10 . 1 . . . . . . . . 5032 1 37 . 1 1 26 26 ILE N N 15 118.5 0.10 . 1 . . . . . . . . 5032 1 38 . 1 1 26 26 ILE H H 1 8.56 0.02 . 1 . . . . . . . . 5032 1 39 . 1 1 26 26 ILE CA C 13 65.2 0.10 . 1 . . . . . . . . 5032 1 40 . 1 1 26 26 ILE CB C 13 37.5 0.10 . 1 . . . . . . . . 5032 1 41 . 1 1 27 27 SER N N 15 113.5 0.10 . 1 . . . . . . . . 5032 1 42 . 1 1 27 27 SER H H 1 7.97 0.02 . 1 . . . . . . . . 5032 1 43 . 1 1 27 27 SER CA C 13 62.8 0.10 . 1 . . . . . . . . 5032 1 44 . 1 1 28 28 GLN N N 15 121.2 0.10 . 1 . . . . . . . . 5032 1 45 . 1 1 28 28 GLN H H 1 7.59 0.02 . 1 . . . . . . . . 5032 1 46 . 1 1 28 28 GLN CA C 13 59.9 0.10 . 1 . . . . . . . . 5032 1 47 . 1 1 28 28 GLN CB C 13 28.1 0.10 . 1 . . . . . . . . 5032 1 48 . 1 1 29 29 ALA N N 15 124.4 0.10 . 1 . . . . . . . . 5032 1 49 . 1 1 29 29 ALA H H 1 7.27 0.02 . 1 . . . . . . . . 5032 1 50 . 1 1 29 29 ALA CA C 13 54.3 0.10 . 1 . . . . . . . . 5032 1 51 . 1 1 29 29 ALA CB C 13 16.2 0.10 . 1 . . . . . . . . 5032 1 52 . 1 1 30 30 ILE N N 15 118.6 0.10 . 1 . . . . . . . . 5032 1 53 . 1 1 30 30 ILE H H 1 7.79 0.02 . 1 . . . . . . . . 5032 1 54 . 1 1 30 30 ILE CA C 13 65.8 0.10 . 1 . . . . . . . . 5032 1 55 . 1 1 30 30 ILE CB C 13 37.8 0.10 . 1 . . . . . . . . 5032 1 56 . 1 1 31 31 GLU N N 15 116.3 0.10 . 1 . . . . . . . . 5032 1 57 . 1 1 31 31 GLU H H 1 8.23 0.02 . 1 . . . . . . . . 5032 1 58 . 1 1 31 31 GLU CA C 13 58.4 0.10 . 1 . . . . . . . . 5032 1 59 . 1 1 31 31 GLU CB C 13 29.2 0.10 . 1 . . . . . . . . 5032 1 60 . 1 1 32 32 SER CA C 13 59.2 0.10 . 1 . . . . . . . . 5032 1 61 . 1 1 33 33 ALA N N 15 128.8 0.10 . 1 . . . . . . . . 5032 1 62 . 1 1 33 33 ALA H H 1 7.38 0.02 . 1 . . . . . . . . 5032 1 63 . 1 1 33 33 ALA CA C 13 50.2 0.10 . 1 . . . . . . . . 5032 1 64 . 1 1 33 33 ALA CB C 13 18.2 0.10 . 1 . . . . . . . . 5032 1 65 . 1 1 36 36 LYS N N 15 114.3 0.10 . 1 . . . . . . . . 5032 1 66 . 1 1 36 36 LYS H H 1 8.07 0.02 . 1 . . . . . . . . 5032 1 67 . 1 1 36 36 LYS CA C 13 55.6 0.10 . 1 . . . . . . . . 5032 1 68 . 1 1 36 36 LYS CB C 13 28.5 0.10 . 1 . . . . . . . . 5032 1 69 . 1 1 37 37 ARG N N 15 109.7 0.10 . 1 . . . . . . . . 5032 1 70 . 1 1 37 37 ARG H H 1 6.58 0.02 . 1 . . . . . . . . 5032 1 71 . 1 1 37 37 ARG CA C 13 53.6 0.10 . 1 . . . . . . . . 5032 1 72 . 1 1 37 37 ARG CB C 13 31.9 0.10 . 1 . . . . . . . . 5032 1 73 . 1 1 38 38 LEU N N 15 120.9 0.10 . 1 . . . . . . . . 5032 1 74 . 1 1 38 38 LEU H H 1 8.47 0.02 . 1 . . . . . . . . 5032 1 75 . 1 1 38 38 LEU CA C 13 54.0 0.10 . 1 . . . . . . . . 5032 1 76 . 1 1 38 38 LEU CB C 13 48.5 0.10 . 1 . . . . . . . . 5032 1 77 . 1 1 39 39 THR N N 15 112.7 0.10 . 1 . . . . . . . . 5032 1 78 . 1 1 39 39 THR H H 1 8.78 0.02 . 1 . . . . . . . . 5032 1 79 . 1 1 39 39 THR CA C 13 60.6 0.10 . 1 . . . . . . . . 5032 1 80 . 1 1 39 39 THR CB C 13 71.3 0.10 . 1 . . . . . . . . 5032 1 81 . 1 1 40 40 LEU N N 15 123.5 0.10 . 1 . . . . . . . . 5032 1 82 . 1 1 40 40 LEU H H 1 9.78 0.02 . 1 . . . . . . . . 5032 1 83 . 1 1 40 40 LEU CA C 13 58.3 0.10 . 1 . . . . . . . . 5032 1 84 . 1 1 40 40 LEU CB C 13 41.1 0.10 . 1 . . . . . . . . 5032 1 85 . 1 1 41 41 ALA N N 15 117.5 0.10 . 1 . . . . . . . . 5032 1 86 . 1 1 41 41 ALA H H 1 8.40 0.02 . 1 . . . . . . . . 5032 1 87 . 1 1 41 41 ALA CA C 13 54.9 0.10 . 1 . . . . . . . . 5032 1 88 . 1 1 41 41 ALA CB C 13 17.6 0.10 . 1 . . . . . . . . 5032 1 89 . 1 1 42 42 GLN N N 15 116.4 0.10 . 1 . . . . . . . . 5032 1 90 . 1 1 42 42 GLN H H 1 7.38 0.02 . 1 . . . . . . . . 5032 1 91 . 1 1 42 42 GLN CA C 13 58.2 0.10 . 1 . . . . . . . . 5032 1 92 . 1 1 42 42 GLN CB C 13 30.1 0.10 . 1 . . . . . . . . 5032 1 93 . 1 1 43 43 ILE N N 15 126.2 0.10 . 1 . . . . . . . . 5032 1 94 . 1 1 43 43 ILE H H 1 8.26 0.02 . 1 . . . . . . . . 5032 1 95 . 1 1 43 43 ILE CA C 13 66.5 0.10 . 1 . . . . . . . . 5032 1 96 . 1 1 43 43 ILE CB C 13 36.8 0.10 . 1 . . . . . . . . 5032 1 97 . 1 1 44 44 TYR N N 15 118.1 0.10 . 1 . . . . . . . . 5032 1 98 . 1 1 44 44 TYR H H 1 8.21 0.02 . 1 . . . . . . . . 5032 1 99 . 1 1 44 44 TYR CA C 13 58.0 0.10 . 1 . . . . . . . . 5032 1 100 . 1 1 44 44 TYR CB C 13 36.6 0.10 . 1 . . . . . . . . 5032 1 101 . 1 1 45 45 GLU N N 15 117.2 0.10 . 1 . . . . . . . . 5032 1 102 . 1 1 45 45 GLU H H 1 7.92 0.02 . 1 . . . . . . . . 5032 1 103 . 1 1 45 45 GLU CA C 13 59.2 0.10 . 1 . . . . . . . . 5032 1 104 . 1 1 45 45 GLU CB C 13 29.3 0.10 . 1 . . . . . . . . 5032 1 105 . 1 1 46 46 TRP N N 15 121.2 0.10 . 1 . . . . . . . . 5032 1 106 . 1 1 46 46 TRP H H 1 8.18 0.02 . 1 . . . . . . . . 5032 1 107 . 1 1 46 46 TRP CA C 13 62.5 0.10 . 1 . . . . . . . . 5032 1 108 . 1 1 46 46 TRP CB C 13 29.0 0.10 . 1 . . . . . . . . 5032 1 109 . 1 1 47 47 MET N N 15 119.7 0.10 . 1 . . . . . . . . 5032 1 110 . 1 1 47 47 MET H H 1 8.28 0.02 . 1 . . . . . . . . 5032 1 111 . 1 1 47 47 MET CA C 13 58.3 0.10 . 1 . . . . . . . . 5032 1 112 . 1 1 47 47 MET CB C 13 31.1 0.10 . 1 . . . . . . . . 5032 1 113 . 1 1 48 48 VAL N N 15 116.2 0.10 . 1 . . . . . . . . 5032 1 114 . 1 1 48 48 VAL H H 1 7.43 0.02 . 1 . . . . . . . . 5032 1 115 . 1 1 48 48 VAL CA C 13 64.5 0.10 . 1 . . . . . . . . 5032 1 116 . 1 1 48 48 VAL CB C 13 31.4 0.10 . 1 . . . . . . . . 5032 1 117 . 1 1 49 49 ARG N N 15 117.3 0.10 . 1 . . . . . . . . 5032 1 118 . 1 1 49 49 ARG H H 1 7.80 0.02 . 1 . . . . . . . . 5032 1 119 . 1 1 49 49 ARG CA C 13 57.6 0.10 . 1 . . . . . . . . 5032 1 120 . 1 1 49 49 ARG CB C 13 30.6 0.10 . 1 . . . . . . . . 5032 1 121 . 1 1 50 50 THR N N 15 112.6 0.10 . 1 . . . . . . . . 5032 1 122 . 1 1 50 50 THR H H 1 7.46 0.02 . 1 . . . . . . . . 5032 1 123 . 1 1 50 50 THR CA C 13 64.2 0.10 . 1 . . . . . . . . 5032 1 124 . 1 1 50 50 THR CB C 13 69.2 0.10 . 1 . . . . . . . . 5032 1 125 . 1 1 51 51 VAL N N 15 125.5 0.10 . 1 . . . . . . . . 5032 1 126 . 1 1 51 51 VAL H H 1 7.86 0.02 . 1 . . . . . . . . 5032 1 127 . 1 1 51 51 VAL CA C 13 59.8 0.10 . 1 . . . . . . . . 5032 1 128 . 1 1 51 51 VAL CB C 13 31.7 0.10 . 1 . . . . . . . . 5032 1 129 . 1 1 53 53 TYR CA C 13 60.9 0.10 . 1 . . . . . . . . 5032 1 130 . 1 1 54 54 PHE N N 15 113.1 0.10 . 1 . . . . . . . . 5032 1 131 . 1 1 54 54 PHE H H 1 7.32 0.02 . 1 . . . . . . . . 5032 1 132 . 1 1 54 54 PHE CA C 13 58.7 0.10 . 1 . . . . . . . . 5032 1 133 . 1 1 54 54 PHE CB C 13 37.3 0.10 . 1 . . . . . . . . 5032 1 134 . 1 1 55 55 LYS N N 15 120.8 0.10 . 1 . . . . . . . . 5032 1 135 . 1 1 55 55 LYS H H 1 7.35 0.02 . 1 . . . . . . . . 5032 1 136 . 1 1 55 55 LYS CA C 13 59.1 0.10 . 1 . . . . . . . . 5032 1 137 . 1 1 55 55 LYS CB C 13 31.9 0.10 . 1 . . . . . . . . 5032 1 138 . 1 1 56 56 ASP N N 15 116.5 0.10 . 1 . . . . . . . . 5032 1 139 . 1 1 56 56 ASP H H 1 7.97 0.02 . 1 . . . . . . . . 5032 1 140 . 1 1 56 56 ASP CA C 13 53.9 0.10 . 1 . . . . . . . . 5032 1 141 . 1 1 56 56 ASP CB C 13 40.0 0.10 . 1 . . . . . . . . 5032 1 142 . 1 1 57 57 LYS N N 15 119.3 0.10 . 1 . . . . . . . . 5032 1 143 . 1 1 57 57 LYS H H 1 7.52 0.02 . 1 . . . . . . . . 5032 1 144 . 1 1 57 57 LYS CA C 13 55.5 0.10 . 1 . . . . . . . . 5032 1 145 . 1 1 57 57 LYS CB C 13 31.8 0.10 . 1 . . . . . . . . 5032 1 146 . 1 1 58 58 GLY N N 15 108.2 0.10 . 1 . . . . . . . . 5032 1 147 . 1 1 58 58 GLY H H 1 8.42 0.02 . 1 . . . . . . . . 5032 1 148 . 1 1 58 58 GLY CA C 13 46.4 0.10 . 1 . . . . . . . . 5032 1 149 . 1 1 59 59 ASP N N 15 120.0 0.10 . 1 . . . . . . . . 5032 1 150 . 1 1 59 59 ASP H H 1 8.17 0.02 . 1 . . . . . . . . 5032 1 151 . 1 1 59 59 ASP CA C 13 53.6 0.10 . 1 . . . . . . . . 5032 1 152 . 1 1 59 59 ASP CB C 13 40.3 0.10 . 1 . . . . . . . . 5032 1 153 . 1 1 63 63 SER N N 15 115.5 0.10 . 1 . . . . . . . . 5032 1 154 . 1 1 63 63 SER H H 1 7.95 0.02 . 1 . . . . . . . . 5032 1 155 . 1 1 63 63 SER CA C 13 58.7 0.10 . 1 . . . . . . . . 5032 1 156 . 1 1 63 63 SER CB C 13 64.0 0.10 . 1 . . . . . . . . 5032 1 157 . 1 1 64 64 ALA N N 15 125.2 0.10 . 1 . . . . . . . . 5032 1 158 . 1 1 64 64 ALA H H 1 7.32 0.02 . 1 . . . . . . . . 5032 1 159 . 1 1 64 64 ALA CA C 13 53.5 0.10 . 1 . . . . . . . . 5032 1 160 . 1 1 64 64 ALA CB C 13 18.4 0.10 . 1 . . . . . . . . 5032 1 161 . 1 1 65 65 GLY N N 15 110.2 0.10 . 1 . . . . . . . . 5032 1 162 . 1 1 65 65 GLY H H 1 8.53 0.02 . 1 . . . . . . . . 5032 1 163 . 1 1 65 65 GLY CA C 13 47.7 0.10 . 1 . . . . . . . . 5032 1 164 . 1 1 66 66 TRP N N 15 121.6 0.10 . 1 . . . . . . . . 5032 1 165 . 1 1 66 66 TRP H H 1 8.15 0.02 . 1 . . . . . . . . 5032 1 166 . 1 1 66 66 TRP CA C 13 58.8 0.10 . 1 . . . . . . . . 5032 1 167 . 1 1 66 66 TRP CB C 13 28.3 0.10 . 1 . . . . . . . . 5032 1 168 . 1 1 67 67 LYS N N 15 122.0 0.10 . 1 . . . . . . . . 5032 1 169 . 1 1 67 67 LYS H H 1 6.58 0.02 . 1 . . . . . . . . 5032 1 170 . 1 1 67 67 LYS CA C 13 60.4 0.10 . 1 . . . . . . . . 5032 1 171 . 1 1 68 68 ASN N N 15 119.3 0.10 . 1 . . . . . . . . 5032 1 172 . 1 1 68 68 ASN H H 1 7.33 0.02 . 1 . . . . . . . . 5032 1 173 . 1 1 68 68 ASN CA C 13 55.7 0.10 . 1 . . . . . . . . 5032 1 174 . 1 1 69 69 SER N N 15 116.5 0.10 . 1 . . . . . . . . 5032 1 175 . 1 1 69 69 SER H H 1 8.10 0.02 . 1 . . . . . . . . 5032 1 176 . 1 1 69 69 SER CA C 13 63.3 0.10 . 1 . . . . . . . . 5032 1 177 . 1 1 70 70 ILE N N 15 125.6 0.10 . 1 . . . . . . . . 5032 1 178 . 1 1 70 70 ILE H H 1 7.85 0.02 . 1 . . . . . . . . 5032 1 179 . 1 1 70 70 ILE CA C 13 64.4 0.10 . 1 . . . . . . . . 5032 1 180 . 1 1 70 70 ILE CB C 13 35.8 0.10 . 1 . . . . . . . . 5032 1 181 . 1 1 71 71 ARG N N 15 119.1 0.10 . 1 . . . . . . . . 5032 1 182 . 1 1 71 71 ARG H H 1 7.82 0.02 . 1 . . . . . . . . 5032 1 183 . 1 1 71 71 ARG CA C 13 60.6 0.10 . 1 . . . . . . . . 5032 1 184 . 1 1 71 71 ARG CB C 13 29.2 0.10 . 1 . . . . . . . . 5032 1 185 . 1 1 72 72 HIS N N 15 117.8 0.10 . 1 . . . . . . . . 5032 1 186 . 1 1 72 72 HIS H H 1 8.64 0.02 . 1 . . . . . . . . 5032 1 187 . 1 1 72 72 HIS CA C 13 59.4 0.10 . 1 . . . . . . . . 5032 1 188 . 1 1 72 72 HIS CB C 13 28.8 0.10 . 1 . . . . . . . . 5032 1 189 . 1 1 73 73 ASN N N 15 115.9 0.10 . 1 . . . . . . . . 5032 1 190 . 1 1 73 73 ASN H H 1 7.67 0.02 . 1 . . . . . . . . 5032 1 191 . 1 1 73 73 ASN CA C 13 57.7 0.10 . 1 . . . . . . . . 5032 1 192 . 1 1 73 73 ASN CB C 13 41.4 0.10 . 1 . . . . . . . . 5032 1 193 . 1 1 74 74 LEU N N 15 119.3 0.10 . 1 . . . . . . . . 5032 1 194 . 1 1 74 74 LEU H H 1 7.67 0.02 . 1 . . . . . . . . 5032 1 195 . 1 1 74 74 LEU CA C 13 57.4 0.10 . 1 . . . . . . . . 5032 1 196 . 1 1 74 74 LEU CB C 13 39.1 0.10 . 1 . . . . . . . . 5032 1 197 . 1 1 75 75 SER N N 15 109.5 0.10 . 1 . . . . . . . . 5032 1 198 . 1 1 75 75 SER H H 1 7.00 0.02 . 1 . . . . . . . . 5032 1 199 . 1 1 75 75 SER CA C 13 61.1 0.10 . 1 . . . . . . . . 5032 1 200 . 1 1 80 80 PHE CA C 13 55.6 0.10 . 1 . . . . . . . . 5032 1 201 . 1 1 80 80 PHE CB C 13 40.9 0.10 . 1 . . . . . . . . 5032 1 202 . 1 1 81 81 ILE N N 15 120.2 0.10 . 1 . . . . . . . . 5032 1 203 . 1 1 81 81 ILE H H 1 9.23 0.02 . 1 . . . . . . . . 5032 1 204 . 1 1 81 81 ILE CA C 13 59.1 0.10 . 1 . . . . . . . . 5032 1 205 . 1 1 81 81 ILE CB C 13 41.1 0.10 . 1 . . . . . . . . 5032 1 206 . 1 1 82 82 LYS N N 15 125.1 0.10 . 1 . . . . . . . . 5032 1 207 . 1 1 82 82 LYS H H 1 7.96 0.02 . 1 . . . . . . . . 5032 1 208 . 1 1 82 82 LYS CA C 13 54.2 0.10 . 1 . . . . . . . . 5032 1 209 . 1 1 82 82 LYS CB C 13 32.0 0.10 . 1 . . . . . . . . 5032 1 210 . 1 1 83 83 VAL N N 15 127.3 0.10 . 1 . . . . . . . . 5032 1 211 . 1 1 83 83 VAL H H 1 9.11 0.02 . 1 . . . . . . . . 5032 1 212 . 1 1 83 83 VAL CA C 13 60.7 0.10 . 1 . . . . . . . . 5032 1 213 . 1 1 83 83 VAL CB C 13 34.6 0.10 . 1 . . . . . . . . 5032 1 214 . 1 1 84 84 HIS N N 15 125.3 0.10 . 1 . . . . . . . . 5032 1 215 . 1 1 84 84 HIS H H 1 8.47 0.02 . 1 . . . . . . . . 5032 1 216 . 1 1 84 84 HIS CA C 13 57.1 0.10 . 1 . . . . . . . . 5032 1 217 . 1 1 84 84 HIS CB C 13 28.9 0.10 . 1 . . . . . . . . 5032 1 218 . 1 1 85 85 ASN N N 15 125.9 0.10 . 1 . . . . . . . . 5032 1 219 . 1 1 85 85 ASN H H 1 8.34 0.02 . 1 . . . . . . . . 5032 1 220 . 1 1 85 85 ASN CA C 13 52.2 0.10 . 1 . . . . . . . . 5032 1 221 . 1 1 85 85 ASN CB C 13 38.2 0.10 . 1 . . . . . . . . 5032 1 222 . 1 1 86 86 GLU CA C 13 56.7 0.10 . 1 . . . . . . . . 5032 1 223 . 1 1 87 87 ALA N N 15 124.8 0.10 . 1 . . . . . . . . 5032 1 224 . 1 1 87 87 ALA H H 1 8.21 0.02 . 1 . . . . . . . . 5032 1 225 . 1 1 87 87 ALA CA C 13 52.6 0.10 . 1 . . . . . . . . 5032 1 226 . 1 1 87 87 ALA CB C 13 18.5 0.10 . 1 . . . . . . . . 5032 1 227 . 1 1 88 88 THR N N 15 116.3 0.10 . 1 . . . . . . . . 5032 1 228 . 1 1 88 88 THR H H 1 7.82 0.02 . 1 . . . . . . . . 5032 1 229 . 1 1 88 88 THR CA C 13 62.8 0.10 . 1 . . . . . . . . 5032 1 230 . 1 1 89 89 GLY N N 15 114.2 0.10 . 1 . . . . . . . . 5032 1 231 . 1 1 89 89 GLY H H 1 8.57 0.02 . 1 . . . . . . . . 5032 1 232 . 1 1 89 89 GLY CA C 13 45.4 0.10 . 1 . . . . . . . . 5032 1 233 . 1 1 90 90 LYS N N 15 119.3 0.10 . 1 . . . . . . . . 5032 1 234 . 1 1 90 90 LYS H H 1 7.35 0.02 . 1 . . . . . . . . 5032 1 235 . 1 1 90 90 LYS CA C 13 54.1 0.10 . 1 . . . . . . . . 5032 1 236 . 1 1 90 90 LYS CB C 13 32.8 0.10 . 1 . . . . . . . . 5032 1 237 . 1 1 91 91 SER N N 15 117.2 0.10 . 1 . . . . . . . . 5032 1 238 . 1 1 91 91 SER H H 1 7.97 0.02 . 1 . . . . . . . . 5032 1 239 . 1 1 91 91 SER CA C 13 58.4 0.10 . 1 . . . . . . . . 5032 1 240 . 1 1 91 91 SER CB C 13 63.1 0.10 . 1 . . . . . . . . 5032 1 241 . 1 1 92 92 SER N N 15 112.8 0.10 . 1 . . . . . . . . 5032 1 242 . 1 1 92 92 SER H H 1 8.02 0.02 . 1 . . . . . . . . 5032 1 243 . 1 1 92 92 SER CA C 13 60.1 0.10 . 1 . . . . . . . . 5032 1 244 . 1 1 92 92 SER CB C 13 63.4 0.10 . 1 . . . . . . . . 5032 1 245 . 1 1 93 93 TRP N N 15 120.0 0.10 . 1 . . . . . . . . 5032 1 246 . 1 1 93 93 TRP H H 1 8.31 0.02 . 1 . . . . . . . . 5032 1 247 . 1 1 93 93 TRP CA C 13 56.3 0.10 . 1 . . . . . . . . 5032 1 248 . 1 1 93 93 TRP CB C 13 31.5 0.10 . 1 . . . . . . . . 5032 1 249 . 1 1 94 94 TRP N N 15 123.8 0.10 . 1 . . . . . . . . 5032 1 250 . 1 1 94 94 TRP H H 1 9.04 0.02 . 1 . . . . . . . . 5032 1 251 . 1 1 94 94 TRP CA C 13 56.5 0.10 . 1 . . . . . . . . 5032 1 252 . 1 1 94 94 TRP CB C 13 30.0 0.10 . 1 . . . . . . . . 5032 1 253 . 1 1 95 95 MET N N 15 118.5 0.10 . 1 . . . . . . . . 5032 1 254 . 1 1 95 95 MET H H 1 8.98 0.02 . 1 . . . . . . . . 5032 1 255 . 1 1 95 95 MET CA C 13 54.0 0.10 . 1 . . . . . . . . 5032 1 256 . 1 1 95 95 MET CB C 13 37.3 0.10 . 1 . . . . . . . . 5032 1 257 . 1 1 96 96 LEU N N 15 120.9 0.10 . 1 . . . . . . . . 5032 1 258 . 1 1 96 96 LEU H H 1 9.13 0.02 . 1 . . . . . . . . 5032 1 259 . 1 1 96 96 LEU CA C 13 54.2 0.10 . 1 . . . . . . . . 5032 1 260 . 1 1 96 96 LEU CB C 13 41.1 0.10 . 1 . . . . . . . . 5032 1 261 . 1 1 98 98 PRO CA C 13 63.8 0.10 . 1 . . . . . . . . 5032 1 262 . 1 1 98 98 PRO CB C 13 31.6 0.10 . 1 . . . . . . . . 5032 1 263 . 1 1 99 99 GLU N N 15 118.3 0.10 . 1 . . . . . . . . 5032 1 264 . 1 1 99 99 GLU H H 1 7.82 0.02 . 1 . . . . . . . . 5032 1 265 . 1 1 99 99 GLU CA C 13 56.1 0.10 . 1 . . . . . . . . 5032 1 266 . 1 1 99 99 GLU CB C 13 29.3 0.10 . 1 . . . . . . . . 5032 1 267 . 1 1 100 100 GLY N N 15 108.9 0.10 . 1 . . . . . . . . 5032 1 268 . 1 1 100 100 GLY H H 1 7.89 0.02 . 1 . . . . . . . . 5032 1 269 . 1 1 100 100 GLY CA C 13 45.3 0.10 . 1 . . . . . . . . 5032 1 270 . 1 1 101 101 GLY N N 15 108.7 0.10 . 1 . . . . . . . . 5032 1 271 . 1 1 101 101 GLY H H 1 8.06 0.02 . 1 . . . . . . . . 5032 1 272 . 1 1 101 101 GLY CA C 13 45.1 0.10 . 1 . . . . . . . . 5032 1 273 . 1 1 102 102 LYS N N 15 121.0 0.10 . 1 . . . . . . . . 5032 1 274 . 1 1 102 102 LYS H H 1 8.07 0.02 . 1 . . . . . . . . 5032 1 275 . 1 1 102 102 LYS CA C 13 56.2 0.10 . 1 . . . . . . . . 5032 1 276 . 1 1 102 102 LYS CB C 13 32.3 0.10 . 1 . . . . . . . . 5032 1 277 . 1 1 103 103 SER N N 15 117.0 0.10 . 1 . . . . . . . . 5032 1 278 . 1 1 103 103 SER H H 1 8.29 0.02 . 1 . . . . . . . . 5032 1 279 . 1 1 103 103 SER CA C 13 58.3 0.10 . 1 . . . . . . . . 5032 1 280 . 1 1 103 103 SER CB C 13 63.7 0.10 . 1 . . . . . . . . 5032 1 281 . 1 1 104 104 GLY N N 15 111.5 0.10 . 1 . . . . . . . . 5032 1 282 . 1 1 104 104 GLY H H 1 8.35 0.02 . 1 . . . . . . . . 5032 1 283 . 1 1 104 104 GLY CA C 13 45.0 0.10 . 1 . . . . . . . . 5032 1 284 . 1 1 105 105 LYS N N 15 121.1 0.10 . 1 . . . . . . . . 5032 1 285 . 1 1 105 105 LYS H H 1 8.07 0.02 . 1 . . . . . . . . 5032 1 286 . 1 1 105 105 LYS CA C 13 55.6 0.10 . 1 . . . . . . . . 5032 1 287 . 1 1 105 105 LYS CB C 13 32.5 0.10 . 1 . . . . . . . . 5032 1 288 . 1 1 106 106 ALA N N 15 127.3 0.10 . 1 . . . . . . . . 5032 1 289 . 1 1 106 106 ALA H H 1 8.22 0.02 . 1 . . . . . . . . 5032 1 290 . 1 1 106 106 ALA CA C 13 50.3 0.10 . 1 . . . . . . . . 5032 1 291 . 1 1 106 106 ALA CB C 13 17.7 0.10 . 1 . . . . . . . . 5032 1 292 . 1 1 107 107 PRO CA C 13 63.0 0.10 . 1 . . . . . . . . 5032 1 293 . 1 1 107 107 PRO CB C 13 38.4 0.10 . 1 . . . . . . . . 5032 1 294 . 1 1 108 108 ARG N N 15 126.4 0.10 . 1 . . . . . . . . 5032 1 295 . 1 1 108 108 ARG H H 1 7.81 0.02 . 1 . . . . . . . . 5032 1 296 . 1 1 108 108 ARG CA C 13 57.1 0.10 . 1 . . . . . . . . 5032 1 297 . 1 1 108 108 ARG CB C 13 31.0 0.10 . 1 . . . . . . . . 5032 1 stop_ save_