data_26834 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26834 _Entry.Title ; N-terminal domain of chicken (gallus gallus) PARP-3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-06-23 _Entry.Accession_date 2016-06-23 _Entry.Last_release_date 2016-08-31 _Entry.Original_release_date 2016-08-31 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Luis Polo . M. . . 26834 2 Yingqi Xu . J. . . 26834 3 Stephen Matthews . J. . . 26834 4 Laurence Pearl . H. . . 26834 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Imperial College London' . 26834 2 . 'University Of Sussex' . 26834 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26834 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 556 26834 '15N chemical shifts' 141 26834 '1H chemical shifts' 142 26834 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-08-31 . original BMRB . 26834 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26834 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27530147 _Citation.Full_citation . _Citation.Title ; PARP3 is a sensor of nicked nucleosomes and monoribosylates histone H2B(Glu2) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. commun.' _Citation.Journal_name_full . _Citation.Journal_volume 7 _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 12404 _Citation.Page_last 12404 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Gabrielle Grundy . . . . 26834 1 2 Luis Polo . M. . . 26834 1 3 Zhihong Zeng . . . . 26834 1 4 Stuart Rulten . . . . 26834 1 5 Nicolas Hoch . . . . 26834 1 6 Pathompong Paomephan . . . . 26834 1 7 Yingqi Xu . . . . 26834 1 8 Steve Sweet . . . . 26834 1 9 Alan Thorne . . . . 26834 1 10 Antony Oliver . W. . . 26834 1 11 Stephen Matthews . . . . 26834 1 12 Laurence Pearl . H. . . 26834 1 13 Keith Caldecott . . . . 26834 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID ADP-ribose 26834 1 Cancer 26834 1 DNA-repair 26834 1 NHEJ 26834 1 PARP 26834 1 Polymerase 26834 1 SSB 26834 1 'Single Strand Break' 26834 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26834 _Assembly.ID 1 _Assembly.Name 'PARP3 NTD' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 18811 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PARP3 NTD' 1 $PARP3_NTD A . yes native no no . . . 26834 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2eoc . . 'solution NMR' . . . 26834 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PARP3_NTD _Entity.Sf_category entity _Entity.Sf_framecode PARP3_NTD _Entity.Entry_ID 26834 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PARP3_NTD _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(D) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MHHHHHHSSGVDLGTWSHPQ FEKENLYFQSMAPKRRAPPA SQPADGGKKAKGGQEEEEDA WSSALNALKTAPREKPPATI DGQCPLSAGPDAKVYEDYDC TLNQTNISANNNKFYIIQLI EHGGTYSTWNRWGRVGEVGQ SKLLPFTSLEAAKKDFEKKF WEKTKNRWAARDNFVAQPGK YTLIEVQPGAGQEVALRVDG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 200 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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_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 . yes UNP E1BSI0 . PARP3 . . . . . . . . . . . . . . 26834 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Involved in both single and double strand break DNA-repair. PARP3 is a sensor of nicked nucleosomes.' 26834 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 -29 MET . 26834 1 2 -28 HIS . 26834 1 3 -27 HIS . 26834 1 4 -26 HIS . 26834 1 5 -25 HIS . 26834 1 6 -24 HIS . 26834 1 7 -23 HIS . 26834 1 8 -22 SER . 26834 1 9 -21 SER . 26834 1 10 -20 GLY . 26834 1 11 -19 VAL . 26834 1 12 -18 ASP . 26834 1 13 -17 LEU . 26834 1 14 -16 GLY . 26834 1 15 -15 THR . 26834 1 16 -14 TRP . 26834 1 17 -13 SER . 26834 1 18 -12 HIS . 26834 1 19 -11 PRO . 26834 1 20 -10 GLN . 26834 1 21 -9 PHE . 26834 1 22 -8 GLU . 26834 1 23 -7 LYS . 26834 1 24 -6 GLU . 26834 1 25 -5 ASN . 26834 1 26 -4 LEU . 26834 1 27 -3 TYR . 26834 1 28 -2 PHE . 26834 1 29 -1 GLN . 26834 1 30 0 SER . 26834 1 31 1 MET . 26834 1 32 2 ALA . 26834 1 33 3 PRO . 26834 1 34 4 LYS . 26834 1 35 5 ARG . 26834 1 36 6 ARG . 26834 1 37 7 ALA . 26834 1 38 8 PRO . 26834 1 39 9 PRO . 26834 1 40 10 ALA . 26834 1 41 11 SER . 26834 1 42 12 GLN . 26834 1 43 13 PRO . 26834 1 44 14 ALA . 26834 1 45 15 ASP . 26834 1 46 16 GLY . 26834 1 47 17 GLY . 26834 1 48 18 LYS . 26834 1 49 19 LYS . 26834 1 50 20 ALA . 26834 1 51 21 LYS . 26834 1 52 22 GLY . 26834 1 53 23 GLY . 26834 1 54 24 GLN . 26834 1 55 25 GLU . 26834 1 56 26 GLU . 26834 1 57 27 GLU . 26834 1 58 28 GLU . 26834 1 59 29 ASP . 26834 1 60 30 ALA . 26834 1 61 31 TRP . 26834 1 62 32 SER . 26834 1 63 33 SER . 26834 1 64 34 ALA . 26834 1 65 35 LEU . 26834 1 66 36 ASN . 26834 1 67 37 ALA . 26834 1 68 38 LEU . 26834 1 69 39 LYS . 26834 1 70 40 THR . 26834 1 71 41 ALA . 26834 1 72 42 PRO . 26834 1 73 43 ARG . 26834 1 74 44 GLU . 26834 1 75 45 LYS . 26834 1 76 46 PRO . 26834 1 77 47 PRO . 26834 1 78 48 ALA . 26834 1 79 49 THR . 26834 1 80 50 ILE . 26834 1 81 51 ASP . 26834 1 82 52 GLY . 26834 1 83 53 GLN . 26834 1 84 54 CYS . 26834 1 85 55 PRO . 26834 1 86 56 LEU . 26834 1 87 57 SER . 26834 1 88 58 ALA . 26834 1 89 59 GLY . 26834 1 90 60 PRO . 26834 1 91 61 ASP . 26834 1 92 62 ALA . 26834 1 93 63 LYS . 26834 1 94 64 VAL . 26834 1 95 65 TYR . 26834 1 96 66 GLU . 26834 1 97 67 ASP . 26834 1 98 68 TYR . 26834 1 99 69 ASP . 26834 1 100 70 CYS . 26834 1 101 71 THR . 26834 1 102 72 LEU . 26834 1 103 73 ASN . 26834 1 104 74 GLN . 26834 1 105 75 THR . 26834 1 106 76 ASN . 26834 1 107 77 ILE . 26834 1 108 78 SER . 26834 1 109 79 ALA . 26834 1 110 80 ASN . 26834 1 111 81 ASN . 26834 1 112 82 ASN . 26834 1 113 83 LYS . 26834 1 114 84 PHE . 26834 1 115 85 TYR . 26834 1 116 86 ILE . 26834 1 117 87 ILE . 26834 1 118 88 GLN . 26834 1 119 89 LEU . 26834 1 120 90 ILE . 26834 1 121 91 GLU . 26834 1 122 92 HIS . 26834 1 123 93 GLY . 26834 1 124 94 GLY . 26834 1 125 95 THR . 26834 1 126 96 TYR . 26834 1 127 97 SER . 26834 1 128 98 THR . 26834 1 129 99 TRP . 26834 1 130 100 ASN . 26834 1 131 101 ARG . 26834 1 132 102 TRP . 26834 1 133 103 GLY . 26834 1 134 104 ARG . 26834 1 135 105 VAL . 26834 1 136 106 GLY . 26834 1 137 107 GLU . 26834 1 138 108 VAL . 26834 1 139 109 GLY . 26834 1 140 110 GLN . 26834 1 141 111 SER . 26834 1 142 112 LYS . 26834 1 143 113 LEU . 26834 1 144 114 LEU . 26834 1 145 115 PRO . 26834 1 146 116 PHE . 26834 1 147 117 THR . 26834 1 148 118 SER . 26834 1 149 119 LEU . 26834 1 150 120 GLU . 26834 1 151 121 ALA . 26834 1 152 122 ALA . 26834 1 153 123 LYS . 26834 1 154 124 LYS . 26834 1 155 125 ASP . 26834 1 156 126 PHE . 26834 1 157 127 GLU . 26834 1 158 128 LYS . 26834 1 159 129 LYS . 26834 1 160 130 PHE . 26834 1 161 131 TRP . 26834 1 162 132 GLU . 26834 1 163 133 LYS . 26834 1 164 134 THR . 26834 1 165 135 LYS . 26834 1 166 136 ASN . 26834 1 167 137 ARG . 26834 1 168 138 TRP . 26834 1 169 139 ALA . 26834 1 170 140 ALA . 26834 1 171 141 ARG . 26834 1 172 142 ASP . 26834 1 173 143 ASN . 26834 1 174 144 PHE . 26834 1 175 145 VAL . 26834 1 176 146 ALA . 26834 1 177 147 GLN . 26834 1 178 148 PRO . 26834 1 179 149 GLY . 26834 1 180 150 LYS . 26834 1 181 151 TYR . 26834 1 182 152 THR . 26834 1 183 153 LEU . 26834 1 184 154 ILE . 26834 1 185 155 GLU . 26834 1 186 156 VAL . 26834 1 187 157 GLN . 26834 1 188 158 PRO . 26834 1 189 159 GLY . 26834 1 190 160 ALA . 26834 1 191 161 GLY . 26834 1 192 162 GLN . 26834 1 193 163 GLU . 26834 1 194 164 VAL . 26834 1 195 165 ALA . 26834 1 196 166 LEU . 26834 1 197 167 ARG . 26834 1 198 168 VAL . 26834 1 199 169 ASP . 26834 1 200 170 GLY . 26834 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 26834 1 . HIS 2 2 26834 1 . HIS 3 3 26834 1 . HIS 4 4 26834 1 . HIS 5 5 26834 1 . HIS 6 6 26834 1 . HIS 7 7 26834 1 . SER 8 8 26834 1 . SER 9 9 26834 1 . GLY 10 10 26834 1 . VAL 11 11 26834 1 . ASP 12 12 26834 1 . LEU 13 13 26834 1 . GLY 14 14 26834 1 . THR 15 15 26834 1 . TRP 16 16 26834 1 . SER 17 17 26834 1 . HIS 18 18 26834 1 . PRO 19 19 26834 1 . GLN 20 20 26834 1 . PHE 21 21 26834 1 . GLU 22 22 26834 1 . LYS 23 23 26834 1 . GLU 24 24 26834 1 . ASN 25 25 26834 1 . LEU 26 26 26834 1 . TYR 27 27 26834 1 . PHE 28 28 26834 1 . GLN 29 29 26834 1 . SER 30 30 26834 1 . MET 31 31 26834 1 . ALA 32 32 26834 1 . PRO 33 33 26834 1 . LYS 34 34 26834 1 . ARG 35 35 26834 1 . ARG 36 36 26834 1 . ALA 37 37 26834 1 . PRO 38 38 26834 1 . PRO 39 39 26834 1 . ALA 40 40 26834 1 . SER 41 41 26834 1 . GLN 42 42 26834 1 . PRO 43 43 26834 1 . ALA 44 44 26834 1 . ASP 45 45 26834 1 . GLY 46 46 26834 1 . GLY 47 47 26834 1 . LYS 48 48 26834 1 . LYS 49 49 26834 1 . ALA 50 50 26834 1 . LYS 51 51 26834 1 . GLY 52 52 26834 1 . GLY 53 53 26834 1 . GLN 54 54 26834 1 . GLU 55 55 26834 1 . GLU 56 56 26834 1 . GLU 57 57 26834 1 . GLU 58 58 26834 1 . ASP 59 59 26834 1 . ALA 60 60 26834 1 . TRP 61 61 26834 1 . SER 62 62 26834 1 . SER 63 63 26834 1 . ALA 64 64 26834 1 . LEU 65 65 26834 1 . ASN 66 66 26834 1 . ALA 67 67 26834 1 . LEU 68 68 26834 1 . LYS 69 69 26834 1 . THR 70 70 26834 1 . ALA 71 71 26834 1 . PRO 72 72 26834 1 . ARG 73 73 26834 1 . GLU 74 74 26834 1 . LYS 75 75 26834 1 . PRO 76 76 26834 1 . PRO 77 77 26834 1 . ALA 78 78 26834 1 . THR 79 79 26834 1 . ILE 80 80 26834 1 . ASP 81 81 26834 1 . GLY 82 82 26834 1 . GLN 83 83 26834 1 . CYS 84 84 26834 1 . PRO 85 85 26834 1 . LEU 86 86 26834 1 . SER 87 87 26834 1 . ALA 88 88 26834 1 . GLY 89 89 26834 1 . PRO 90 90 26834 1 . ASP 91 91 26834 1 . ALA 92 92 26834 1 . LYS 93 93 26834 1 . VAL 94 94 26834 1 . TYR 95 95 26834 1 . GLU 96 96 26834 1 . ASP 97 97 26834 1 . TYR 98 98 26834 1 . ASP 99 99 26834 1 . CYS 100 100 26834 1 . THR 101 101 26834 1 . LEU 102 102 26834 1 . ASN 103 103 26834 1 . GLN 104 104 26834 1 . THR 105 105 26834 1 . ASN 106 106 26834 1 . ILE 107 107 26834 1 . SER 108 108 26834 1 . ALA 109 109 26834 1 . ASN 110 110 26834 1 . ASN 111 111 26834 1 . ASN 112 112 26834 1 . LYS 113 113 26834 1 . PHE 114 114 26834 1 . TYR 115 115 26834 1 . ILE 116 116 26834 1 . ILE 117 117 26834 1 . GLN 118 118 26834 1 . LEU 119 119 26834 1 . ILE 120 120 26834 1 . GLU 121 121 26834 1 . HIS 122 122 26834 1 . GLY 123 123 26834 1 . GLY 124 124 26834 1 . THR 125 125 26834 1 . TYR 126 126 26834 1 . SER 127 127 26834 1 . THR 128 128 26834 1 . TRP 129 129 26834 1 . ASN 130 130 26834 1 . ARG 131 131 26834 1 . TRP 132 132 26834 1 . GLY 133 133 26834 1 . ARG 134 134 26834 1 . VAL 135 135 26834 1 . GLY 136 136 26834 1 . GLU 137 137 26834 1 . VAL 138 138 26834 1 . GLY 139 139 26834 1 . GLN 140 140 26834 1 . SER 141 141 26834 1 . LYS 142 142 26834 1 . LEU 143 143 26834 1 . LEU 144 144 26834 1 . PRO 145 145 26834 1 . PHE 146 146 26834 1 . THR 147 147 26834 1 . SER 148 148 26834 1 . LEU 149 149 26834 1 . GLU 150 150 26834 1 . ALA 151 151 26834 1 . ALA 152 152 26834 1 . LYS 153 153 26834 1 . LYS 154 154 26834 1 . ASP 155 155 26834 1 . PHE 156 156 26834 1 . GLU 157 157 26834 1 . LYS 158 158 26834 1 . LYS 159 159 26834 1 . PHE 160 160 26834 1 . TRP 161 161 26834 1 . GLU 162 162 26834 1 . LYS 163 163 26834 1 . THR 164 164 26834 1 . LYS 165 165 26834 1 . ASN 166 166 26834 1 . ARG 167 167 26834 1 . TRP 168 168 26834 1 . ALA 169 169 26834 1 . ALA 170 170 26834 1 . ARG 171 171 26834 1 . ASP 172 172 26834 1 . ASN 173 173 26834 1 . PHE 174 174 26834 1 . VAL 175 175 26834 1 . ALA 176 176 26834 1 . GLN 177 177 26834 1 . PRO 178 178 26834 1 . GLY 179 179 26834 1 . LYS 180 180 26834 1 . TYR 181 181 26834 1 . THR 182 182 26834 1 . LEU 183 183 26834 1 . ILE 184 184 26834 1 . GLU 185 185 26834 1 . VAL 186 186 26834 1 . GLN 187 187 26834 1 . PRO 188 188 26834 1 . GLY 189 189 26834 1 . ALA 190 190 26834 1 . GLY 191 191 26834 1 . GLN 192 192 26834 1 . GLU 193 193 26834 1 . VAL 194 194 26834 1 . ALA 195 195 26834 1 . LEU 196 196 26834 1 . ARG 197 197 26834 1 . VAL 198 198 26834 1 . ASP 199 199 26834 1 . GLY 200 200 26834 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26834 _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 $PARP3_NTD . 9031 organism . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . 26834 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 26834 _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 $PARP3_NTD . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pNIC28-BSA1 . . . 26834 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26834 _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 'PARP3 NTD' '[U-100% 13C; U-100% 15N]' . . 1 $PARP3_NTD . . 0.3 . . mM . . . . 26834 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26834 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26834 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 26834 _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' 0.1 . M 26834 1 pH 7.5 . pH 26834 1 pressure 1 . atm 26834 1 temperature 298 . K 26834 1 stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 26834 _Software.ID 1 _Software.Name CCPN _Software.Version 2.4.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 26834 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26834 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 26834 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Ascend _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 26834 _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 Ascend . 600 . . . 26834 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 26834 _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 . . . . . . . . . . . . . . . . 26834 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26834 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26834 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26834 1 5 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26834 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26834 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 26834 _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 internal indirect 0.25144953 . . . . . 26834 1 H 1 water protons . . . . ppm 4.772 internal direct 1 . . . . . 26834 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329112 . . . . . 26834 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 26834 _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' . . . 26834 1 2 '3D HNCO' . . . 26834 1 3 '3D HNCACB' . . . 26834 1 4 '3D CBCA(CO)NH' . . . 26834 1 5 '3D C(CO)NH' . . . 26834 1 6 '3D HN(CA)CO' . . . 26834 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CCPN . . 26834 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 31 31 MET C C 13 175.505 . . . . . . . 1 MET C . 26834 1 2 . 1 1 31 31 MET CA C 13 55.305 . . . . . . . 1 MET CA . 26834 1 3 . 1 1 31 31 MET CB C 13 33.165 . . . . . . . 1 MET CB . 26834 1 4 . 1 1 32 32 ALA H H 1 8.446 . . . . . . . 2 ALA HN . 26834 1 5 . 1 1 32 32 ALA CA C 13 50.779 . . . . . . . 2 ALA CA . 26834 1 6 . 1 1 32 32 ALA CB C 13 18.147 . . . . . . . 2 ALA CB . 26834 1 7 . 1 1 32 32 ALA N N 15 127.362 . . . . . . . 2 ALA N . 26834 1 8 . 1 1 35 35 ARG C C 13 176.051 . . . . . . . 5 ARG C . 26834 1 9 . 1 1 35 35 ARG CA C 13 55.944 . . . . . . . 5 ARG CA . 26834 1 10 . 1 1 35 35 ARG CB C 13 31.062 . . . . . . . 5 ARG CB . 26834 1 11 . 1 1 35 35 ARG CG C 13 27.085 . . . . . . . 5 ARG CG . 26834 1 12 . 1 1 35 35 ARG CD C 13 43.518 . . . . . . . 5 ARG CD . 26834 1 13 . 1 1 36 36 ARG H H 1 8.465 . . . . . . . 6 ARG HN . 26834 1 14 . 1 1 36 36 ARG C C 13 175.549 . . . . . . . 6 ARG C . 26834 1 15 . 1 1 36 36 ARG CA C 13 55.944 . . . . . . . 6 ARG CA . 26834 1 16 . 1 1 36 36 ARG CG C 13 27.033 . . . . . . . 6 ARG CG . 26834 1 17 . 1 1 36 36 ARG CD C 13 43.475 . . . . . . . 6 ARG CD . 26834 1 18 . 1 1 36 36 ARG N N 15 123.501 . . . . . . . 6 ARG N . 26834 1 19 . 1 1 37 37 ALA H H 1 8.403 . . . . . . . 7 ALA HN . 26834 1 20 . 1 1 37 37 ALA C C 13 174.898 . . . . . . . 7 ALA C . 26834 1 21 . 1 1 37 37 ALA CA C 13 50.589 . . . . . . . 7 ALA CA . 26834 1 22 . 1 1 37 37 ALA CB C 13 18.161 . . . . . . . 7 ALA CB . 26834 1 23 . 1 1 37 37 ALA N N 15 127.314 . . . . . . . 7 ALA N . 26834 1 24 . 1 1 39 39 PRO C C 13 176.716 . . . . . . . 9 PRO C . 26834 1 25 . 1 1 39 39 PRO CA C 13 62.978 . . . . . . . 9 PRO CA . 26834 1 26 . 1 1 39 39 PRO CB C 13 32.007 . . . . . . . 9 PRO CB . 26834 1 27 . 1 1 39 39 PRO CG C 13 27.427 . . . . . . . 9 PRO CG . 26834 1 28 . 1 1 39 39 PRO CD C 13 50.553 . . . . . . . 9 PRO CD . 26834 1 29 . 1 1 40 40 ALA H H 1 8.441 . . . . . . . 10 ALA HN . 26834 1 30 . 1 1 40 40 ALA C C 13 177.822 . . . . . . . 10 ALA C . 26834 1 31 . 1 1 40 40 ALA CA C 13 52.606 . . . . . . . 10 ALA CA . 26834 1 32 . 1 1 40 40 ALA CB C 13 19.211 . . . . . . . 10 ALA CB . 26834 1 33 . 1 1 40 40 ALA N N 15 124.188 . . . . . . . 10 ALA N . 26834 1 34 . 1 1 41 41 SER H H 1 8.255 . . . . . . . 11 SER HN . 26834 1 35 . 1 1 41 41 SER C C 13 174.046 . . . . . . . 11 SER C . 26834 1 36 . 1 1 41 41 SER CA C 13 58.273 . . . . . . . 11 SER CA . 26834 1 37 . 1 1 41 41 SER CB C 13 63.996 . . . . . . . 11 SER CB . 26834 1 38 . 1 1 41 41 SER N N 15 114.775 . . . . . . . 11 SER N . 26834 1 39 . 1 1 42 42 GLN CA C 13 53.729 . . . . . . . 12 GLN CA . 26834 1 40 . 1 1 42 42 GLN CB C 13 29.113 . . . . . . . 12 GLN CB . 26834 1 41 . 1 1 42 42 GLN N N 15 122.783 . . . . . . . 12 GLN N . 26834 1 42 . 1 1 43 43 PRO C C 13 176.993 . . . . . . . 13 PRO C . 26834 1 43 . 1 1 43 43 PRO CA C 13 63.214 . . . . . . . 13 PRO CA . 26834 1 44 . 1 1 43 43 PRO CB C 13 32.140 . . . . . . . 13 PRO CB . 26834 1 45 . 1 1 43 43 PRO CG C 13 27.507 . . . . . . . 13 PRO CG . 26834 1 46 . 1 1 44 44 ALA H H 1 8.550 . . . . . . . 14 ALA HN . 26834 1 47 . 1 1 44 44 ALA C C 13 177.737 . . . . . . . 14 ALA C . 26834 1 48 . 1 1 44 44 ALA CA C 13 52.766 . . . . . . . 14 ALA CA . 26834 1 49 . 1 1 44 44 ALA CB C 13 19.083 . . . . . . . 14 ALA CB . 26834 1 50 . 1 1 44 44 ALA N N 15 124.703 . . . . . . . 14 ALA N . 26834 1 51 . 1 1 45 45 ASP H H 1 8.303 . . . . . . . 15 ASP HN . 26834 1 52 . 1 1 45 45 ASP C C 13 177.041 . . . . . . . 15 ASP C . 26834 1 53 . 1 1 45 45 ASP CA C 13 54.296 . . . . . . . 15 ASP CA . 26834 1 54 . 1 1 45 45 ASP CB C 13 41.299 . . . . . . . 15 ASP CB . 26834 1 55 . 1 1 45 45 ASP N N 15 119.070 . . . . . . . 15 ASP N . 26834 1 56 . 1 1 46 46 GLY H H 1 8.369 . . . . . . . 16 GLY HN . 26834 1 57 . 1 1 46 46 GLY C C 13 175.024 . . . . . . . 16 GLY C . 26834 1 58 . 1 1 46 46 GLY CA C 13 45.728 . . . . . . . 16 GLY CA . 26834 1 59 . 1 1 46 46 GLY N N 15 109.403 . . . . . . . 16 GLY N . 26834 1 60 . 1 1 47 47 GLY H H 1 8.404 . . . . . . . 17 GLY HN . 26834 1 61 . 1 1 47 47 GLY C C 13 174.258 . . . . . . . 17 GLY C . 26834 1 62 . 1 1 47 47 GLY CA C 13 45.377 . . . . . . . 17 GLY CA . 26834 1 63 . 1 1 47 47 GLY N N 15 108.696 . . . . . . . 17 GLY N . 26834 1 64 . 1 1 48 48 LYS H H 1 8.122 . . . . . . . 18 LYS HN . 26834 1 65 . 1 1 48 48 LYS C C 13 176.729 . . . . . . . 18 LYS C . 26834 1 66 . 1 1 48 48 LYS CA C 13 56.493 . . . . . . . 18 LYS CA . 26834 1 67 . 1 1 48 48 LYS CB C 13 33.029 . . . . . . . 18 LYS CB . 26834 1 68 . 1 1 48 48 LYS N N 15 120.813 . . . . . . . 18 LYS N . 26834 1 69 . 1 1 49 49 LYS H H 1 8.367 . . . . . . . 19 LYS HN . 26834 1 70 . 1 1 49 49 LYS CA C 13 56.304 . . . . . . . 19 LYS CA . 26834 1 71 . 1 1 49 49 LYS N N 15 122.677 . . . . . . . 19 LYS N . 26834 1 72 . 1 1 50 50 ALA H H 1 8.355 . . . . . . . 20 ALA HN . 26834 1 73 . 1 1 50 50 ALA C C 13 177.759 . . . . . . . 20 ALA C . 26834 1 74 . 1 1 50 50 ALA CA C 13 52.542 . . . . . . . 20 ALA CA . 26834 1 75 . 1 1 50 50 ALA CB C 13 19.313 . . . . . . . 20 ALA CB . 26834 1 76 . 1 1 50 50 ALA N N 15 125.638 . . . . . . . 20 ALA N . 26834 1 77 . 1 1 51 51 LYS H H 1 8.385 . . . . . . . 21 LYS HN . 26834 1 78 . 1 1 51 51 LYS C C 13 177.216 . . . . . . . 21 LYS C . 26834 1 79 . 1 1 51 51 LYS CA C 13 56.551 . . . . . . . 21 LYS CA . 26834 1 80 . 1 1 51 51 LYS CB C 13 33.080 . . . . . . . 21 LYS CB . 26834 1 81 . 1 1 51 51 LYS CG C 13 24.715 . . . . . . . 21 LYS CG . 26834 1 82 . 1 1 51 51 LYS CD C 13 29.055 . . . . . . . 21 LYS CD . 26834 1 83 . 1 1 51 51 LYS CE C 13 42.230 . . . . . . . 21 LYS CE . 26834 1 84 . 1 1 51 51 LYS N N 15 120.955 . . . . . . . 21 LYS N . 26834 1 85 . 1 1 52 52 GLY H H 1 8.502 . . . . . . . 22 GLY HN . 26834 1 86 . 1 1 52 52 GLY C C 13 174.687 . . . . . . . 22 GLY C . 26834 1 87 . 1 1 52 52 GLY CA C 13 45.431 . . . . . . . 22 GLY CA . 26834 1 88 . 1 1 52 52 GLY N N 15 110.337 . . . . . . . 22 GLY N . 26834 1 89 . 1 1 53 53 GLY H H 1 8.408 . . . . . . . 23 GLY HN . 26834 1 90 . 1 1 53 53 GLY C C 13 174.351 . . . . . . . 23 GLY C . 26834 1 91 . 1 1 53 53 GLY CA C 13 45.351 . . . . . . . 23 GLY CA . 26834 1 92 . 1 1 53 53 GLY N N 15 109.016 . . . . . . . 23 GLY N . 26834 1 93 . 1 1 54 54 GLN H H 1 8.376 . . . . . . . 24 GLN HN . 26834 1 94 . 1 1 54 54 GLN C C 13 176.185 . . . . . . . 24 GLN C . 26834 1 95 . 1 1 54 54 GLN CA C 13 56.150 . . . . . . . 24 GLN CA . 26834 1 96 . 1 1 54 54 GLN CB C 13 29.422 . . . . . . . 24 GLN CB . 26834 1 97 . 1 1 54 54 GLN CG C 13 33.944 . . . . . . . 24 GLN CG . 26834 1 98 . 1 1 54 54 GLN N N 15 119.930 . . . . . . . 24 GLN N . 26834 1 99 . 1 1 55 55 GLU H H 1 8.636 . . . . . . . 25 GLU HN . 26834 1 100 . 1 1 55 55 GLU C C 13 176.670 . . . . . . . 25 GLU C . 26834 1 101 . 1 1 55 55 GLU CA C 13 57.121 . . . . . . . 25 GLU CA . 26834 1 102 . 1 1 55 55 GLU CB C 13 30.033 . . . . . . . 25 GLU CB . 26834 1 103 . 1 1 55 55 GLU CG C 13 36.412 . . . . . . . 25 GLU CG . 26834 1 104 . 1 1 55 55 GLU N N 15 121.721 . . . . . . . 25 GLU N . 26834 1 105 . 1 1 56 56 GLU H H 1 8.435 . . . . . . . 26 GLU HN . 26834 1 106 . 1 1 56 56 GLU CA C 13 56.487 . . . . . . . 26 GLU CA . 26834 1 107 . 1 1 56 56 GLU CB C 13 30.316 . . . . . . . 26 GLU CB . 26834 1 108 . 1 1 56 56 GLU N N 15 121.217 . . . . . . . 26 GLU N . 26834 1 109 . 1 1 57 57 GLU C C 13 176.682 . . . . . . . 27 GLU C . 26834 1 110 . 1 1 57 57 GLU CA C 13 56.653 . . . . . . . 27 GLU CA . 26834 1 111 . 1 1 57 57 GLU CB C 13 30.420 . . . . . . . 27 GLU CB . 26834 1 112 . 1 1 57 57 GLU CG C 13 36.361 . . . . . . . 27 GLU CG . 26834 1 113 . 1 1 58 58 GLU H H 1 8.426 . . . . . . . 28 GLU HN . 26834 1 114 . 1 1 58 58 GLU C C 13 176.479 . . . . . . . 28 GLU C . 26834 1 115 . 1 1 58 58 GLU CA C 13 56.863 . . . . . . . 28 GLU CA . 26834 1 116 . 1 1 58 58 GLU CB C 13 30.415 . . . . . . . 28 GLU CB . 26834 1 117 . 1 1 58 58 GLU CG C 13 36.283 . . . . . . . 28 GLU CG . 26834 1 118 . 1 1 58 58 GLU N N 15 121.901 . . . . . . . 28 GLU N . 26834 1 119 . 1 1 59 59 ASP H H 1 8.404 . . . . . . . 29 ASP HN . 26834 1 120 . 1 1 59 59 ASP C C 13 176.527 . . . . . . . 29 ASP C . 26834 1 121 . 1 1 59 59 ASP CA C 13 54.538 . . . . . . . 29 ASP CA . 26834 1 122 . 1 1 59 59 ASP CB C 13 41.171 . . . . . . . 29 ASP CB . 26834 1 123 . 1 1 59 59 ASP N N 15 121.377 . . . . . . . 29 ASP N . 26834 1 124 . 1 1 60 60 ALA H H 1 8.192 . . . . . . . 30 ALA HN . 26834 1 125 . 1 1 60 60 ALA C C 13 178.329 . . . . . . . 30 ALA C . 26834 1 126 . 1 1 60 60 ALA CA C 13 53.478 . . . . . . . 30 ALA CA . 26834 1 127 . 1 1 60 60 ALA CB C 13 18.807 . . . . . . . 30 ALA CB . 26834 1 128 . 1 1 60 60 ALA N N 15 124.169 . . . . . . . 30 ALA N . 26834 1 129 . 1 1 61 61 TRP H H 1 8.088 . . . . . . . 31 TRP HN . 26834 1 130 . 1 1 61 61 TRP C C 13 176.970 . . . . . . . 31 TRP C . 26834 1 131 . 1 1 61 61 TRP CA C 13 58.097 . . . . . . . 31 TRP CA . 26834 1 132 . 1 1 61 61 TRP CB C 13 29.278 . . . . . . . 31 TRP CB . 26834 1 133 . 1 1 61 61 TRP N N 15 119.004 . . . . . . . 31 TRP N . 26834 1 134 . 1 1 62 62 SER H H 1 7.936 . . . . . . . 32 SER HN . 26834 1 135 . 1 1 62 62 SER C C 13 175.280 . . . . . . . 32 SER C . 26834 1 136 . 1 1 62 62 SER CA C 13 59.113 . . . . . . . 32 SER CA . 26834 1 137 . 1 1 62 62 SER CB C 13 63.611 . . . . . . . 32 SER CB . 26834 1 138 . 1 1 62 62 SER N N 15 116.494 . . . . . . . 32 SER N . 26834 1 139 . 1 1 63 63 SER H H 1 8.268 . . . . . . . 33 SER HN . 26834 1 140 . 1 1 63 63 SER C C 13 175.243 . . . . . . . 33 SER C . 26834 1 141 . 1 1 63 63 SER CA C 13 59.457 . . . . . . . 33 SER CA . 26834 1 142 . 1 1 63 63 SER CB C 13 63.624 . . . . . . . 33 SER CB . 26834 1 143 . 1 1 63 63 SER N N 15 117.928 . . . . . . . 33 SER N . 26834 1 144 . 1 1 64 64 ALA H H 1 8.131 . . . . . . . 34 ALA HN . 26834 1 145 . 1 1 64 64 ALA C C 13 178.557 . . . . . . . 34 ALA C . 26834 1 146 . 1 1 64 64 ALA CA C 13 53.417 . . . . . . . 34 ALA CA . 26834 1 147 . 1 1 64 64 ALA CB C 13 18.801 . . . . . . . 34 ALA CB . 26834 1 148 . 1 1 64 64 ALA N N 15 125.341 . . . . . . . 34 ALA N . 26834 1 149 . 1 1 65 65 LEU H H 1 7.939 . . . . . . . 35 LEU HN . 26834 1 150 . 1 1 65 65 LEU C C 13 177.983 . . . . . . . 35 LEU C . 26834 1 151 . 1 1 65 65 LEU CA C 13 56.095 . . . . . . . 35 LEU CA . 26834 1 152 . 1 1 65 65 LEU CB C 13 42.018 . . . . . . . 35 LEU CB . 26834 1 153 . 1 1 65 65 LEU N N 15 119.492 . . . . . . . 35 LEU N . 26834 1 154 . 1 1 66 66 ASN H H 1 8.157 . . . . . . . 36 ASN HN . 26834 1 155 . 1 1 66 66 ASN C C 13 175.506 . . . . . . . 36 ASN C . 26834 1 156 . 1 1 66 66 ASN CA C 13 53.893 . . . . . . . 36 ASN CA . 26834 1 157 . 1 1 66 66 ASN CB C 13 38.751 . . . . . . . 36 ASN CB . 26834 1 158 . 1 1 66 66 ASN N N 15 118.230 . . . . . . . 36 ASN N . 26834 1 159 . 1 1 67 67 ALA H H 1 8.007 . . . . . . . 37 ALA HN . 26834 1 160 . 1 1 67 67 ALA C C 13 177.839 . . . . . . . 37 ALA C . 26834 1 161 . 1 1 67 67 ALA CA C 13 53.066 . . . . . . . 37 ALA CA . 26834 1 162 . 1 1 67 67 ALA CB C 13 18.998 . . . . . . . 37 ALA CB . 26834 1 163 . 1 1 67 67 ALA N N 15 123.367 . . . . . . . 37 ALA N . 26834 1 164 . 1 1 68 68 LEU H H 1 8.295 . . . . . . . 38 LEU HN . 26834 1 165 . 1 1 68 68 LEU C C 13 174.778 . . . . . . . 38 LEU C . 26834 1 166 . 1 1 68 68 LEU CA C 13 54.100 . . . . . . . 38 LEU CA . 26834 1 167 . 1 1 68 68 LEU CB C 13 37.886 . . . . . . . 38 LEU CB . 26834 1 168 . 1 1 68 68 LEU N N 15 115.479 . . . . . . . 38 LEU N . 26834 1 169 . 1 1 69 69 LYS C C 13 176.708 . . . . . . . 39 LYS C . 26834 1 170 . 1 1 69 69 LYS CA C 13 56.493 . . . . . . . 39 LYS CA . 26834 1 171 . 1 1 69 69 LYS CB C 13 32.950 . . . . . . . 39 LYS CB . 26834 1 172 . 1 1 70 70 THR H H 1 8.012 . . . . . . . 40 THR HN . 26834 1 173 . 1 1 70 70 THR C C 13 173.889 . . . . . . . 40 THR C . 26834 1 174 . 1 1 70 70 THR CA C 13 61.586 . . . . . . . 40 THR CA . 26834 1 175 . 1 1 70 70 THR CB C 13 70.031 . . . . . . . 40 THR CB . 26834 1 176 . 1 1 70 70 THR N N 15 114.589 . . . . . . . 40 THR N . 26834 1 177 . 1 1 71 71 ALA H H 1 8.268 . . . . . . . 41 ALA HN . 26834 1 178 . 1 1 71 71 ALA C C 13 175.377 . . . . . . . 41 ALA C . 26834 1 179 . 1 1 71 71 ALA CA C 13 50.748 . . . . . . . 41 ALA CA . 26834 1 180 . 1 1 71 71 ALA CB C 13 18.220 . . . . . . . 41 ALA CB . 26834 1 181 . 1 1 71 71 ALA N N 15 127.895 . . . . . . . 41 ALA N . 26834 1 182 . 1 1 77 77 PRO C C 13 176.581 . . . . . . . 47 PRO C . 26834 1 183 . 1 1 77 77 PRO CA C 13 62.796 . . . . . . . 47 PRO CA . 26834 1 184 . 1 1 77 77 PRO CB C 13 31.991 . . . . . . . 47 PRO CB . 26834 1 185 . 1 1 77 77 PRO CG C 13 27.389 . . . . . . . 47 PRO CG . 26834 1 186 . 1 1 77 77 PRO CD C 13 50.531 . . . . . . . 47 PRO CD . 26834 1 187 . 1 1 78 78 ALA H H 1 8.574 . . . . . . . 48 ALA HN . 26834 1 188 . 1 1 78 78 ALA C C 13 177.208 . . . . . . . 48 ALA C . 26834 1 189 . 1 1 78 78 ALA CA C 13 52.278 . . . . . . . 48 ALA CA . 26834 1 190 . 1 1 78 78 ALA CB C 13 19.576 . . . . . . . 48 ALA CB . 26834 1 191 . 1 1 78 78 ALA N N 15 125.305 . . . . . . . 48 ALA N . 26834 1 192 . 1 1 79 79 THR H H 1 8.401 . . . . . . . 49 THR HN . 26834 1 193 . 1 1 79 79 THR C C 13 174.595 . . . . . . . 49 THR C . 26834 1 194 . 1 1 79 79 THR CA C 13 60.680 . . . . . . . 49 THR CA . 26834 1 195 . 1 1 79 79 THR CB C 13 70.882 . . . . . . . 49 THR CB . 26834 1 196 . 1 1 79 79 THR CG2 C 13 21.709 . . . . . . . 49 THR CG2 . 26834 1 197 . 1 1 79 79 THR N N 15 115.565 . . . . . . . 49 THR N . 26834 1 198 . 1 1 80 80 ILE H H 1 8.670 . . . . . . . 50 ILE HN . 26834 1 199 . 1 1 80 80 ILE C C 13 175.360 . . . . . . . 50 ILE C . 26834 1 200 . 1 1 80 80 ILE CA C 13 62.471 . . . . . . . 50 ILE CA . 26834 1 201 . 1 1 80 80 ILE CB C 13 38.544 . . . . . . . 50 ILE CB . 26834 1 202 . 1 1 80 80 ILE CG1 C 13 29.319 . . . . . . . 50 ILE CG1 . 26834 1 203 . 1 1 80 80 ILE CG2 C 13 16.706 . . . . . . . 50 ILE CG2 . 26834 1 204 . 1 1 80 80 ILE CD1 C 13 14.423 . . . . . . . 50 ILE CD1 . 26834 1 205 . 1 1 80 80 ILE N N 15 126.480 . . . . . . . 50 ILE N . 26834 1 206 . 1 1 81 81 ASP H H 1 9.682 . . . . . . . 51 ASP HN . 26834 1 207 . 1 1 81 81 ASP C C 13 178.392 . . . . . . . 51 ASP C . 26834 1 208 . 1 1 81 81 ASP CA C 13 54.987 . . . . . . . 51 ASP CA . 26834 1 209 . 1 1 81 81 ASP CB C 13 41.527 . . . . . . . 51 ASP CB . 26834 1 210 . 1 1 81 81 ASP N N 15 130.015 . . . . . . . 51 ASP N . 26834 1 211 . 1 1 82 82 GLY H H 1 8.648 . . . . . . . 52 GLY HN . 26834 1 212 . 1 1 82 82 GLY C C 13 175.132 . . . . . . . 52 GLY C . 26834 1 213 . 1 1 82 82 GLY CA C 13 47.049 . . . . . . . 52 GLY CA . 26834 1 214 . 1 1 82 82 GLY N N 15 116.504 . . . . . . . 52 GLY N . 26834 1 215 . 1 1 83 83 GLN H H 1 7.354 . . . . . . . 53 GLN HN . 26834 1 216 . 1 1 83 83 GLN C C 13 175.837 . . . . . . . 53 GLN C . 26834 1 217 . 1 1 83 83 GLN CA C 13 55.337 . . . . . . . 53 GLN CA . 26834 1 218 . 1 1 83 83 GLN CB C 13 28.645 . . . . . . . 53 GLN CB . 26834 1 219 . 1 1 83 83 GLN CG C 13 33.081 . . . . . . . 53 GLN CG . 26834 1 220 . 1 1 83 83 GLN N N 15 114.359 . . . . . . . 53 GLN N . 26834 1 221 . 1 1 84 84 CYS H H 1 7.865 . . . . . . . 54 CYS HN . 26834 1 222 . 1 1 84 84 CYS C C 13 175.214 . . . . . . . 54 CYS C . 26834 1 223 . 1 1 84 84 CYS CA C 13 55.631 . . . . . . . 54 CYS CA . 26834 1 224 . 1 1 84 84 CYS CB C 13 26.651 . . . . . . . 54 CYS CB . 26834 1 225 . 1 1 84 84 CYS N N 15 120.740 . . . . . . . 54 CYS N . 26834 1 226 . 1 1 85 85 PRO C C 13 177.766 . . . . . . . 55 PRO C . 26834 1 227 . 1 1 85 85 PRO CA C 13 64.828 . . . . . . . 55 PRO CA . 26834 1 228 . 1 1 85 85 PRO CB C 13 32.140 . . . . . . . 55 PRO CB . 26834 1 229 . 1 1 85 85 PRO CG C 13 27.605 . . . . . . . 55 PRO CG . 26834 1 230 . 1 1 85 85 PRO CD C 13 52.507 . . . . . . . 55 PRO CD . 26834 1 231 . 1 1 86 86 LEU H H 1 6.945 . . . . . . . 56 LEU HN . 26834 1 232 . 1 1 86 86 LEU C C 13 177.437 . . . . . . . 56 LEU C . 26834 1 233 . 1 1 86 86 LEU CA C 13 55.470 . . . . . . . 56 LEU CA . 26834 1 234 . 1 1 86 86 LEU CB C 13 41.198 . . . . . . . 56 LEU CB . 26834 1 235 . 1 1 86 86 LEU CG C 13 25.517 . . . . . . . 56 LEU CG . 26834 1 236 . 1 1 86 86 LEU N N 15 114.905 . . . . . . . 56 LEU N . 26834 1 237 . 1 1 87 87 SER H H 1 7.945 . . . . . . . 57 SER HN . 26834 1 238 . 1 1 87 87 SER C C 13 174.465 . . . . . . . 57 SER C . 26834 1 239 . 1 1 87 87 SER CA C 13 60.449 . . . . . . . 57 SER CA . 26834 1 240 . 1 1 87 87 SER CB C 13 63.125 . . . . . . . 57 SER CB . 26834 1 241 . 1 1 87 87 SER N N 15 113.147 . . . . . . . 57 SER N . 26834 1 242 . 1 1 88 88 ALA H H 1 7.181 . . . . . . . 58 ALA HN . 26834 1 243 . 1 1 88 88 ALA C C 13 177.682 . . . . . . . 58 ALA C . 26834 1 244 . 1 1 88 88 ALA CA C 13 52.530 . . . . . . . 58 ALA CA . 26834 1 245 . 1 1 88 88 ALA CB C 13 19.196 . . . . . . . 58 ALA CB . 26834 1 246 . 1 1 88 88 ALA N N 15 122.588 . . . . . . . 58 ALA N . 26834 1 247 . 1 1 89 89 GLY H H 1 7.687 . . . . . . . 59 GLY HN . 26834 1 248 . 1 1 89 89 GLY C C 13 172.962 . . . . . . . 59 GLY C . 26834 1 249 . 1 1 89 89 GLY CA C 13 44.344 . . . . . . . 59 GLY CA . 26834 1 250 . 1 1 89 89 GLY N N 15 107.667 . . . . . . . 59 GLY N . 26834 1 251 . 1 1 90 90 PRO C C 13 177.216 . . . . . . . 60 PRO C . 26834 1 252 . 1 1 90 90 PRO CA C 13 64.088 . . . . . . . 60 PRO CA . 26834 1 253 . 1 1 90 90 PRO CB C 13 32.241 . . . . . . . 60 PRO CB . 26834 1 254 . 1 1 90 90 PRO CG C 13 26.966 . . . . . . . 60 PRO CG . 26834 1 255 . 1 1 90 90 PRO CD C 13 50.336 . . . . . . . 60 PRO CD . 26834 1 256 . 1 1 91 91 ASP H H 1 8.481 . . . . . . . 61 ASP HN . 26834 1 257 . 1 1 91 91 ASP C C 13 175.363 . . . . . . . 61 ASP C . 26834 1 258 . 1 1 91 91 ASP CA C 13 54.140 . . . . . . . 61 ASP CA . 26834 1 259 . 1 1 91 91 ASP CB C 13 41.042 . . . . . . . 61 ASP CB . 26834 1 260 . 1 1 91 91 ASP N N 15 117.129 . . . . . . . 61 ASP N . 26834 1 261 . 1 1 92 92 ALA H H 1 7.443 . . . . . . . 62 ALA HN . 26834 1 262 . 1 1 92 92 ALA C C 13 176.503 . . . . . . . 62 ALA C . 26834 1 263 . 1 1 92 92 ALA CA C 13 51.647 . . . . . . . 62 ALA CA . 26834 1 264 . 1 1 92 92 ALA CB C 13 20.717 . . . . . . . 62 ALA CB . 26834 1 265 . 1 1 92 92 ALA N N 15 122.858 . . . . . . . 62 ALA N . 26834 1 266 . 1 1 93 93 LYS H H 1 8.869 . . . . . . . 63 LYS HN . 26834 1 267 . 1 1 93 93 LYS C C 13 174.864 . . . . . . . 63 LYS C . 26834 1 268 . 1 1 93 93 LYS CA C 13 54.935 . . . . . . . 63 LYS CA . 26834 1 269 . 1 1 93 93 LYS CB C 13 35.581 . . . . . . . 63 LYS CB . 26834 1 270 . 1 1 93 93 LYS CG C 13 23.216 . . . . . . . 63 LYS CG . 26834 1 271 . 1 1 93 93 LYS CD C 13 29.301 . . . . . . . 63 LYS CD . 26834 1 272 . 1 1 93 93 LYS N N 15 119.075 . . . . . . . 63 LYS N . 26834 1 273 . 1 1 94 94 VAL H H 1 8.746 . . . . . . . 64 VAL HN . 26834 1 274 . 1 1 94 94 VAL C C 13 176.060 . . . . . . . 64 VAL C . 26834 1 275 . 1 1 94 94 VAL CA C 13 64.094 . . . . . . . 64 VAL CA . 26834 1 276 . 1 1 94 94 VAL CB C 13 32.114 . . . . . . . 64 VAL CB . 26834 1 277 . 1 1 94 94 VAL CG1 C 13 22.878 . . . . . . . 64 VAL CG1 . 26834 1 278 . 1 1 94 94 VAL CG2 C 13 21.714 . . . . . . . 64 VAL CG2 . 26834 1 279 . 1 1 94 94 VAL N N 15 122.759 . . . . . . . 64 VAL N . 26834 1 280 . 1 1 95 95 TYR H H 1 9.320 . . . . . . . 65 TYR HN . 26834 1 281 . 1 1 95 95 TYR C C 13 172.765 . . . . . . . 65 TYR C . 26834 1 282 . 1 1 95 95 TYR CA C 13 58.600 . . . . . . . 65 TYR CA . 26834 1 283 . 1 1 95 95 TYR CB C 13 40.461 . . . . . . . 65 TYR CB . 26834 1 284 . 1 1 95 95 TYR N N 15 130.809 . . . . . . . 65 TYR N . 26834 1 285 . 1 1 96 96 GLU H H 1 8.498 . . . . . . . 66 GLU HN . 26834 1 286 . 1 1 96 96 GLU C C 13 173.881 . . . . . . . 66 GLU C . 26834 1 287 . 1 1 96 96 GLU CA C 13 58.606 . . . . . . . 66 GLU CA . 26834 1 288 . 1 1 96 96 GLU CB C 13 28.464 . . . . . . . 66 GLU CB . 26834 1 289 . 1 1 96 96 GLU N N 15 125.204 . . . . . . . 66 GLU N . 26834 1 290 . 1 1 99 99 ASP C C 13 175.073 . . . . . . . 69 ASP C . 26834 1 291 . 1 1 99 99 ASP CA C 13 53.874 . . . . . . . 69 ASP CA . 26834 1 292 . 1 1 99 99 ASP CB C 13 45.840 . . . . . . . 69 ASP CB . 26834 1 293 . 1 1 100 100 CYS H H 1 9.229 . . . . . . . 70 CYS HN . 26834 1 294 . 1 1 100 100 CYS C C 13 172.319 . . . . . . . 70 CYS C . 26834 1 295 . 1 1 100 100 CYS CA C 13 57.964 . . . . . . . 70 CYS CA . 26834 1 296 . 1 1 100 100 CYS CB C 13 31.070 . . . . . . . 70 CYS CB . 26834 1 297 . 1 1 100 100 CYS N N 15 120.879 . . . . . . . 70 CYS N . 26834 1 298 . 1 1 101 101 THR H H 1 8.893 . . . . . . . 71 THR HN . 26834 1 299 . 1 1 101 101 THR C C 13 172.405 . . . . . . . 71 THR C . 26834 1 300 . 1 1 101 101 THR CA C 13 63.281 . . . . . . . 71 THR CA . 26834 1 301 . 1 1 101 101 THR CB C 13 70.185 . . . . . . . 71 THR CB . 26834 1 302 . 1 1 101 101 THR N N 15 120.924 . . . . . . . 71 THR N . 26834 1 303 . 1 1 102 102 LEU H H 1 9.622 . . . . . . . 72 LEU HN . 26834 1 304 . 1 1 102 102 LEU C C 13 177.994 . . . . . . . 72 LEU C . 26834 1 305 . 1 1 102 102 LEU CA C 13 52.025 . . . . . . . 72 LEU CA . 26834 1 306 . 1 1 102 102 LEU CB C 13 44.899 . . . . . . . 72 LEU CB . 26834 1 307 . 1 1 102 102 LEU N N 15 124.539 . . . . . . . 72 LEU N . 26834 1 308 . 1 1 103 103 ASN H H 1 9.401 . . . . . . . 73 ASN HN . 26834 1 309 . 1 1 103 103 ASN C C 13 173.278 . . . . . . . 73 ASN C . 26834 1 310 . 1 1 103 103 ASN CA C 13 52.345 . . . . . . . 73 ASN CA . 26834 1 311 . 1 1 103 103 ASN CB C 13 44.414 . . . . . . . 73 ASN CB . 26834 1 312 . 1 1 103 103 ASN N N 15 120.131 . . . . . . . 73 ASN N . 26834 1 313 . 1 1 104 104 GLN H H 1 8.902 . . . . . . . 74 GLN HN . 26834 1 314 . 1 1 104 104 GLN C C 13 174.724 . . . . . . . 74 GLN C . 26834 1 315 . 1 1 104 104 GLN CA C 13 55.445 . . . . . . . 74 GLN CA . 26834 1 316 . 1 1 104 104 GLN CB C 13 30.866 . . . . . . . 74 GLN CB . 26834 1 317 . 1 1 104 104 GLN CG C 13 34.342 . . . . . . . 74 GLN CG . 26834 1 318 . 1 1 104 104 GLN N N 15 124.161 . . . . . . . 74 GLN N . 26834 1 319 . 1 1 105 105 THR H H 1 8.574 . . . . . . . 75 THR HN . 26834 1 320 . 1 1 105 105 THR C C 13 173.617 . . . . . . . 75 THR C . 26834 1 321 . 1 1 105 105 THR CA C 13 61.682 . . . . . . . 75 THR CA . 26834 1 322 . 1 1 105 105 THR CB C 13 70.193 . . . . . . . 75 THR CB . 26834 1 323 . 1 1 105 105 THR N N 15 121.710 . . . . . . . 75 THR N . 26834 1 324 . 1 1 106 106 ASN H H 1 8.571 . . . . . . . 76 ASN HN . 26834 1 325 . 1 1 106 106 ASN C C 13 174.971 . . . . . . . 76 ASN C . 26834 1 326 . 1 1 106 106 ASN CA C 13 52.608 . . . . . . . 76 ASN CA . 26834 1 327 . 1 1 106 106 ASN CB C 13 40.810 . . . . . . . 76 ASN CB . 26834 1 328 . 1 1 106 106 ASN N N 15 123.252 . . . . . . . 76 ASN N . 26834 1 329 . 1 1 107 107 ILE C C 13 177.303 . . . . . . . 77 ILE C . 26834 1 330 . 1 1 107 107 ILE CA C 13 63.588 . . . . . . . 77 ILE CA . 26834 1 331 . 1 1 107 107 ILE CB C 13 37.973 . . . . . . . 77 ILE CB . 26834 1 332 . 1 1 108 108 SER H H 1 8.295 . . . . . . . 78 SER HN . 26834 1 333 . 1 1 108 108 SER C C 13 174.733 . . . . . . . 78 SER C . 26834 1 334 . 1 1 108 108 SER CA C 13 58.515 . . . . . . . 78 SER CA . 26834 1 335 . 1 1 108 108 SER CB C 13 63.436 . . . . . . . 78 SER CB . 26834 1 336 . 1 1 108 108 SER N N 15 116.218 . . . . . . . 78 SER N . 26834 1 337 . 1 1 109 109 ALA H H 1 8.205 . . . . . . . 79 ALA HN . 26834 1 338 . 1 1 109 109 ALA C C 13 177.804 . . . . . . . 79 ALA C . 26834 1 339 . 1 1 109 109 ALA CA C 13 53.105 . . . . . . . 79 ALA CA . 26834 1 340 . 1 1 109 109 ALA CB C 13 18.964 . . . . . . . 79 ALA CB . 26834 1 341 . 1 1 109 109 ALA N N 15 125.295 . . . . . . . 79 ALA N . 26834 1 342 . 1 1 110 110 ASN H H 1 8.092 . . . . . . . 80 ASN HN . 26834 1 343 . 1 1 110 110 ASN C C 13 176.668 . . . . . . . 80 ASN C . 26834 1 344 . 1 1 110 110 ASN CA C 13 53.675 . . . . . . . 80 ASN CA . 26834 1 345 . 1 1 110 110 ASN N N 15 119.275 . . . . . . . 80 ASN N . 26834 1 346 . 1 1 111 111 ASN H H 1 8.074 . . . . . . . 81 ASN HN . 26834 1 347 . 1 1 111 111 ASN C C 13 174.195 . . . . . . . 81 ASN C . 26834 1 348 . 1 1 111 111 ASN CA C 13 52.516 . . . . . . . 81 ASN CA . 26834 1 349 . 1 1 111 111 ASN CB C 13 39.772 . . . . . . . 81 ASN CB . 26834 1 350 . 1 1 111 111 ASN N N 15 116.646 . . . . . . . 81 ASN N . 26834 1 351 . 1 1 112 112 ASN H H 1 8.246 . . . . . . . 82 ASN HN . 26834 1 352 . 1 1 112 112 ASN C C 13 175.150 . . . . . . . 82 ASN C . 26834 1 353 . 1 1 112 112 ASN CA C 13 53.635 . . . . . . . 82 ASN CA . 26834 1 354 . 1 1 112 112 ASN CB C 13 39.107 . . . . . . . 82 ASN CB . 26834 1 355 . 1 1 112 112 ASN N N 15 121.084 . . . . . . . 82 ASN N . 26834 1 356 . 1 1 113 113 LYS H H 1 8.729 . . . . . . . 83 LYS HN . 26834 1 357 . 1 1 113 113 LYS C C 13 175.695 . . . . . . . 83 LYS C . 26834 1 358 . 1 1 113 113 LYS CA C 13 55.282 . . . . . . . 83 LYS CA . 26834 1 359 . 1 1 113 113 LYS CB C 13 37.027 . . . . . . . 83 LYS CB . 26834 1 360 . 1 1 113 113 LYS CG C 13 25.269 . . . . . . . 83 LYS CG . 26834 1 361 . 1 1 113 113 LYS CD C 13 29.170 . . . . . . . 83 LYS CD . 26834 1 362 . 1 1 113 113 LYS CE C 13 41.911 . . . . . . . 83 LYS CE . 26834 1 363 . 1 1 113 113 LYS N N 15 121.044 . . . . . . . 83 LYS N . 26834 1 364 . 1 1 114 114 PHE H H 1 9.325 . . . . . . . 84 PHE HN . 26834 1 365 . 1 1 114 114 PHE C C 13 174.581 . . . . . . . 84 PHE C . 26834 1 366 . 1 1 114 114 PHE CA C 13 55.312 . . . . . . . 84 PHE CA . 26834 1 367 . 1 1 114 114 PHE CB C 13 44.104 . . . . . . . 84 PHE CB . 26834 1 368 . 1 1 114 114 PHE N N 15 116.960 . . . . . . . 84 PHE N . 26834 1 369 . 1 1 115 115 TYR H H 1 8.981 . . . . . . . 85 TYR HN . 26834 1 370 . 1 1 115 115 TYR C C 13 173.762 . . . . . . . 85 TYR C . 26834 1 371 . 1 1 115 115 TYR CA C 13 58.781 . . . . . . . 85 TYR CA . 26834 1 372 . 1 1 115 115 TYR CB C 13 44.010 . . . . . . . 85 TYR CB . 26834 1 373 . 1 1 115 115 TYR N N 15 125.849 . . . . . . . 85 TYR N . 26834 1 374 . 1 1 116 116 ILE H H 1 9.915 . . . . . . . 86 ILE HN . 26834 1 375 . 1 1 116 116 ILE C C 13 175.006 . . . . . . . 86 ILE C . 26834 1 376 . 1 1 116 116 ILE CA C 13 61.066 . . . . . . . 86 ILE CA . 26834 1 377 . 1 1 116 116 ILE CB C 13 42.276 . . . . . . . 86 ILE CB . 26834 1 378 . 1 1 116 116 ILE CG1 C 13 29.316 . . . . . . . 86 ILE CG1 . 26834 1 379 . 1 1 116 116 ILE CG2 C 13 16.450 . . . . . . . 86 ILE CG2 . 26834 1 380 . 1 1 116 116 ILE N N 15 131.704 . . . . . . . 86 ILE N . 26834 1 381 . 1 1 117 117 ILE H H 1 8.727 . . . . . . . 87 ILE HN . 26834 1 382 . 1 1 117 117 ILE C C 13 174.885 . . . . . . . 87 ILE C . 26834 1 383 . 1 1 117 117 ILE CA C 13 59.984 . . . . . . . 87 ILE CA . 26834 1 384 . 1 1 117 117 ILE CB C 13 40.328 . . . . . . . 87 ILE CB . 26834 1 385 . 1 1 117 117 ILE CG1 C 13 27.375 . . . . . . . 87 ILE CG1 . 26834 1 386 . 1 1 117 117 ILE CG2 C 13 16.450 . . . . . . . 87 ILE CG2 . 26834 1 387 . 1 1 117 117 ILE CD1 C 13 13.759 . . . . . . . 87 ILE CD1 . 26834 1 388 . 1 1 117 117 ILE N N 15 124.809 . . . . . . . 87 ILE N . 26834 1 389 . 1 1 118 118 GLN H H 1 9.296 . . . . . . . 88 GLN HN . 26834 1 390 . 1 1 118 118 GLN C C 13 174.359 . . . . . . . 88 GLN C . 26834 1 391 . 1 1 118 118 GLN CA C 13 55.090 . . . . . . . 88 GLN CA . 26834 1 392 . 1 1 118 118 GLN CB C 13 35.505 . . . . . . . 88 GLN CB . 26834 1 393 . 1 1 118 118 GLN N N 15 120.690 . . . . . . . 88 GLN N . 26834 1 394 . 1 1 119 119 LEU H H 1 8.867 . . . . . . . 89 LEU HN . 26834 1 395 . 1 1 119 119 LEU C C 13 174.861 . . . . . . . 89 LEU C . 26834 1 396 . 1 1 119 119 LEU CA C 13 55.903 . . . . . . . 89 LEU CA . 26834 1 397 . 1 1 119 119 LEU CB C 13 45.471 . . . . . . . 89 LEU CB . 26834 1 398 . 1 1 119 119 LEU CG C 13 30.046 . . . . . . . 89 LEU CG . 26834 1 399 . 1 1 119 119 LEU CD1 C 13 26.810 . . . . . . . 89 LEU CD1 . 26834 1 400 . 1 1 119 119 LEU CD2 C 13 23.594 . . . . . . . 89 LEU CD2 . 26834 1 401 . 1 1 119 119 LEU N N 15 128.022 . . . . . . . 89 LEU N . 26834 1 402 . 1 1 120 120 ILE H H 1 9.481 . . . . . . . 90 ILE HN . 26834 1 403 . 1 1 120 120 ILE C C 13 174.277 . . . . . . . 90 ILE C . 26834 1 404 . 1 1 120 120 ILE CA C 13 59.464 . . . . . . . 90 ILE CA . 26834 1 405 . 1 1 120 120 ILE CB C 13 40.926 . . . . . . . 90 ILE CB . 26834 1 406 . 1 1 120 120 ILE CG1 C 13 28.229 . . . . . . . 90 ILE CG1 . 26834 1 407 . 1 1 120 120 ILE CG2 C 13 18.696 . . . . . . . 90 ILE CG2 . 26834 1 408 . 1 1 120 120 ILE CD1 C 13 14.883 . . . . . . . 90 ILE CD1 . 26834 1 409 . 1 1 120 120 ILE N N 15 126.975 . . . . . . . 90 ILE N . 26834 1 410 . 1 1 121 121 GLU H H 1 9.337 . . . . . . . 91 GLU HN . 26834 1 411 . 1 1 121 121 GLU C C 13 175.201 . . . . . . . 91 GLU C . 26834 1 412 . 1 1 121 121 GLU CA C 13 54.477 . . . . . . . 91 GLU CA . 26834 1 413 . 1 1 121 121 GLU CB C 13 32.917 . . . . . . . 91 GLU CB . 26834 1 414 . 1 1 121 121 GLU CG C 13 36.416 . . . . . . . 91 GLU CG . 26834 1 415 . 1 1 121 121 GLU N N 15 128.498 . . . . . . . 91 GLU N . 26834 1 416 . 1 1 122 122 HIS H H 1 8.764 . . . . . . . 92 HIS HN . 26834 1 417 . 1 1 122 122 HIS C C 13 175.285 . . . . . . . 92 HIS C . 26834 1 418 . 1 1 122 122 HIS CA C 13 54.054 . . . . . . . 92 HIS CA . 26834 1 419 . 1 1 122 122 HIS CB C 13 29.793 . . . . . . . 92 HIS CB . 26834 1 420 . 1 1 122 122 HIS N N 15 123.571 . . . . . . . 92 HIS N . 26834 1 421 . 1 1 123 123 GLY H H 1 9.038 . . . . . . . 93 GLY HN . 26834 1 422 . 1 1 123 123 GLY C C 13 175.627 . . . . . . . 93 GLY C . 26834 1 423 . 1 1 123 123 GLY CA C 13 47.510 . . . . . . . 93 GLY CA . 26834 1 424 . 1 1 123 123 GLY N N 15 116.409 . . . . . . . 93 GLY N . 26834 1 425 . 1 1 124 124 GLY H H 1 8.707 . . . . . . . 94 GLY HN . 26834 1 426 . 1 1 124 124 GLY C C 13 173.276 . . . . . . . 94 GLY C . 26834 1 427 . 1 1 124 124 GLY CA C 13 45.077 . . . . . . . 94 GLY CA . 26834 1 428 . 1 1 124 124 GLY N N 15 106.764 . . . . . . . 94 GLY N . 26834 1 429 . 1 1 125 125 THR H H 1 7.480 . . . . . . . 95 THR HN . 26834 1 430 . 1 1 125 125 THR C C 13 171.284 . . . . . . . 95 THR C . 26834 1 431 . 1 1 125 125 THR CA C 13 60.074 . . . . . . . 95 THR CA . 26834 1 432 . 1 1 125 125 THR CB C 13 70.618 . . . . . . . 95 THR CB . 26834 1 433 . 1 1 125 125 THR N N 15 114.446 . . . . . . . 95 THR N . 26834 1 434 . 1 1 126 126 TYR H H 1 8.400 . . . . . . . 96 TYR HN . 26834 1 435 . 1 1 126 126 TYR C C 13 175.301 . . . . . . . 96 TYR C . 26834 1 436 . 1 1 126 126 TYR CA C 13 57.501 . . . . . . . 96 TYR CA . 26834 1 437 . 1 1 126 126 TYR CB C 13 41.376 . . . . . . . 96 TYR CB . 26834 1 438 . 1 1 126 126 TYR N N 15 119.219 . . . . . . . 96 TYR N . 26834 1 439 . 1 1 127 127 SER H H 1 9.321 . . . . . . . 97 SER HN . 26834 1 440 . 1 1 127 127 SER C C 13 175.028 . . . . . . . 97 SER C . 26834 1 441 . 1 1 127 127 SER CA C 13 58.410 . . . . . . . 97 SER CA . 26834 1 442 . 1 1 127 127 SER CB C 13 68.092 . . . . . . . 97 SER CB . 26834 1 443 . 1 1 127 127 SER N N 15 117.157 . . . . . . . 97 SER N . 26834 1 444 . 1 1 128 128 THR H H 1 9.717 . . . . . . . 98 THR HN . 26834 1 445 . 1 1 128 128 THR C C 13 173.514 . . . . . . . 98 THR C . 26834 1 446 . 1 1 128 128 THR CA C 13 60.051 . . . . . . . 98 THR CA . 26834 1 447 . 1 1 128 128 THR CB C 13 71.587 . . . . . . . 98 THR CB . 26834 1 448 . 1 1 128 128 THR CG2 C 13 23.879 . . . . . . . 98 THR CG2 . 26834 1 449 . 1 1 128 128 THR N N 15 111.516 . . . . . . . 98 THR N . 26834 1 450 . 1 1 129 129 TRP H H 1 9.795 . . . . . . . 99 TRP HN . 26834 1 451 . 1 1 129 129 TRP C C 13 174.121 . . . . . . . 99 TRP C . 26834 1 452 . 1 1 129 129 TRP CA C 13 54.830 . . . . . . . 99 TRP CA . 26834 1 453 . 1 1 129 129 TRP CB C 13 34.286 . . . . . . . 99 TRP CB . 26834 1 454 . 1 1 129 129 TRP N N 15 125.153 . . . . . . . 99 TRP N . 26834 1 455 . 1 1 130 130 ASN H H 1 7.834 . . . . . . . 100 ASN HN . 26834 1 456 . 1 1 130 130 ASN C C 13 172.132 . . . . . . . 100 ASN C . 26834 1 457 . 1 1 130 130 ASN CA C 13 50.072 . . . . . . . 100 ASN CA . 26834 1 458 . 1 1 130 130 ASN CB C 13 43.607 . . . . . . . 100 ASN CB . 26834 1 459 . 1 1 130 130 ASN N N 15 125.146 . . . . . . . 100 ASN N . 26834 1 460 . 1 1 131 131 ARG H H 1 8.208 . . . . . . . 101 ARG HN . 26834 1 461 . 1 1 131 131 ARG C C 13 172.919 . . . . . . . 101 ARG C . 26834 1 462 . 1 1 131 131 ARG CA C 13 55.421 . . . . . . . 101 ARG CA . 26834 1 463 . 1 1 131 131 ARG CB C 13 34.091 . . . . . . . 101 ARG CB . 26834 1 464 . 1 1 131 131 ARG CG C 13 28.629 . . . . . . . 101 ARG CG . 26834 1 465 . 1 1 131 131 ARG CD C 13 44.280 . . . . . . . 101 ARG CD . 26834 1 466 . 1 1 131 131 ARG N N 15 123.097 . . . . . . . 101 ARG N . 26834 1 467 . 1 1 132 132 TRP H H 1 8.741 . . . . . . . 102 TRP HN . 26834 1 468 . 1 1 132 132 TRP C C 13 172.857 . . . . . . . 102 TRP C . 26834 1 469 . 1 1 132 132 TRP CA C 13 56.654 . . . . . . . 102 TRP CA . 26834 1 470 . 1 1 132 132 TRP CB C 13 33.035 . . . . . . . 102 TRP CB . 26834 1 471 . 1 1 132 132 TRP N N 15 125.609 . . . . . . . 102 TRP N . 26834 1 472 . 1 1 133 133 GLY H H 1 6.585 . . . . . . . 103 GLY HN . 26834 1 473 . 1 1 133 133 GLY C C 13 170.981 . . . . . . . 103 GLY C . 26834 1 474 . 1 1 133 133 GLY CA C 13 45.193 . . . . . . . 103 GLY CA . 26834 1 475 . 1 1 133 133 GLY N N 15 105.570 . . . . . . . 103 GLY N . 26834 1 476 . 1 1 134 134 ARG H H 1 8.993 . . . . . . . 104 ARG HN . 26834 1 477 . 1 1 134 134 ARG C C 13 176.586 . . . . . . . 104 ARG C . 26834 1 478 . 1 1 134 134 ARG CA C 13 55.573 . . . . . . . 104 ARG CA . 26834 1 479 . 1 1 134 134 ARG CB C 13 31.443 . . . . . . . 104 ARG CB . 26834 1 480 . 1 1 134 134 ARG N N 15 122.424 . . . . . . . 104 ARG N . 26834 1 481 . 1 1 135 135 VAL C C 13 177.036 . . . . . . . 105 VAL C . 26834 1 482 . 1 1 135 135 VAL CA C 13 66.092 . . . . . . . 105 VAL CA . 26834 1 483 . 1 1 135 135 VAL CB C 13 31.586 . . . . . . . 105 VAL CB . 26834 1 484 . 1 1 135 135 VAL CG1 C 13 20.944 . . . . . . . 105 VAL CG1 . 26834 1 485 . 1 1 135 135 VAL CG2 C 13 22.431 . . . . . . . 105 VAL CG2 . 26834 1 486 . 1 1 136 136 GLY H H 1 8.835 . . . . . . . 106 GLY HN . 26834 1 487 . 1 1 136 136 GLY C C 13 174.231 . . . . . . . 106 GLY C . 26834 1 488 . 1 1 136 136 GLY CA C 13 44.774 . . . . . . . 106 GLY CA . 26834 1 489 . 1 1 136 136 GLY N N 15 115.877 . . . . . . . 106 GLY N . 26834 1 490 . 1 1 137 137 GLU H H 1 8.480 . . . . . . . 107 GLU HN . 26834 1 491 . 1 1 137 137 GLU C C 13 176.184 . . . . . . . 107 GLU C . 26834 1 492 . 1 1 137 137 GLU CA C 13 54.239 . . . . . . . 107 GLU CA . 26834 1 493 . 1 1 137 137 GLU CB C 13 31.613 . . . . . . . 107 GLU CB . 26834 1 494 . 1 1 137 137 GLU CG C 13 35.931 . . . . . . . 107 GLU CG . 26834 1 495 . 1 1 137 137 GLU N N 15 120.319 . . . . . . . 107 GLU N . 26834 1 496 . 1 1 138 138 VAL H H 1 8.510 . . . . . . . 108 VAL HN . 26834 1 497 . 1 1 138 138 VAL C C 13 177.447 . . . . . . . 108 VAL C . 26834 1 498 . 1 1 138 138 VAL CA C 13 65.700 . . . . . . . 108 VAL CA . 26834 1 499 . 1 1 138 138 VAL CB C 13 31.914 . . . . . . . 108 VAL CB . 26834 1 500 . 1 1 138 138 VAL CG1 C 13 21.353 . . . . . . . 108 VAL CG1 . 26834 1 501 . 1 1 138 138 VAL CG2 C 13 22.445 . . . . . . . 108 VAL CG2 . 26834 1 502 . 1 1 138 138 VAL N N 15 120.973 . . . . . . . 108 VAL N . 26834 1 503 . 1 1 139 139 GLY H H 1 7.922 . . . . . . . 109 GLY HN . 26834 1 504 . 1 1 139 139 GLY C C 13 174.532 . . . . . . . 109 GLY C . 26834 1 505 . 1 1 139 139 GLY CA C 13 44.254 . . . . . . . 109 GLY CA . 26834 1 506 . 1 1 139 139 GLY N N 15 103.582 . . . . . . . 109 GLY N . 26834 1 507 . 1 1 140 140 GLN H H 1 7.837 . . . . . . . 110 GLN HN . 26834 1 508 . 1 1 140 140 GLN C C 13 172.827 . . . . . . . 110 GLN C . 26834 1 509 . 1 1 140 140 GLN CA C 13 54.033 . . . . . . . 110 GLN CA . 26834 1 510 . 1 1 140 140 GLN CB C 13 31.874 . . . . . . . 110 GLN CB . 26834 1 511 . 1 1 140 140 GLN CG C 13 34.514 . . . . . . . 110 GLN CG . 26834 1 512 . 1 1 140 140 GLN N N 15 119.271 . . . . . . . 110 GLN N . 26834 1 513 . 1 1 141 141 SER H H 1 7.845 . . . . . . . 111 SER HN . 26834 1 514 . 1 1 141 141 SER C C 13 174.381 . . . . . . . 111 SER C . 26834 1 515 . 1 1 141 141 SER CA C 13 56.910 . . . . . . . 111 SER CA . 26834 1 516 . 1 1 141 141 SER CB C 13 67.837 . . . . . . . 111 SER CB . 26834 1 517 . 1 1 141 141 SER N N 15 109.758 . . . . . . . 111 SER N . 26834 1 518 . 1 1 142 142 LYS H H 1 8.356 . . . . . . . 112 LYS HN . 26834 1 519 . 1 1 142 142 LYS C C 13 173.771 . . . . . . . 112 LYS C . 26834 1 520 . 1 1 142 142 LYS CA C 13 56.609 . . . . . . . 112 LYS CA . 26834 1 521 . 1 1 142 142 LYS CB C 13 36.655 . . . . . . . 112 LYS CB . 26834 1 522 . 1 1 142 142 LYS CG C 13 24.771 . . . . . . . 112 LYS CG . 26834 1 523 . 1 1 142 142 LYS CD C 13 29.087 . . . . . . . 112 LYS CD . 26834 1 524 . 1 1 142 142 LYS CE C 13 42.206 . . . . . . . 112 LYS CE . 26834 1 525 . 1 1 142 142 LYS N N 15 118.124 . . . . . . . 112 LYS N . 26834 1 526 . 1 1 143 143 LEU H H 1 9.132 . . . . . . . 113 LEU HN . 26834 1 527 . 1 1 143 143 LEU C C 13 175.239 . . . . . . . 113 LEU C . 26834 1 528 . 1 1 143 143 LEU CA C 13 53.664 . . . . . . . 113 LEU CA . 26834 1 529 . 1 1 143 143 LEU CB C 13 44.343 . . . . . . . 113 LEU CB . 26834 1 530 . 1 1 143 143 LEU CG C 13 26.432 . . . . . . . 113 LEU CG . 26834 1 531 . 1 1 143 143 LEU CD1 C 13 24.152 . . . . . . . 113 LEU CD1 . 26834 1 532 . 1 1 143 143 LEU N N 15 131.622 . . . . . . . 113 LEU N . 26834 1 533 . 1 1 144 144 LEU H H 1 9.499 . . . . . . . 114 LEU HN . 26834 1 534 . 1 1 144 144 LEU C C 13 173.134 . . . . . . . 114 LEU C . 26834 1 535 . 1 1 144 144 LEU CA C 13 51.337 . . . . . . . 114 LEU CA . 26834 1 536 . 1 1 144 144 LEU CB C 13 44.595 . . . . . . . 114 LEU CB . 26834 1 537 . 1 1 144 144 LEU N N 15 130.641 . . . . . . . 114 LEU N . 26834 1 538 . 1 1 147 147 THR C C 13 174.432 . . . . . . . 117 THR C . 26834 1 539 . 1 1 147 147 THR CA C 13 62.572 . . . . . . . 117 THR CA . 26834 1 540 . 1 1 147 147 THR CB C 13 69.353 . . . . . . . 117 THR CB . 26834 1 541 . 1 1 147 147 THR CG2 C 13 22.098 . . . . . . . 117 THR CG2 . 26834 1 542 . 1 1 148 148 SER H H 1 7.589 . . . . . . . 118 SER HN . 26834 1 543 . 1 1 148 148 SER C C 13 173.345 . . . . . . . 118 SER C . 26834 1 544 . 1 1 148 148 SER CA C 13 56.541 . . . . . . . 118 SER CA . 26834 1 545 . 1 1 148 148 SER CB C 13 66.167 . . . . . . . 118 SER CB . 26834 1 546 . 1 1 148 148 SER N N 15 112.841 . . . . . . . 118 SER N . 26834 1 547 . 1 1 149 149 LEU H H 1 8.674 . . . . . . . 119 LEU HN . 26834 1 548 . 1 1 149 149 LEU C C 13 177.896 . . . . . . . 119 LEU C . 26834 1 549 . 1 1 149 149 LEU CA C 13 57.206 . . . . . . . 119 LEU CA . 26834 1 550 . 1 1 149 149 LEU CB C 13 40.164 . . . . . . . 119 LEU CB . 26834 1 551 . 1 1 149 149 LEU CG C 13 25.352 . . . . . . . 119 LEU CG . 26834 1 552 . 1 1 149 149 LEU CD1 C 13 20.552 . . . . . . . 119 LEU CD1 . 26834 1 553 . 1 1 149 149 LEU N N 15 125.021 . . . . . . . 119 LEU N . 26834 1 554 . 1 1 150 150 GLU H H 1 8.380 . . . . . . . 120 GLU HN . 26834 1 555 . 1 1 150 150 GLU C C 13 178.548 . . . . . . . 120 GLU C . 26834 1 556 . 1 1 150 150 GLU CA C 13 60.078 . . . . . . . 120 GLU CA . 26834 1 557 . 1 1 150 150 GLU CB C 13 28.933 . . . . . . . 120 GLU CB . 26834 1 558 . 1 1 150 150 GLU CG C 13 36.447 . . . . . . . 120 GLU CG . 26834 1 559 . 1 1 150 150 GLU N N 15 117.247 . . . . . . . 120 GLU N . 26834 1 560 . 1 1 151 151 ALA H H 1 7.680 . . . . . . . 121 ALA HN . 26834 1 561 . 1 1 151 151 ALA C C 13 179.385 . . . . . . . 121 ALA C . 26834 1 562 . 1 1 151 151 ALA CA C 13 54.800 . . . . . . . 121 ALA CA . 26834 1 563 . 1 1 151 151 ALA CB C 13 18.809 . . . . . . . 121 ALA CB . 26834 1 564 . 1 1 151 151 ALA N N 15 120.905 . . . . . . . 121 ALA N . 26834 1 565 . 1 1 152 152 ALA H H 1 7.224 . . . . . . . 122 ALA HN . 26834 1 566 . 1 1 152 152 ALA C C 13 178.632 . . . . . . . 122 ALA C . 26834 1 567 . 1 1 152 152 ALA CA C 13 54.367 . . . . . . . 122 ALA CA . 26834 1 568 . 1 1 152 152 ALA CB C 13 18.179 . . . . . . . 122 ALA CB . 26834 1 569 . 1 1 152 152 ALA N N 15 122.928 . . . . . . . 122 ALA N . 26834 1 570 . 1 1 153 153 LYS H H 1 8.484 . . . . . . . 123 LYS HN . 26834 1 571 . 1 1 153 153 LYS C C 13 178.597 . . . . . . . 123 LYS C . 26834 1 572 . 1 1 153 153 LYS CA C 13 60.303 . . . . . . . 123 LYS CA . 26834 1 573 . 1 1 153 153 LYS CB C 13 32.855 . . . . . . . 123 LYS CB . 26834 1 574 . 1 1 153 153 LYS CG C 13 25.538 . . . . . . . 123 LYS CG . 26834 1 575 . 1 1 153 153 LYS CD C 13 30.476 . . . . . . . 123 LYS CD . 26834 1 576 . 1 1 153 153 LYS CE C 13 41.658 . . . . . . . 123 LYS CE . 26834 1 577 . 1 1 153 153 LYS N N 15 117.908 . . . . . . . 123 LYS N . 26834 1 578 . 1 1 154 154 LYS H H 1 7.680 . . . . . . . 124 LYS HN . 26834 1 579 . 1 1 154 154 LYS HZ1 H 1 6.579 . . . . . . . 124 LYS QZ . 26834 1 580 . 1 1 154 154 LYS HZ2 H 1 6.579 . . . . . . . 124 LYS QZ . 26834 1 581 . 1 1 154 154 LYS HZ3 H 1 6.579 . . . . . . . 124 LYS QZ . 26834 1 582 . 1 1 154 154 LYS C C 13 179.338 . . . . . . . 124 LYS C . 26834 1 583 . 1 1 154 154 LYS CA C 13 59.764 . . . . . . . 124 LYS CA . 26834 1 584 . 1 1 154 154 LYS CB C 13 32.121 . . . . . . . 124 LYS CB . 26834 1 585 . 1 1 154 154 LYS CG C 13 25.524 . . . . . . . 124 LYS CG . 26834 1 586 . 1 1 154 154 LYS CD C 13 29.224 . . . . . . . 124 LYS CD . 26834 1 587 . 1 1 154 154 LYS CE C 13 42.297 . . . . . . . 124 LYS CE . 26834 1 588 . 1 1 154 154 LYS N N 15 117.087 . . . . . . . 124 LYS N . 26834 1 589 . 1 1 154 154 LYS NZ N 15 117.271 . . . . . . . 124 LYS NZ . 26834 1 590 . 1 1 155 155 ASP H H 1 7.347 . . . . . . . 125 ASP HN . 26834 1 591 . 1 1 155 155 ASP C C 13 177.742 . . . . . . . 125 ASP C . 26834 1 592 . 1 1 155 155 ASP CA C 13 58.643 . . . . . . . 125 ASP CA . 26834 1 593 . 1 1 155 155 ASP CB C 13 44.720 . . . . . . . 125 ASP CB . 26834 1 594 . 1 1 155 155 ASP N N 15 120.189 . . . . . . . 125 ASP N . 26834 1 595 . 1 1 156 156 PHE H H 1 8.199 . . . . . . . 126 PHE HN . 26834 1 596 . 1 1 156 156 PHE C C 13 177.228 . . . . . . . 126 PHE C . 26834 1 597 . 1 1 156 156 PHE CA C 13 61.790 . . . . . . . 126 PHE CA . 26834 1 598 . 1 1 156 156 PHE CB C 13 40.144 . . . . . . . 126 PHE CB . 26834 1 599 . 1 1 156 156 PHE N N 15 119.763 . . . . . . . 126 PHE N . 26834 1 600 . 1 1 157 157 GLU H H 1 9.181 . . . . . . . 127 GLU HN . 26834 1 601 . 1 1 157 157 GLU C C 13 180.227 . . . . . . . 127 GLU C . 26834 1 602 . 1 1 157 157 GLU CA C 13 60.679 . . . . . . . 127 GLU CA . 26834 1 603 . 1 1 157 157 GLU CB C 13 29.667 . . . . . . . 127 GLU CB . 26834 1 604 . 1 1 157 157 GLU CG C 13 38.274 . . . . . . . 127 GLU CG . 26834 1 605 . 1 1 157 157 GLU N N 15 117.203 . . . . . . . 127 GLU N . 26834 1 606 . 1 1 158 158 LYS H H 1 8.548 . . . . . . . 128 LYS HN . 26834 1 607 . 1 1 158 158 LYS C C 13 178.454 . . . . . . . 128 LYS C . 26834 1 608 . 1 1 158 158 LYS CA C 13 60.133 . . . . . . . 128 LYS CA . 26834 1 609 . 1 1 158 158 LYS CB C 13 32.297 . . . . . . . 128 LYS CB . 26834 1 610 . 1 1 158 158 LYS CG C 13 24.851 . . . . . . . 128 LYS CG . 26834 1 611 . 1 1 158 158 LYS CD C 13 29.578 . . . . . . . 128 LYS CD . 26834 1 612 . 1 1 158 158 LYS CE C 13 42.041 . . . . . . . 128 LYS CE . 26834 1 613 . 1 1 158 158 LYS N N 15 122.998 . . . . . . . 128 LYS N . 26834 1 614 . 1 1 159 159 LYS H H 1 7.843 . . . . . . . 129 LYS HN . 26834 1 615 . 1 1 159 159 LYS C C 13 178.105 . . . . . . . 129 LYS C . 26834 1 616 . 1 1 159 159 LYS CA C 13 58.588 . . . . . . . 129 LYS CA . 26834 1 617 . 1 1 159 159 LYS CB C 13 30.915 . . . . . . . 129 LYS CB . 26834 1 618 . 1 1 159 159 LYS CG C 13 25.419 . . . . . . . 129 LYS CG . 26834 1 619 . 1 1 159 159 LYS CD C 13 27.516 . . . . . . . 129 LYS CD . 26834 1 620 . 1 1 159 159 LYS N N 15 120.996 . . . . . . . 129 LYS N . 26834 1 621 . 1 1 160 160 PHE H H 1 8.422 . . . . . . . 130 PHE HN . 26834 1 622 . 1 1 160 160 PHE C C 13 179.038 . . . . . . . 130 PHE C . 26834 1 623 . 1 1 160 160 PHE CA C 13 63.379 . . . . . . . 130 PHE CA . 26834 1 624 . 1 1 160 160 PHE CB C 13 40.069 . . . . . . . 130 PHE CB . 26834 1 625 . 1 1 160 160 PHE N N 15 118.501 . . . . . . . 130 PHE N . 26834 1 626 . 1 1 161 161 TRP C C 13 179.074 . . . . . . . 131 TRP C . 26834 1 627 . 1 1 161 161 TRP CA C 13 60.223 . . . . . . . 131 TRP CA . 26834 1 628 . 1 1 161 161 TRP CB C 13 29.021 . . . . . . . 131 TRP CB . 26834 1 629 . 1 1 162 162 GLU H H 1 8.994 . . . . . . . 132 GLU HN . 26834 1 630 . 1 1 162 162 GLU C C 13 178.915 . . . . . . . 132 GLU C . 26834 1 631 . 1 1 162 162 GLU CA C 13 59.486 . . . . . . . 132 GLU CA . 26834 1 632 . 1 1 162 162 GLU CB C 13 29.548 . . . . . . . 132 GLU CB . 26834 1 633 . 1 1 162 162 GLU CG C 13 36.705 . . . . . . . 132 GLU CG . 26834 1 634 . 1 1 162 162 GLU N N 15 120.810 . . . . . . . 132 GLU N . 26834 1 635 . 1 1 163 163 LYS H H 1 7.676 . . . . . . . 133 LYS HN . 26834 1 636 . 1 1 163 163 LYS C C 13 177.700 . . . . . . . 133 LYS C . 26834 1 637 . 1 1 163 163 LYS CA C 13 55.738 . . . . . . . 133 LYS CA . 26834 1 638 . 1 1 163 163 LYS CB C 13 31.915 . . . . . . . 133 LYS CB . 26834 1 639 . 1 1 163 163 LYS CG C 13 23.012 . . . . . . . 133 LYS CG . 26834 1 640 . 1 1 163 163 LYS CD C 13 26.793 . . . . . . . 133 LYS CD . 26834 1 641 . 1 1 163 163 LYS N N 15 111.406 . . . . . . . 133 LYS N . 26834 1 642 . 1 1 164 164 THR H H 1 7.755 . . . . . . . 134 THR HN . 26834 1 643 . 1 1 164 164 THR C C 13 176.215 . . . . . . . 134 THR C . 26834 1 644 . 1 1 164 164 THR CA C 13 62.272 . . . . . . . 134 THR CA . 26834 1 645 . 1 1 164 164 THR CB C 13 72.420 . . . . . . . 134 THR CB . 26834 1 646 . 1 1 164 164 THR CG2 C 13 21.305 . . . . . . . 134 THR CG2 . 26834 1 647 . 1 1 164 164 THR N N 15 106.268 . . . . . . . 134 THR N . 26834 1 648 . 1 1 165 165 LYS H H 1 9.028 . . . . . . . 135 LYS HN . 26834 1 649 . 1 1 165 165 LYS C C 13 173.687 . . . . . . . 135 LYS C . 26834 1 650 . 1 1 165 165 LYS CA C 13 57.183 . . . . . . . 135 LYS CA . 26834 1 651 . 1 1 165 165 LYS CB C 13 31.272 . . . . . . . 135 LYS CB . 26834 1 652 . 1 1 165 165 LYS N N 15 124.032 . . . . . . . 135 LYS N . 26834 1 653 . 1 1 166 166 ASN H H 1 8.235 . . . . . . . 136 ASN HN . 26834 1 654 . 1 1 166 166 ASN C C 13 173.399 . . . . . . . 136 ASN C . 26834 1 655 . 1 1 166 166 ASN CA C 13 52.461 . . . . . . . 136 ASN CA . 26834 1 656 . 1 1 166 166 ASN CB C 13 42.939 . . . . . . . 136 ASN CB . 26834 1 657 . 1 1 166 166 ASN N N 15 114.844 . . . . . . . 136 ASN N . 26834 1 658 . 1 1 167 167 ARG H H 1 9.122 . . . . . . . 137 ARG HN . 26834 1 659 . 1 1 167 167 ARG C C 13 179.030 . . . . . . . 137 ARG C . 26834 1 660 . 1 1 167 167 ARG CA C 13 54.958 . . . . . . . 137 ARG CA . 26834 1 661 . 1 1 167 167 ARG CB C 13 30.058 . . . . . . . 137 ARG CB . 26834 1 662 . 1 1 167 167 ARG CG C 13 27.320 . . . . . . . 137 ARG CG . 26834 1 663 . 1 1 167 167 ARG CD C 13 43.123 . . . . . . . 137 ARG CD . 26834 1 664 . 1 1 167 167 ARG N N 15 118.709 . . . . . . . 137 ARG N . 26834 1 665 . 1 1 168 168 TRP H H 1 9.944 . . . . . . . 138 TRP HN . 26834 1 666 . 1 1 168 168 TRP C C 13 178.953 . . . . . . . 138 TRP C . 26834 1 667 . 1 1 168 168 TRP CA C 13 60.179 . . . . . . . 138 TRP CA . 26834 1 668 . 1 1 168 168 TRP CB C 13 30.299 . . . . . . . 138 TRP CB . 26834 1 669 . 1 1 168 168 TRP N N 15 127.491 . . . . . . . 138 TRP N . 26834 1 670 . 1 1 169 169 ALA C C 13 177.607 . . . . . . . 139 ALA C . 26834 1 671 . 1 1 169 169 ALA CA C 13 54.010 . . . . . . . 139 ALA CA . 26834 1 672 . 1 1 169 169 ALA CB C 13 18.583 . . . . . . . 139 ALA CB . 26834 1 673 . 1 1 170 170 ALA H H 1 7.737 . . . . . . . 140 ALA HN . 26834 1 674 . 1 1 170 170 ALA C C 13 178.884 . . . . . . . 140 ALA C . 26834 1 675 . 1 1 170 170 ALA CA C 13 51.228 . . . . . . . 140 ALA CA . 26834 1 676 . 1 1 170 170 ALA CB C 13 19.186 . . . . . . . 140 ALA CB . 26834 1 677 . 1 1 170 170 ALA N N 15 120.071 . . . . . . . 140 ALA N . 26834 1 678 . 1 1 171 171 ARG H H 1 7.406 . . . . . . . 141 ARG HN . 26834 1 679 . 1 1 171 171 ARG C C 13 175.986 . . . . . . . 141 ARG C . 26834 1 680 . 1 1 171 171 ARG CA C 13 59.353 . . . . . . . 141 ARG CA . 26834 1 681 . 1 1 171 171 ARG CB C 13 28.492 . . . . . . . 141 ARG CB . 26834 1 682 . 1 1 171 171 ARG CG C 13 24.835 . . . . . . . 141 ARG CG . 26834 1 683 . 1 1 171 171 ARG CD C 13 41.928 . . . . . . . 141 ARG CD . 26834 1 684 . 1 1 171 171 ARG N N 15 119.096 . . . . . . . 141 ARG N . 26834 1 685 . 1 1 172 172 ASP H H 1 8.612 . . . . . . . 142 ASP HN . 26834 1 686 . 1 1 172 172 ASP C C 13 176.074 . . . . . . . 142 ASP C . 26834 1 687 . 1 1 172 172 ASP CA C 13 55.837 . . . . . . . 142 ASP CA . 26834 1 688 . 1 1 172 172 ASP CB C 13 39.756 . . . . . . . 142 ASP CB . 26834 1 689 . 1 1 172 172 ASP N N 15 120.091 . . . . . . . 142 ASP N . 26834 1 690 . 1 1 173 173 ASN H H 1 8.187 . . . . . . . 143 ASN HN . 26834 1 691 . 1 1 173 173 ASN C C 13 173.299 . . . . . . . 143 ASN C . 26834 1 692 . 1 1 173 173 ASN CA C 13 51.920 . . . . . . . 143 ASN CA . 26834 1 693 . 1 1 173 173 ASN CB C 13 39.343 . . . . . . . 143 ASN CB . 26834 1 694 . 1 1 173 173 ASN N N 15 120.870 . . . . . . . 143 ASN N . 26834 1 695 . 1 1 174 174 PHE H H 1 7.446 . . . . . . . 144 PHE HN . 26834 1 696 . 1 1 174 174 PHE C C 13 175.645 . . . . . . . 144 PHE C . 26834 1 697 . 1 1 174 174 PHE CA C 13 59.522 . . . . . . . 144 PHE CA . 26834 1 698 . 1 1 174 174 PHE CB C 13 40.355 . . . . . . . 144 PHE CB . 26834 1 699 . 1 1 174 174 PHE N N 15 121.122 . . . . . . . 144 PHE N . 26834 1 700 . 1 1 175 175 VAL H H 1 8.340 . . . . . . . 145 VAL HN . 26834 1 701 . 1 1 175 175 VAL C C 13 175.186 . . . . . . . 145 VAL C . 26834 1 702 . 1 1 175 175 VAL CA C 13 61.441 . . . . . . . 145 VAL CA . 26834 1 703 . 1 1 175 175 VAL CB C 13 34.137 . . . . . . . 145 VAL CB . 26834 1 704 . 1 1 175 175 VAL CG1 C 13 20.841 . . . . . . . 145 VAL CG1 . 26834 1 705 . 1 1 175 175 VAL N N 15 129.990 . . . . . . . 145 VAL N . 26834 1 706 . 1 1 176 176 ALA H H 1 8.900 . . . . . . . 146 ALA HN . 26834 1 707 . 1 1 176 176 ALA C C 13 177.619 . . . . . . . 146 ALA C . 26834 1 708 . 1 1 176 176 ALA CA C 13 52.801 . . . . . . . 146 ALA CA . 26834 1 709 . 1 1 176 176 ALA CB C 13 18.487 . . . . . . . 146 ALA CB . 26834 1 710 . 1 1 176 176 ALA N N 15 132.387 . . . . . . . 146 ALA N . 26834 1 711 . 1 1 177 177 GLN H H 1 9.318 . . . . . . . 147 GLN HN . 26834 1 712 . 1 1 177 177 GLN C C 13 174.589 . . . . . . . 147 GLN C . 26834 1 713 . 1 1 177 177 GLN CA C 13 51.710 . . . . . . . 147 GLN CA . 26834 1 714 . 1 1 177 177 GLN CB C 13 28.628 . . . . . . . 147 GLN CB . 26834 1 715 . 1 1 177 177 GLN N N 15 123.078 . . . . . . . 147 GLN N . 26834 1 716 . 1 1 178 178 PRO C C 13 178.094 . . . . . . . 148 PRO C . 26834 1 717 . 1 1 178 178 PRO CA C 13 64.054 . . . . . . . 148 PRO CA . 26834 1 718 . 1 1 178 178 PRO CB C 13 31.701 . . . . . . . 148 PRO CB . 26834 1 719 . 1 1 178 178 PRO CG C 13 27.646 . . . . . . . 148 PRO CG . 26834 1 720 . 1 1 179 179 GLY H H 1 8.963 . . . . . . . 149 GLY HN . 26834 1 721 . 1 1 179 179 GLY C C 13 174.217 . . . . . . . 149 GLY C . 26834 1 722 . 1 1 179 179 GLY CA C 13 45.698 . . . . . . . 149 GLY CA . 26834 1 723 . 1 1 179 179 GLY N N 15 112.270 . . . . . . . 149 GLY N . 26834 1 724 . 1 1 180 180 LYS H H 1 7.553 . . . . . . . 150 LYS HN . 26834 1 725 . 1 1 180 180 LYS C C 13 176.533 . . . . . . . 150 LYS C . 26834 1 726 . 1 1 180 180 LYS CA C 13 52.688 . . . . . . . 150 LYS CA . 26834 1 727 . 1 1 180 180 LYS CB C 13 31.732 . . . . . . . 150 LYS CB . 26834 1 728 . 1 1 180 180 LYS CG C 13 24.095 . . . . . . . 150 LYS CG . 26834 1 729 . 1 1 180 180 LYS CD C 13 27.053 . . . . . . . 150 LYS CD . 26834 1 730 . 1 1 180 180 LYS N N 15 118.103 . . . . . . . 150 LYS N . 26834 1 731 . 1 1 181 181 TYR H H 1 8.479 . . . . . . . 151 TYR HN . 26834 1 732 . 1 1 181 181 TYR C C 13 176.071 . . . . . . . 151 TYR C . 26834 1 733 . 1 1 181 181 TYR CA C 13 58.701 . . . . . . . 151 TYR CA . 26834 1 734 . 1 1 181 181 TYR CB C 13 39.810 . . . . . . . 151 TYR CB . 26834 1 735 . 1 1 181 181 TYR N N 15 118.334 . . . . . . . 151 TYR N . 26834 1 736 . 1 1 182 182 THR H H 1 9.675 . . . . . . . 152 THR HN . 26834 1 737 . 1 1 182 182 THR C C 13 173.057 . . . . . . . 152 THR C . 26834 1 738 . 1 1 182 182 THR CA C 13 60.124 . . . . . . . 152 THR CA . 26834 1 739 . 1 1 182 182 THR CB C 13 70.896 . . . . . . . 152 THR CB . 26834 1 740 . 1 1 182 182 THR N N 15 112.620 . . . . . . . 152 THR N . 26834 1 741 . 1 1 183 183 LEU H H 1 6.042 . . . . . . . 153 LEU HN . 26834 1 742 . 1 1 183 183 LEU C C 13 176.248 . . . . . . . 153 LEU C . 26834 1 743 . 1 1 183 183 LEU CA C 13 54.936 . . . . . . . 153 LEU CA . 26834 1 744 . 1 1 183 183 LEU CB C 13 43.367 . . . . . . . 153 LEU CB . 26834 1 745 . 1 1 183 183 LEU N N 15 124.737 . . . . . . . 153 LEU N . 26834 1 746 . 1 1 184 184 ILE H H 1 8.402 . . . . . . . 154 ILE HN . 26834 1 747 . 1 1 184 184 ILE C C 13 175.475 . . . . . . . 154 ILE C . 26834 1 748 . 1 1 184 184 ILE CA C 13 60.613 . . . . . . . 154 ILE CA . 26834 1 749 . 1 1 184 184 ILE CB C 13 38.444 . . . . . . . 154 ILE CB . 26834 1 750 . 1 1 184 184 ILE CG1 C 13 27.068 . . . . . . . 154 ILE CG1 . 26834 1 751 . 1 1 184 184 ILE CG2 C 13 17.510 . . . . . . . 154 ILE CG2 . 26834 1 752 . 1 1 184 184 ILE CD1 C 13 12.544 . . . . . . . 154 ILE CD1 . 26834 1 753 . 1 1 184 184 ILE N N 15 124.201 . . . . . . . 154 ILE N . 26834 1 754 . 1 1 185 185 GLU H H 1 8.557 . . . . . . . 155 GLU HN . 26834 1 755 . 1 1 185 185 GLU C C 13 176.083 . . . . . . . 155 GLU C . 26834 1 756 . 1 1 185 185 GLU CA C 13 56.338 . . . . . . . 155 GLU CA . 26834 1 757 . 1 1 185 185 GLU CB C 13 30.824 . . . . . . . 155 GLU CB . 26834 1 758 . 1 1 185 185 GLU CG C 13 36.526 . . . . . . . 155 GLU CG . 26834 1 759 . 1 1 185 185 GLU N N 15 125.460 . . . . . . . 155 GLU N . 26834 1 760 . 1 1 186 186 VAL H H 1 8.325 . . . . . . . 156 VAL HN . 26834 1 761 . 1 1 186 186 VAL C C 13 175.832 . . . . . . . 156 VAL C . 26834 1 762 . 1 1 186 186 VAL CA C 13 62.299 . . . . . . . 156 VAL CA . 26834 1 763 . 1 1 186 186 VAL CB C 13 32.887 . . . . . . . 156 VAL CB . 26834 1 764 . 1 1 186 186 VAL CG1 C 13 21.076 . . . . . . . 156 VAL CG1 . 26834 1 765 . 1 1 186 186 VAL CG2 C 13 20.704 . . . . . . . 156 VAL CG2 . 26834 1 766 . 1 1 186 186 VAL N N 15 122.531 . . . . . . . 156 VAL N . 26834 1 767 . 1 1 187 187 GLN H H 1 8.573 . . . . . . . 157 GLN HN . 26834 1 768 . 1 1 187 187 GLN C C 13 174.025 . . . . . . . 157 GLN C . 26834 1 769 . 1 1 187 187 GLN CA C 13 53.537 . . . . . . . 157 GLN CA . 26834 1 770 . 1 1 187 187 GLN CB C 13 28.940 . . . . . . . 157 GLN CB . 26834 1 771 . 1 1 187 187 GLN N N 15 125.682 . . . . . . . 157 GLN N . 26834 1 772 . 1 1 188 188 PRO C C 13 177.575 . . . . . . . 158 PRO C . 26834 1 773 . 1 1 188 188 PRO CA C 13 63.464 . . . . . . . 158 PRO CA . 26834 1 774 . 1 1 188 188 PRO CB C 13 32.125 . . . . . . . 158 PRO CB . 26834 1 775 . 1 1 188 188 PRO CG C 13 27.536 . . . . . . . 158 PRO CG . 26834 1 776 . 1 1 188 188 PRO CD C 13 50.824 . . . . . . . 158 PRO CD . 26834 1 777 . 1 1 189 189 GLY H H 1 8.556 . . . . . . . 159 GLY HN . 26834 1 778 . 1 1 189 189 GLY C C 13 174.070 . . . . . . . 159 GLY C . 26834 1 779 . 1 1 189 189 GLY CA C 13 45.296 . . . . . . . 159 GLY CA . 26834 1 780 . 1 1 189 189 GLY N N 15 109.743 . . . . . . . 159 GLY N . 26834 1 781 . 1 1 190 190 ALA H H 1 8.203 . . . . . . . 160 ALA HN . 26834 1 782 . 1 1 190 190 ALA C C 13 178.446 . . . . . . . 160 ALA C . 26834 1 783 . 1 1 190 190 ALA CA C 13 52.789 . . . . . . . 160 ALA CA . 26834 1 784 . 1 1 190 190 ALA CB C 13 19.329 . . . . . . . 160 ALA CB . 26834 1 785 . 1 1 190 190 ALA N N 15 123.754 . . . . . . . 160 ALA N . 26834 1 786 . 1 1 191 191 GLY H H 1 8.557 . . . . . . . 161 GLY HN . 26834 1 787 . 1 1 191 191 GLY C C 13 174.317 . . . . . . . 161 GLY C . 26834 1 788 . 1 1 191 191 GLY CA C 13 45.466 . . . . . . . 161 GLY CA . 26834 1 789 . 1 1 191 191 GLY N N 15 108.550 . . . . . . . 161 GLY N . 26834 1 790 . 1 1 192 192 GLN H H 1 8.214 . . . . . . . 162 GLN HN . 26834 1 791 . 1 1 192 192 GLN C C 13 176.003 . . . . . . . 162 GLN C . 26834 1 792 . 1 1 192 192 GLN CA C 13 55.879 . . . . . . . 162 GLN CA . 26834 1 793 . 1 1 192 192 GLN CB C 13 29.611 . . . . . . . 162 GLN CB . 26834 1 794 . 1 1 192 192 GLN CG C 13 33.878 . . . . . . . 162 GLN CG . 26834 1 795 . 1 1 192 192 GLN N N 15 119.532 . . . . . . . 162 GLN N . 26834 1 796 . 1 1 193 193 GLU H H 1 8.606 . . . . . . . 163 GLU HN . 26834 1 797 . 1 1 193 193 GLU C C 13 176.563 . . . . . . . 163 GLU C . 26834 1 798 . 1 1 193 193 GLU CA C 13 56.876 . . . . . . . 163 GLU CA . 26834 1 799 . 1 1 193 193 GLU CB C 13 30.041 . . . . . . . 163 GLU CB . 26834 1 800 . 1 1 193 193 GLU CG C 13 33.878 . . . . . . . 163 GLU CG . 26834 1 801 . 1 1 193 193 GLU N N 15 122.282 . . . . . . . 163 GLU N . 26834 1 802 . 1 1 194 194 VAL H H 1 8.162 . . . . . . . 164 VAL HN . 26834 1 803 . 1 1 194 194 VAL C C 13 175.743 . . . . . . . 164 VAL C . 26834 1 804 . 1 1 194 194 VAL CA C 13 62.359 . . . . . . . 164 VAL CA . 26834 1 805 . 1 1 194 194 VAL CB C 13 32.805 . . . . . . . 164 VAL CB . 26834 1 806 . 1 1 194 194 VAL CG1 C 13 20.674 . . . . . . . 164 VAL CG1 . 26834 1 807 . 1 1 194 194 VAL CG2 C 13 21.023 . . . . . . . 164 VAL CG2 . 26834 1 808 . 1 1 194 194 VAL N N 15 121.317 . . . . . . . 164 VAL N . 26834 1 809 . 1 1 195 195 ALA H H 1 8.327 . . . . . . . 165 ALA HN . 26834 1 810 . 1 1 195 195 ALA C C 13 177.317 . . . . . . . 165 ALA C . 26834 1 811 . 1 1 195 195 ALA CA C 13 52.375 . . . . . . . 165 ALA CA . 26834 1 812 . 1 1 195 195 ALA CB C 13 19.275 . . . . . . . 165 ALA CB . 26834 1 813 . 1 1 195 195 ALA N N 15 127.605 . . . . . . . 165 ALA N . 26834 1 814 . 1 1 196 196 LEU H H 1 8.156 . . . . . . . 166 LEU HN . 26834 1 815 . 1 1 196 196 LEU C C 13 176.943 . . . . . . . 166 LEU C . 26834 1 816 . 1 1 196 196 LEU CA C 13 55.018 . . . . . . . 166 LEU CA . 26834 1 817 . 1 1 196 196 LEU CB C 13 42.549 . . . . . . . 166 LEU CB . 26834 1 818 . 1 1 196 196 LEU CG C 13 27.088 . . . . . . . 166 LEU CG . 26834 1 819 . 1 1 196 196 LEU CD1 C 13 23.784 . . . . . . . 166 LEU CD1 . 26834 1 820 . 1 1 196 196 LEU N N 15 121.873 . . . . . . . 166 LEU N . 26834 1 821 . 1 1 197 197 ARG H H 1 8.298 . . . . . . . 167 ARG HN . 26834 1 822 . 1 1 197 197 ARG C C 13 175.937 . . . . . . . 167 ARG C . 26834 1 823 . 1 1 197 197 ARG CA C 13 55.975 . . . . . . . 167 ARG CA . 26834 1 824 . 1 1 197 197 ARG CB C 13 31.043 . . . . . . . 167 ARG CB . 26834 1 825 . 1 1 197 197 ARG CG C 13 27.182 . . . . . . . 167 ARG CG . 26834 1 826 . 1 1 197 197 ARG CD C 13 43.401 . . . . . . . 167 ARG CD . 26834 1 827 . 1 1 197 197 ARG N N 15 123.053 . . . . . . . 167 ARG N . 26834 1 828 . 1 1 198 198 VAL H H 1 8.341 . . . . . . . 168 VAL HN . 26834 1 829 . 1 1 198 198 VAL C C 13 174.916 . . . . . . . 168 VAL C . 26834 1 830 . 1 1 198 198 VAL CA C 13 61.994 . . . . . . . 168 VAL CA . 26834 1 831 . 1 1 198 198 VAL CB C 13 32.976 . . . . . . . 168 VAL CB . 26834 1 832 . 1 1 198 198 VAL CG1 C 13 19.944 . . . . . . . 168 VAL CG1 . 26834 1 833 . 1 1 198 198 VAL CG2 C 13 21.323 . . . . . . . 168 VAL CG2 . 26834 1 834 . 1 1 198 198 VAL N N 15 121.959 . . . . . . . 168 VAL N . 26834 1 835 . 1 1 199 199 ASP H H 1 8.017 . . . . . . . 169 ASP HN . 26834 1 836 . 1 1 199 199 ASP C C 13 180.758 . . . . . . . 169 ASP C . 26834 1 837 . 1 1 199 199 ASP CA C 13 55.907 . . . . . . . 169 ASP CA . 26834 1 838 . 1 1 199 199 ASP CB C 13 42.386 . . . . . . . 169 ASP CB . 26834 1 839 . 1 1 199 199 ASP N N 15 129.264 . . . . . . . 169 ASP N . 26834 1 stop_ save_