data_26535 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26535 _Entry.Title ; Assignment of the BeF3-activated PmrA response regulator from Klebsiella pneumoniae in complex with the promoter DNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-03-09 _Entry.Accession_date 2015-03-09 _Entry.Last_release_date 2015-11-12 _Entry.Original_release_date 2015-11-12 _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 Yuan-Chao Lou . . . . 26535 2 Yi-Fen Kao . . . . 26535 3 Chinpan Chen . . . . 26535 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 26535 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26535 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 502 26535 '15N chemical shifts' 200 26535 '1H chemical shifts' 497 26535 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 . . 2016-07-13 2015-03-01 update BMRB 'update entry citation' 26535 1 . . 2015-11-12 2015-03-01 original author 'original release' 26535 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26535 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26564787 _Citation.Full_citation . _Citation.Title ; Structure and dynamics of polymyxin-resistance-associated response regulator PmrA in complex with promoter DNA ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume 6 _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 8838 _Citation.Page_last 8838 _Citation.Year 2015 _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 Yuan-Chao Lou . . . . 26535 1 2 Tsai-Hsuan Weng . . . . 26535 1 3 Yi-Chuan Li . . . . 26535 1 4 Yi-Fen Kao . . . . 26535 1 5 Shan-Ho Chou . . . . 26535 1 6 Chwan-Deng Hsiao . . . . 26535 1 7 Chinpan Chen . . . . 26535 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26535 _Assembly.ID 1 _Assembly.Name 'PmrA-DNA complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _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 'subunit 1' 1 $PmrA A . yes native no no . . . 26535 1 2 'subunit 2' 1 $PmrA B . no native no no . . . 26535 1 3 DNA 2 $DNA C . no native no no . . . 26535 1 4 'BERYLLIUM TRIFLUORIDE ION' 3 $entity_BEF D . no native no no . . . 26535 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PmrA _Entity.Sf_category entity _Entity.Sf_framecode PmrA _Entity.Entry_ID 26535 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PmrA _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 ; MKILVIEDDALLLQGLILAM QSEGYVCDGVSTAHEAALSL ASNHYSLIVLDLGLPDEDGL HFLSRMRREKMTQPVLILTA RDTLEDRISGLDTGADDYLV KPFALEELNARIRALLRRHN NQGDNEISVGNLRLNVTRRL VWLGETALDLTPKEYALLSR LMMKAGSPVHREILYNDIYS GDNEPATNTLEVHIHNLREK IGKSRIRTVRGFGYMLANND DTELEHHHHHH ; _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 231 _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_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 MET . 26535 1 2 2 LYS . 26535 1 3 3 ILE . 26535 1 4 4 LEU . 26535 1 5 5 VAL . 26535 1 6 6 ILE . 26535 1 7 7 GLU . 26535 1 8 8 ASP . 26535 1 9 9 ASP . 26535 1 10 10 ALA . 26535 1 11 11 LEU . 26535 1 12 12 LEU . 26535 1 13 13 LEU . 26535 1 14 14 GLN . 26535 1 15 15 GLY . 26535 1 16 16 LEU . 26535 1 17 17 ILE . 26535 1 18 18 LEU . 26535 1 19 19 ALA . 26535 1 20 20 MET . 26535 1 21 21 GLN . 26535 1 22 22 SER . 26535 1 23 23 GLU . 26535 1 24 24 GLY . 26535 1 25 25 TYR . 26535 1 26 26 VAL . 26535 1 27 27 CYS . 26535 1 28 28 ASP . 26535 1 29 29 GLY . 26535 1 30 30 VAL . 26535 1 31 31 SER . 26535 1 32 32 THR . 26535 1 33 33 ALA . 26535 1 34 34 HIS . 26535 1 35 35 GLU . 26535 1 36 36 ALA . 26535 1 37 37 ALA . 26535 1 38 38 LEU . 26535 1 39 39 SER . 26535 1 40 40 LEU . 26535 1 41 41 ALA . 26535 1 42 42 SER . 26535 1 43 43 ASN . 26535 1 44 44 HIS . 26535 1 45 45 TYR . 26535 1 46 46 SER . 26535 1 47 47 LEU . 26535 1 48 48 ILE . 26535 1 49 49 VAL . 26535 1 50 50 LEU . 26535 1 51 51 ASP . 26535 1 52 52 LEU . 26535 1 53 53 GLY . 26535 1 54 54 LEU . 26535 1 55 55 PRO . 26535 1 56 56 ASP . 26535 1 57 57 GLU . 26535 1 58 58 ASP . 26535 1 59 59 GLY . 26535 1 60 60 LEU . 26535 1 61 61 HIS . 26535 1 62 62 PHE . 26535 1 63 63 LEU . 26535 1 64 64 SER . 26535 1 65 65 ARG . 26535 1 66 66 MET . 26535 1 67 67 ARG . 26535 1 68 68 ARG . 26535 1 69 69 GLU . 26535 1 70 70 LYS . 26535 1 71 71 MET . 26535 1 72 72 THR . 26535 1 73 73 GLN . 26535 1 74 74 PRO . 26535 1 75 75 VAL . 26535 1 76 76 LEU . 26535 1 77 77 ILE . 26535 1 78 78 LEU . 26535 1 79 79 THR . 26535 1 80 80 ALA . 26535 1 81 81 ARG . 26535 1 82 82 ASP . 26535 1 83 83 THR . 26535 1 84 84 LEU . 26535 1 85 85 GLU . 26535 1 86 86 ASP . 26535 1 87 87 ARG . 26535 1 88 88 ILE . 26535 1 89 89 SER . 26535 1 90 90 GLY . 26535 1 91 91 LEU . 26535 1 92 92 ASP . 26535 1 93 93 THR . 26535 1 94 94 GLY . 26535 1 95 95 ALA . 26535 1 96 96 ASP . 26535 1 97 97 ASP . 26535 1 98 98 TYR . 26535 1 99 99 LEU . 26535 1 100 100 VAL . 26535 1 101 101 LYS . 26535 1 102 102 PRO . 26535 1 103 103 PHE . 26535 1 104 104 ALA . 26535 1 105 105 LEU . 26535 1 106 106 GLU . 26535 1 107 107 GLU . 26535 1 108 108 LEU . 26535 1 109 109 ASN . 26535 1 110 110 ALA . 26535 1 111 111 ARG . 26535 1 112 112 ILE . 26535 1 113 113 ARG . 26535 1 114 114 ALA . 26535 1 115 115 LEU . 26535 1 116 116 LEU . 26535 1 117 117 ARG . 26535 1 118 118 ARG . 26535 1 119 119 HIS . 26535 1 120 120 ASN . 26535 1 121 121 ASN . 26535 1 122 122 GLN . 26535 1 123 123 GLY . 26535 1 124 124 ASP . 26535 1 125 125 ASN . 26535 1 126 126 GLU . 26535 1 127 127 ILE . 26535 1 128 128 SER . 26535 1 129 129 VAL . 26535 1 130 130 GLY . 26535 1 131 131 ASN . 26535 1 132 132 LEU . 26535 1 133 133 ARG . 26535 1 134 134 LEU . 26535 1 135 135 ASN . 26535 1 136 136 VAL . 26535 1 137 137 THR . 26535 1 138 138 ARG . 26535 1 139 139 ARG . 26535 1 140 140 LEU . 26535 1 141 141 VAL . 26535 1 142 142 TRP . 26535 1 143 143 LEU . 26535 1 144 144 GLY . 26535 1 145 145 GLU . 26535 1 146 146 THR . 26535 1 147 147 ALA . 26535 1 148 148 LEU . 26535 1 149 149 ASP . 26535 1 150 150 LEU . 26535 1 151 151 THR . 26535 1 152 152 PRO . 26535 1 153 153 LYS . 26535 1 154 154 GLU . 26535 1 155 155 TYR . 26535 1 156 156 ALA . 26535 1 157 157 LEU . 26535 1 158 158 LEU . 26535 1 159 159 SER . 26535 1 160 160 ARG . 26535 1 161 161 LEU . 26535 1 162 162 MET . 26535 1 163 163 MET . 26535 1 164 164 LYS . 26535 1 165 165 ALA . 26535 1 166 166 GLY . 26535 1 167 167 SER . 26535 1 168 168 PRO . 26535 1 169 169 VAL . 26535 1 170 170 HIS . 26535 1 171 171 ARG . 26535 1 172 172 GLU . 26535 1 173 173 ILE . 26535 1 174 174 LEU . 26535 1 175 175 TYR . 26535 1 176 176 ASN . 26535 1 177 177 ASP . 26535 1 178 178 ILE . 26535 1 179 179 TYR . 26535 1 180 180 SER . 26535 1 181 181 GLY . 26535 1 182 182 ASP . 26535 1 183 183 ASN . 26535 1 184 184 GLU . 26535 1 185 185 PRO . 26535 1 186 186 ALA . 26535 1 187 187 THR . 26535 1 188 188 ASN . 26535 1 189 189 THR . 26535 1 190 190 LEU . 26535 1 191 191 GLU . 26535 1 192 192 VAL . 26535 1 193 193 HIS . 26535 1 194 194 ILE . 26535 1 195 195 HIS . 26535 1 196 196 ASN . 26535 1 197 197 LEU . 26535 1 198 198 ARG . 26535 1 199 199 GLU . 26535 1 200 200 LYS . 26535 1 201 201 ILE . 26535 1 202 202 GLY . 26535 1 203 203 LYS . 26535 1 204 204 SER . 26535 1 205 205 ARG . 26535 1 206 206 ILE . 26535 1 207 207 ARG . 26535 1 208 208 THR . 26535 1 209 209 VAL . 26535 1 210 210 ARG . 26535 1 211 211 GLY . 26535 1 212 212 PHE . 26535 1 213 213 GLY . 26535 1 214 214 TYR . 26535 1 215 215 MET . 26535 1 216 216 LEU . 26535 1 217 217 ALA . 26535 1 218 218 ASN . 26535 1 219 219 ASN . 26535 1 220 220 ASP . 26535 1 221 221 ASP . 26535 1 222 222 THR . 26535 1 223 223 GLU . 26535 1 224 224 LEU . 26535 1 225 225 GLU . 26535 1 226 226 HIS . 26535 1 227 227 HIS . 26535 1 228 228 HIS . 26535 1 229 229 HIS . 26535 1 230 230 HIS . 26535 1 231 231 HIS . 26535 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 26535 1 . LYS 2 2 26535 1 . ILE 3 3 26535 1 . LEU 4 4 26535 1 . VAL 5 5 26535 1 . ILE 6 6 26535 1 . GLU 7 7 26535 1 . ASP 8 8 26535 1 . ASP 9 9 26535 1 . ALA 10 10 26535 1 . LEU 11 11 26535 1 . LEU 12 12 26535 1 . LEU 13 13 26535 1 . GLN 14 14 26535 1 . GLY 15 15 26535 1 . LEU 16 16 26535 1 . ILE 17 17 26535 1 . LEU 18 18 26535 1 . ALA 19 19 26535 1 . MET 20 20 26535 1 . GLN 21 21 26535 1 . SER 22 22 26535 1 . GLU 23 23 26535 1 . GLY 24 24 26535 1 . TYR 25 25 26535 1 . VAL 26 26 26535 1 . CYS 27 27 26535 1 . ASP 28 28 26535 1 . GLY 29 29 26535 1 . VAL 30 30 26535 1 . SER 31 31 26535 1 . THR 32 32 26535 1 . ALA 33 33 26535 1 . HIS 34 34 26535 1 . GLU 35 35 26535 1 . ALA 36 36 26535 1 . ALA 37 37 26535 1 . LEU 38 38 26535 1 . SER 39 39 26535 1 . LEU 40 40 26535 1 . ALA 41 41 26535 1 . SER 42 42 26535 1 . ASN 43 43 26535 1 . HIS 44 44 26535 1 . TYR 45 45 26535 1 . SER 46 46 26535 1 . LEU 47 47 26535 1 . ILE 48 48 26535 1 . VAL 49 49 26535 1 . LEU 50 50 26535 1 . ASP 51 51 26535 1 . LEU 52 52 26535 1 . GLY 53 53 26535 1 . LEU 54 54 26535 1 . PRO 55 55 26535 1 . ASP 56 56 26535 1 . GLU 57 57 26535 1 . ASP 58 58 26535 1 . GLY 59 59 26535 1 . LEU 60 60 26535 1 . HIS 61 61 26535 1 . PHE 62 62 26535 1 . LEU 63 63 26535 1 . SER 64 64 26535 1 . ARG 65 65 26535 1 . MET 66 66 26535 1 . ARG 67 67 26535 1 . ARG 68 68 26535 1 . GLU 69 69 26535 1 . LYS 70 70 26535 1 . MET 71 71 26535 1 . THR 72 72 26535 1 . GLN 73 73 26535 1 . PRO 74 74 26535 1 . VAL 75 75 26535 1 . LEU 76 76 26535 1 . ILE 77 77 26535 1 . LEU 78 78 26535 1 . THR 79 79 26535 1 . ALA 80 80 26535 1 . ARG 81 81 26535 1 . ASP 82 82 26535 1 . THR 83 83 26535 1 . LEU 84 84 26535 1 . GLU 85 85 26535 1 . ASP 86 86 26535 1 . ARG 87 87 26535 1 . ILE 88 88 26535 1 . SER 89 89 26535 1 . GLY 90 90 26535 1 . LEU 91 91 26535 1 . ASP 92 92 26535 1 . THR 93 93 26535 1 . GLY 94 94 26535 1 . ALA 95 95 26535 1 . ASP 96 96 26535 1 . ASP 97 97 26535 1 . TYR 98 98 26535 1 . LEU 99 99 26535 1 . VAL 100 100 26535 1 . LYS 101 101 26535 1 . PRO 102 102 26535 1 . PHE 103 103 26535 1 . ALA 104 104 26535 1 . LEU 105 105 26535 1 . GLU 106 106 26535 1 . GLU 107 107 26535 1 . LEU 108 108 26535 1 . ASN 109 109 26535 1 . ALA 110 110 26535 1 . ARG 111 111 26535 1 . ILE 112 112 26535 1 . ARG 113 113 26535 1 . ALA 114 114 26535 1 . LEU 115 115 26535 1 . LEU 116 116 26535 1 . ARG 117 117 26535 1 . ARG 118 118 26535 1 . HIS 119 119 26535 1 . ASN 120 120 26535 1 . ASN 121 121 26535 1 . GLN 122 122 26535 1 . GLY 123 123 26535 1 . ASP 124 124 26535 1 . ASN 125 125 26535 1 . GLU 126 126 26535 1 . ILE 127 127 26535 1 . SER 128 128 26535 1 . VAL 129 129 26535 1 . GLY 130 130 26535 1 . ASN 131 131 26535 1 . LEU 132 132 26535 1 . ARG 133 133 26535 1 . LEU 134 134 26535 1 . ASN 135 135 26535 1 . VAL 136 136 26535 1 . THR 137 137 26535 1 . ARG 138 138 26535 1 . ARG 139 139 26535 1 . LEU 140 140 26535 1 . VAL 141 141 26535 1 . TRP 142 142 26535 1 . LEU 143 143 26535 1 . GLY 144 144 26535 1 . GLU 145 145 26535 1 . THR 146 146 26535 1 . ALA 147 147 26535 1 . LEU 148 148 26535 1 . ASP 149 149 26535 1 . LEU 150 150 26535 1 . THR 151 151 26535 1 . PRO 152 152 26535 1 . LYS 153 153 26535 1 . GLU 154 154 26535 1 . TYR 155 155 26535 1 . ALA 156 156 26535 1 . LEU 157 157 26535 1 . LEU 158 158 26535 1 . SER 159 159 26535 1 . ARG 160 160 26535 1 . LEU 161 161 26535 1 . MET 162 162 26535 1 . MET 163 163 26535 1 . LYS 164 164 26535 1 . ALA 165 165 26535 1 . GLY 166 166 26535 1 . SER 167 167 26535 1 . PRO 168 168 26535 1 . VAL 169 169 26535 1 . HIS 170 170 26535 1 . ARG 171 171 26535 1 . GLU 172 172 26535 1 . ILE 173 173 26535 1 . LEU 174 174 26535 1 . TYR 175 175 26535 1 . ASN 176 176 26535 1 . ASP 177 177 26535 1 . ILE 178 178 26535 1 . TYR 179 179 26535 1 . SER 180 180 26535 1 . GLY 181 181 26535 1 . ASP 182 182 26535 1 . ASN 183 183 26535 1 . GLU 184 184 26535 1 . PRO 185 185 26535 1 . ALA 186 186 26535 1 . THR 187 187 26535 1 . ASN 188 188 26535 1 . THR 189 189 26535 1 . LEU 190 190 26535 1 . GLU 191 191 26535 1 . VAL 192 192 26535 1 . HIS 193 193 26535 1 . ILE 194 194 26535 1 . HIS 195 195 26535 1 . ASN 196 196 26535 1 . LEU 197 197 26535 1 . ARG 198 198 26535 1 . GLU 199 199 26535 1 . LYS 200 200 26535 1 . ILE 201 201 26535 1 . GLY 202 202 26535 1 . LYS 203 203 26535 1 . SER 204 204 26535 1 . ARG 205 205 26535 1 . ILE 206 206 26535 1 . ARG 207 207 26535 1 . THR 208 208 26535 1 . VAL 209 209 26535 1 . ARG 210 210 26535 1 . GLY 211 211 26535 1 . PHE 212 212 26535 1 . GLY 213 213 26535 1 . TYR 214 214 26535 1 . MET 215 215 26535 1 . LEU 216 216 26535 1 . ALA 217 217 26535 1 . ASN 218 218 26535 1 . ASN 219 219 26535 1 . ASP 220 220 26535 1 . ASP 221 221 26535 1 . THR 222 222 26535 1 . GLU 223 223 26535 1 . LEU 224 224 26535 1 . GLU 225 225 26535 1 . HIS 226 226 26535 1 . HIS 227 227 26535 1 . HIS 228 228 26535 1 . HIS 229 229 26535 1 . HIS 230 230 26535 1 . HIS 231 231 26535 1 stop_ save_ save_DNA _Entity.Sf_category entity _Entity.Sf_framecode DNA _Entity.Entry_ID 26535 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name DNA _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 ; ATTTCTTAATATTATCCTAA GCAAG ; _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 25 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _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_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 DA . 26535 2 2 2 DT . 26535 2 3 3 DT . 26535 2 4 4 DT . 26535 2 5 5 DC . 26535 2 6 6 DT . 26535 2 7 7 DT . 26535 2 8 8 DA . 26535 2 9 9 DA . 26535 2 10 10 DT . 26535 2 11 11 DA . 26535 2 12 12 DT . 26535 2 13 13 DT . 26535 2 14 14 DA . 26535 2 15 15 DT . 26535 2 16 16 DC . 26535 2 17 17 DC . 26535 2 18 18 DT . 26535 2 19 19 DA . 26535 2 20 20 DA . 26535 2 21 21 DG . 26535 2 22 22 DC . 26535 2 23 23 DA . 26535 2 24 24 DA . 26535 2 25 25 DG . 26535 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 . DA 1 1 26535 2 . DT 2 2 26535 2 . DT 3 3 26535 2 . DT 4 4 26535 2 . DC 5 5 26535 2 . DT 6 6 26535 2 . DT 7 7 26535 2 . DA 8 8 26535 2 . DA 9 9 26535 2 . DT 10 10 26535 2 . DA 11 11 26535 2 . DT 12 12 26535 2 . DT 13 13 26535 2 . DA 14 14 26535 2 . DT 15 15 26535 2 . DC 16 16 26535 2 . DC 17 17 26535 2 . DT 18 18 26535 2 . DA 19 19 26535 2 . DA 20 20 26535 2 . DG 21 21 26535 2 . DC 22 22 26535 2 . DA 23 23 26535 2 . DA 24 24 26535 2 . DG 25 25 26535 2 stop_ save_ save_entity_BEF _Entity.Sf_category entity _Entity.Sf_framecode entity_BEF _Entity.Entry_ID 26535 _Entity.ID 3 _Entity.BMRB_code BEF _Entity.Name 'BERYLLIUM TRIFLUORIDE ION' _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 BEF _Entity.Nonpolymer_comp_label $chem_comp_BEF _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 66.007 _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 'BERYLLIUM TRIFLUORIDE ION' BMRB 26535 3 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'BERYLLIUM TRIFLUORIDE ION' BMRB 26535 3 BEF 'Three letter code' 26535 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 1 BEF $chem_comp_BEF 26535 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 26535 _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 $PmrA . 573 organism . 'klebsiella pneumoniae' enterobacteria . . Bacteria . klebsiella pneumoniae . . . . . . . . . . . . . 26535 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 26535 _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 $PmrA . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 DE3' . . . . . pet29b . . . 26535 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_BEF _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_BEF _Chem_comp.Entry_ID 26535 _Chem_comp.ID BEF _Chem_comp.Provenance PDB _Chem_comp.Name 'BERYLLIUM TRIFLUORIDE ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code BEF _Chem_comp.PDB_code BEF _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code BEF _Chem_comp.Number_atoms_all 4 _Chem_comp.Number_atoms_nh 4 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Be.3FH/h;3*1H/q+2;;;/p-3 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge -1 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'Be F3' _Chem_comp.Formula_weight 66.007 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag yes _Chem_comp.Model_coordinates_db_code 1LVK _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID F[Be-](F)F SMILES ACDLabs 10.04 26535 BEF F[Be-](F)F SMILES CACTVS 3.341 26535 BEF F[Be-](F)F SMILES_CANONICAL CACTVS 3.341 26535 BEF InChI=1S/Be.3FH/h;3*1H/q+2;;;/p-3 InChI InChI 1.03 26535 BEF OGIAHMCCNXDTIE-UHFFFAOYSA-K InChIKey InChI 1.03 26535 BEF [Be-](F)(F)F SMILES 'OpenEye OEToolkits' 1.5.0 26535 BEF [Be-](F)(F)F SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 26535 BEF stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID trifluoroberyllate(1-) 'SYSTEMATIC NAME' ACDLabs 10.04 26535 BEF trifluoroberyllium 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 26535 BEF stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID BE BE BE BE . BE . . N -1 . . . 0 no no . . . . 32.595 . 58.188 . 22.992 . . . . 1 . 26535 BEF F1 F1 F1 F1 . F . . N 0 . . . 1 no no . . . . 31.324 . 57.364 . 23.232 . . . . 2 . 26535 BEF F2 F2 F2 F2 . F . . N 0 . . . 1 no no . . . . 33.110 . 58.885 . 24.291 . . . . 3 . 26535 BEF F3 F3 F3 F3 . F . . N 0 . . . 1 no no . . . . 32.321 . 59.297 . 21.951 . . . . 4 . 26535 BEF stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING BE F1 no N 1 . 26535 BEF 2 . SING BE F2 no N 2 . 26535 BEF 3 . SING BE F3 no N 3 . 26535 BEF stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26535 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'PmrA + 25bp DNA (1:1)' _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 PmrA '[U-99% 13C; U-99% 15N; U-95% 2H]]' . . 1 $PmrA . . 0.5 . . mM . . . . 26535 1 2 DNA 'natural abundance' . . 2 $DNA . . 0.5 . . mM . . . . 26535 1 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 26535 1 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 26535 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26535 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26535 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 26535 _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' 0.22 . M 26535 1 pH 8.0 . pH 26535 1 pressure 1 . atm 26535 1 temperature 310 . K 26535 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26535 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26535 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26535 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 26535 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 26535 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26535 2 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 26535 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 26535 _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 Avance . 850 . . . 26535 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 26535 _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 . . . . . . . . . . . . . . . . 26535 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26535 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26535 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 26535 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26535 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26535 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26535 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 26535 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 26535 1 2 '3D HNCO' . . . 26535 1 3 '3D HNCA' . . . 26535 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 2 $NMRView . . 26535 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 2 2 LYS C C 13 175.3670 0.20 . 1 . . . . 2 LYS C . 26535 1 2 . 1 1 2 2 LYS CA C 13 54.7650 0.20 . 1 . . . . 2 LYS CA . 26535 1 3 . 1 1 3 3 ILE H H 1 9.0840 0.02 . 1 . . . . 3 ILE HN . 26535 1 4 . 1 1 3 3 ILE HD11 H 1 0.1214 0.02 . 1 . . . . 3 ILE HD11 . 26535 1 5 . 1 1 3 3 ILE HD12 H 1 0.1214 0.02 . 1 . . . . 3 ILE HD11 . 26535 1 6 . 1 1 3 3 ILE HD13 H 1 0.1214 0.02 . 1 . . . . 3 ILE HD11 . 26535 1 7 . 1 1 3 3 ILE C C 13 173.6150 0.20 . 1 . . . . 3 ILE C . 26535 1 8 . 1 1 3 3 ILE CA C 13 58.9100 0.20 . 1 . . . . 3 ILE CA . 26535 1 9 . 1 1 3 3 ILE CD1 C 13 11.9922 0.20 . 1 . . . . 3 ILE CD1 . 26535 1 10 . 1 1 3 3 ILE N N 15 126.7320 0.20 . 1 . . . . 3 ILE N . 26535 1 11 . 1 1 4 4 LEU H H 1 7.8180 0.02 . 1 . . . . 4 LEU HN . 26535 1 12 . 1 1 4 4 LEU HD11 H 1 0.4935 0.02 . 1 . . . . 4 LEU HD11 . 26535 1 13 . 1 1 4 4 LEU HD12 H 1 0.4935 0.02 . 1 . . . . 4 LEU HD11 . 26535 1 14 . 1 1 4 4 LEU HD13 H 1 0.4935 0.02 . 1 . . . . 4 LEU HD11 . 26535 1 15 . 1 1 4 4 LEU HD21 H 1 0.4236 0.02 . 1 . . . . 4 LEU HD21 . 26535 1 16 . 1 1 4 4 LEU HD22 H 1 0.4236 0.02 . 1 . . . . 4 LEU HD21 . 26535 1 17 . 1 1 4 4 LEU HD23 H 1 0.4236 0.02 . 1 . . . . 4 LEU HD21 . 26535 1 18 . 1 1 4 4 LEU C C 13 173.4230 0.20 . 1 . . . . 4 LEU C . 26535 1 19 . 1 1 4 4 LEU CA C 13 52.4020 0.20 . 1 . . . . 4 LEU CA . 26535 1 20 . 1 1 4 4 LEU CD1 C 13 21.9745 0.20 . 1 . . . . 4 LEU CD1 . 26535 1 21 . 1 1 4 4 LEU CD2 C 13 26.5330 0.20 . 1 . . . . 4 LEU CD2 . 26535 1 22 . 1 1 4 4 LEU N N 15 128.3740 0.20 . 1 . . . . 4 LEU N . 26535 1 23 . 1 1 5 5 VAL H H 1 8.6930 0.02 . 1 . . . . 5 VAL HN . 26535 1 24 . 1 1 5 5 VAL HG11 H 1 0.7295 0.02 . 1 . . . . 5 VAL HG11 . 26535 1 25 . 1 1 5 5 VAL HG12 H 1 0.7295 0.02 . 1 . . . . 5 VAL HG11 . 26535 1 26 . 1 1 5 5 VAL HG13 H 1 0.7295 0.02 . 1 . . . . 5 VAL HG11 . 26535 1 27 . 1 1 5 5 VAL HG21 H 1 0.5995 0.02 . 1 . . . . 5 VAL HG21 . 26535 1 28 . 1 1 5 5 VAL HG22 H 1 0.5995 0.02 . 1 . . . . 5 VAL HG21 . 26535 1 29 . 1 1 5 5 VAL HG23 H 1 0.5995 0.02 . 1 . . . . 5 VAL HG21 . 26535 1 30 . 1 1 5 5 VAL C C 13 173.3650 0.20 . 1 . . . . 5 VAL C . 26535 1 31 . 1 1 5 5 VAL CA C 13 60.6230 0.20 . 1 . . . . 5 VAL CA . 26535 1 32 . 1 1 5 5 VAL CG1 C 13 22.7402 0.20 . 1 . . . . 5 VAL CG1 . 26535 1 33 . 1 1 5 5 VAL CG2 C 13 21.3738 0.20 . 1 . . . . 5 VAL CG2 . 26535 1 34 . 1 1 5 5 VAL N N 15 127.1250 0.20 . 1 . . . . 5 VAL N . 26535 1 35 . 1 1 6 6 ILE H H 1 8.5430 0.02 . 1 . . . . 6 ILE HN . 26535 1 36 . 1 1 6 6 ILE HD11 H 1 0.4500 0.02 . 1 . . . . 6 ILE HD11 . 26535 1 37 . 1 1 6 6 ILE HD12 H 1 0.4500 0.02 . 1 . . . . 6 ILE HD11 . 26535 1 38 . 1 1 6 6 ILE HD13 H 1 0.4500 0.02 . 1 . . . . 6 ILE HD11 . 26535 1 39 . 1 1 6 6 ILE C C 13 173.6740 0.20 . 1 . . . . 6 ILE C . 26535 1 40 . 1 1 6 6 ILE CA C 13 59.1840 0.20 . 1 . . . . 6 ILE CA . 26535 1 41 . 1 1 6 6 ILE CD1 C 13 16.8838 0.20 . 1 . . . . 6 ILE CD1 . 26535 1 42 . 1 1 6 6 ILE N N 15 128.2420 0.20 . 1 . . . . 6 ILE N . 26535 1 43 . 1 1 7 7 GLU H H 1 8.2370 0.02 . 1 . . . . 7 GLU HN . 26535 1 44 . 1 1 7 7 GLU C C 13 173.2620 0.20 . 1 . . . . 7 GLU C . 26535 1 45 . 1 1 7 7 GLU CA C 13 56.0670 0.20 . 1 . . . . 7 GLU CA . 26535 1 46 . 1 1 7 7 GLU N N 15 125.7730 0.20 . 1 . . . . 7 GLU N . 26535 1 47 . 1 1 8 8 ASP H H 1 8.6110 0.02 . 1 . . . . 8 ASP HN . 26535 1 48 . 1 1 8 8 ASP C C 13 176.2790 0.20 . 1 . . . . 8 ASP C . 26535 1 49 . 1 1 8 8 ASP CA C 13 54.1490 0.20 . 1 . . . . 8 ASP CA . 26535 1 50 . 1 1 8 8 ASP N N 15 123.9360 0.20 . 1 . . . . 8 ASP N . 26535 1 51 . 1 1 9 9 ASP H H 1 10.3570 0.02 . 1 . . . . 9 ASP HN . 26535 1 52 . 1 1 9 9 ASP C C 13 175.9410 0.20 . 1 . . . . 9 ASP C . 26535 1 53 . 1 1 9 9 ASP CA C 13 53.6350 0.20 . 1 . . . . 9 ASP CA . 26535 1 54 . 1 1 9 9 ASP N N 15 127.3000 0.20 . 1 . . . . 9 ASP N . 26535 1 55 . 1 1 10 10 ALA H H 1 8.3680 0.02 . 1 . . . . 10 ALA HN . 26535 1 56 . 1 1 10 10 ALA C C 13 180.2540 0.20 . 1 . . . . 10 ALA C . 26535 1 57 . 1 1 10 10 ALA CA C 13 54.7310 0.20 . 1 . . . . 10 ALA CA . 26535 1 58 . 1 1 10 10 ALA N N 15 130.6000 0.20 . 1 . . . . 10 ALA N . 26535 1 59 . 1 1 11 11 LEU H H 1 7.8680 0.02 . 1 . . . . 11 LEU HN . 26535 1 60 . 1 1 11 11 LEU HD11 H 1 0.9197 0.02 . 1 . . . . 11 LEU HD11 . 26535 1 61 . 1 1 11 11 LEU HD12 H 1 0.9197 0.02 . 1 . . . . 11 LEU HD11 . 26535 1 62 . 1 1 11 11 LEU HD13 H 1 0.9197 0.02 . 1 . . . . 11 LEU HD11 . 26535 1 63 . 1 1 11 11 LEU HD21 H 1 0.8471 0.02 . 1 . . . . 11 LEU HD21 . 26535 1 64 . 1 1 11 11 LEU HD22 H 1 0.8471 0.02 . 1 . . . . 11 LEU HD21 . 26535 1 65 . 1 1 11 11 LEU HD23 H 1 0.8471 0.02 . 1 . . . . 11 LEU HD21 . 26535 1 66 . 1 1 11 11 LEU C C 13 180.2410 0.20 . 1 . . . . 11 LEU C . 26535 1 67 . 1 1 11 11 LEU CA C 13 57.0950 0.20 . 1 . . . . 11 LEU CA . 26535 1 68 . 1 1 11 11 LEU CD1 C 13 24.3055 0.20 . 1 . . . . 11 LEU CD1 . 26535 1 69 . 1 1 11 11 LEU CD2 C 13 23.5081 0.20 . 1 . . . . 11 LEU CD2 . 26535 1 70 . 1 1 11 11 LEU N N 15 118.6780 0.20 . 1 . . . . 11 LEU N . 26535 1 71 . 1 1 12 12 LEU H H 1 7.7030 0.02 . 1 . . . . 12 LEU HN . 26535 1 72 . 1 1 12 12 LEU HD11 H 1 0.9777 0.02 . 1 . . . . 12 LEU HD11 . 26535 1 73 . 1 1 12 12 LEU HD12 H 1 0.9777 0.02 . 1 . . . . 12 LEU HD11 . 26535 1 74 . 1 1 12 12 LEU HD13 H 1 0.9777 0.02 . 1 . . . . 12 LEU HD11 . 26535 1 75 . 1 1 12 12 LEU C C 13 178.7240 0.20 . 1 . . . . 12 LEU C . 26535 1 76 . 1 1 12 12 LEU CA C 13 56.8210 0.20 . 1 . . . . 12 LEU CA . 26535 1 77 . 1 1 12 12 LEU CD1 C 13 24.3670 0.20 . 1 . . . . 12 LEU CD1 . 26535 1 78 . 1 1 12 12 LEU N N 15 124.1980 0.20 . 1 . . . . 12 LEU N . 26535 1 79 . 1 1 13 13 LEU H H 1 8.8340 0.02 . 1 . . . . 13 LEU HN . 26535 1 80 . 1 1 13 13 LEU HD11 H 1 0.8214 0.02 . 1 . . . . 13 LEU HD11 . 26535 1 81 . 1 1 13 13 LEU HD12 H 1 0.8214 0.02 . 1 . . . . 13 LEU HD11 . 26535 1 82 . 1 1 13 13 LEU HD13 H 1 0.8214 0.02 . 1 . . . . 13 LEU HD11 . 26535 1 83 . 1 1 13 13 LEU HD21 H 1 0.5974 0.02 . 1 . . . . 13 LEU HD21 . 26535 1 84 . 1 1 13 13 LEU HD22 H 1 0.5974 0.02 . 1 . . . . 13 LEU HD21 . 26535 1 85 . 1 1 13 13 LEU HD23 H 1 0.5974 0.02 . 1 . . . . 13 LEU HD21 . 26535 1 86 . 1 1 13 13 LEU C C 13 177.6780 0.20 . 1 . . . . 13 LEU C . 26535 1 87 . 1 1 13 13 LEU CA C 13 58.2940 0.20 . 1 . . . . 13 LEU CA . 26535 1 88 . 1 1 13 13 LEU CD1 C 13 23.4512 0.20 . 1 . . . . 13 LEU CD1 . 26535 1 89 . 1 1 13 13 LEU CD2 C 13 26.7500 0.20 . 1 . . . . 13 LEU CD2 . 26535 1 90 . 1 1 13 13 LEU N N 15 120.1160 0.20 . 1 . . . . 13 LEU N . 26535 1 91 . 1 1 14 14 GLN H H 1 7.4850 0.02 . 1 . . . . 14 GLN HN . 26535 1 92 . 1 1 14 14 GLN C C 13 178.8560 0.20 . 1 . . . . 14 GLN C . 26535 1 93 . 1 1 14 14 GLN CA C 13 58.3620 0.20 . 1 . . . . 14 GLN CA . 26535 1 94 . 1 1 14 14 GLN N N 15 114.9560 0.20 . 1 . . . . 14 GLN N . 26535 1 95 . 1 1 15 15 GLY H H 1 7.7040 0.02 . 1 . . . . 15 GLY HN . 26535 1 96 . 1 1 15 15 GLY C C 13 177.0160 0.20 . 1 . . . . 15 GLY C . 26535 1 97 . 1 1 15 15 GLY CA C 13 46.3730 0.20 . 1 . . . . 15 GLY CA . 26535 1 98 . 1 1 15 15 GLY N N 15 106.3830 0.20 . 1 . . . . 15 GLY N . 26535 1 99 . 1 1 16 16 LEU H H 1 8.8370 0.02 . 1 . . . . 16 LEU HN . 26535 1 100 . 1 1 16 16 LEU HD11 H 1 0.6133 0.02 . 1 . . . . 16 LEU HD11 . 26535 1 101 . 1 1 16 16 LEU HD12 H 1 0.6133 0.02 . 1 . . . . 16 LEU HD11 . 26535 1 102 . 1 1 16 16 LEU HD13 H 1 0.6133 0.02 . 1 . . . . 16 LEU HD11 . 26535 1 103 . 1 1 16 16 LEU HD21 H 1 0.6566 0.02 . 1 . . . . 16 LEU HD21 . 26535 1 104 . 1 1 16 16 LEU HD22 H 1 0.6566 0.02 . 1 . . . . 16 LEU HD21 . 26535 1 105 . 1 1 16 16 LEU HD23 H 1 0.6566 0.02 . 1 . . . . 16 LEU HD21 . 26535 1 106 . 1 1 16 16 LEU C C 13 178.6500 0.20 . 1 . . . . 16 LEU C . 26535 1 107 . 1 1 16 16 LEU CA C 13 57.6090 0.20 . 1 . . . . 16 LEU CA . 26535 1 108 . 1 1 16 16 LEU CD1 C 13 26.0627 0.20 . 1 . . . . 16 LEU CD1 . 26535 1 109 . 1 1 16 16 LEU CD2 C 13 23.1738 0.20 . 1 . . . . 16 LEU CD2 . 26535 1 110 . 1 1 16 16 LEU N N 15 124.6900 0.20 . 1 . . . . 16 LEU N . 26535 1 111 . 1 1 17 17 ILE H H 1 8.2640 0.02 . 1 . . . . 17 ILE HN . 26535 1 112 . 1 1 17 17 ILE HD11 H 1 0.7424 0.02 . 1 . . . . 17 ILE HD11 . 26535 1 113 . 1 1 17 17 ILE HD12 H 1 0.7424 0.02 . 1 . . . . 17 ILE HD11 . 26535 1 114 . 1 1 17 17 ILE HD13 H 1 0.7424 0.02 . 1 . . . . 17 ILE HD11 . 26535 1 115 . 1 1 17 17 ILE C C 13 178.5920 0.20 . 1 . . . . 17 ILE C . 26535 1 116 . 1 1 17 17 ILE CA C 13 65.2820 0.20 . 1 . . . . 17 ILE CA . 26535 1 117 . 1 1 17 17 ILE CD1 C 13 13.5409 0.20 . 1 . . . . 17 ILE CD1 . 26535 1 118 . 1 1 17 17 ILE N N 15 120.1540 0.20 . 1 . . . . 17 ILE N . 26535 1 119 . 1 1 18 18 LEU H H 1 7.5230 0.02 . 1 . . . . 18 LEU HN . 26535 1 120 . 1 1 18 18 LEU HD11 H 1 0.8943 0.02 . 1 . . . . 18 LEU HD11 . 26535 1 121 . 1 1 18 18 LEU HD12 H 1 0.8943 0.02 . 1 . . . . 18 LEU HD11 . 26535 1 122 . 1 1 18 18 LEU HD13 H 1 0.8943 0.02 . 1 . . . . 18 LEU HD11 . 26535 1 123 . 1 1 18 18 LEU C C 13 178.5900 0.20 . 1 . . . . 18 LEU C . 26535 1 124 . 1 1 18 18 LEU CA C 13 57.4710 0.20 . 1 . . . . 18 LEU CA . 26535 1 125 . 1 1 18 18 LEU CD1 C 13 23.3176 0.20 . 1 . . . . 18 LEU CD1 . 26535 1 126 . 1 1 18 18 LEU N N 15 118.3920 0.20 . 1 . . . . 18 LEU N . 26535 1 127 . 1 1 19 19 ALA H H 1 8.2060 0.02 . 1 . . . . 19 ALA HN . 26535 1 128 . 1 1 19 19 ALA C C 13 180.8870 0.20 . 1 . . . . 19 ALA C . 26535 1 129 . 1 1 19 19 ALA CA C 13 54.5590 0.20 . 1 . . . . 19 ALA CA . 26535 1 130 . 1 1 19 19 ALA N N 15 123.1830 0.20 . 1 . . . . 19 ALA N . 26535 1 131 . 1 1 20 20 MET H H 1 8.6240 0.02 . 1 . . . . 20 MET HN . 26535 1 132 . 1 1 20 20 MET C C 13 179.7250 0.20 . 1 . . . . 20 MET C . 26535 1 133 . 1 1 20 20 MET CA C 13 57.0260 0.20 . 1 . . . . 20 MET CA . 26535 1 134 . 1 1 20 20 MET N N 15 118.1090 0.20 . 1 . . . . 20 MET N . 26535 1 135 . 1 1 21 21 GLN H H 1 8.4990 0.02 . 1 . . . . 21 GLN HN . 26535 1 136 . 1 1 21 21 GLN C C 13 181.6100 0.20 . 1 . . . . 21 GLN C . 26535 1 137 . 1 1 21 21 GLN CA C 13 58.1230 0.20 . 1 . . . . 21 GLN CA . 26535 1 138 . 1 1 21 21 GLN N N 15 120.0940 0.20 . 1 . . . . 21 GLN N . 26535 1 139 . 1 1 22 22 SER H H 1 8.2700 0.02 . 1 . . . . 22 SER HN . 26535 1 140 . 1 1 22 22 SER C C 13 175.5880 0.20 . 1 . . . . 22 SER C . 26535 1 141 . 1 1 22 22 SER CA C 13 61.2740 0.20 . 1 . . . . 22 SER CA . 26535 1 142 . 1 1 22 22 SER N N 15 117.7620 0.20 . 1 . . . . 22 SER N . 26535 1 143 . 1 1 23 23 GLU H H 1 7.1810 0.02 . 1 . . . . 23 GLU HN . 26535 1 144 . 1 1 23 23 GLU C C 13 175.7790 0.20 . 1 . . . . 23 GLU C . 26535 1 145 . 1 1 23 23 GLU CA C 13 55.4160 0.20 . 1 . . . . 23 GLU CA . 26535 1 146 . 1 1 23 23 GLU N N 15 119.4690 0.20 . 1 . . . . 23 GLU N . 26535 1 147 . 1 1 24 24 GLY H H 1 7.5670 0.02 . 1 . . . . 24 GLY HN . 26535 1 148 . 1 1 24 24 GLY C C 13 174.2480 0.20 . 1 . . . . 24 GLY C . 26535 1 149 . 1 1 24 24 GLY CA C 13 44.0780 0.20 . 1 . . . . 24 GLY CA . 26535 1 150 . 1 1 24 24 GLY N N 15 105.5250 0.20 . 1 . . . . 24 GLY N . 26535 1 151 . 1 1 25 25 TYR H H 1 7.4030 0.02 . 1 . . . . 25 TYR HN . 26535 1 152 . 1 1 25 25 TYR C C 13 176.1180 0.20 . 1 . . . . 25 TYR C . 26535 1 153 . 1 1 25 25 TYR CA C 13 55.4160 0.20 . 1 . . . . 25 TYR CA . 26535 1 154 . 1 1 25 25 TYR N N 15 120.3590 0.20 . 1 . . . . 25 TYR N . 26535 1 155 . 1 1 26 26 VAL H H 1 8.2460 0.02 . 1 . . . . 26 VAL HN . 26535 1 156 . 1 1 26 26 VAL HG11 H 1 1.0213 0.02 . 1 . . . . 26 VAL HG11 . 26535 1 157 . 1 1 26 26 VAL HG12 H 1 1.0213 0.02 . 1 . . . . 26 VAL HG11 . 26535 1 158 . 1 1 26 26 VAL HG13 H 1 1.0213 0.02 . 1 . . . . 26 VAL HG11 . 26535 1 159 . 1 1 26 26 VAL HG21 H 1 0.9797 0.02 . 1 . . . . 26 VAL HG21 . 26535 1 160 . 1 1 26 26 VAL HG22 H 1 0.9797 0.02 . 1 . . . . 26 VAL HG21 . 26535 1 161 . 1 1 26 26 VAL HG23 H 1 0.9797 0.02 . 1 . . . . 26 VAL HG21 . 26535 1 162 . 1 1 26 26 VAL C C 13 175.4110 0.20 . 1 . . . . 26 VAL C . 26535 1 163 . 1 1 26 26 VAL CA C 13 62.4040 0.20 . 1 . . . . 26 VAL CA . 26535 1 164 . 1 1 26 26 VAL CG1 C 13 21.2266 0.20 . 1 . . . . 26 VAL CG1 . 26535 1 165 . 1 1 26 26 VAL CG2 C 13 21.4625 0.20 . 1 . . . . 26 VAL CG2 . 26535 1 166 . 1 1 26 26 VAL N N 15 122.6940 0.20 . 1 . . . . 26 VAL N . 26535 1 167 . 1 1 27 27 CYS H H 1 8.9000 0.02 . 1 . . . . 27 CYS HN . 26535 1 168 . 1 1 27 27 CYS C C 13 172.5550 0.20 . 1 . . . . 27 CYS C . 26535 1 169 . 1 1 27 27 CYS CA C 13 56.4780 0.20 . 1 . . . . 27 CYS CA . 26535 1 170 . 1 1 27 27 CYS N N 15 127.7680 0.20 . 1 . . . . 27 CYS N . 26535 1 171 . 1 1 28 28 ASP H H 1 8.6500 0.02 . 1 . . . . 28 ASP HN . 26535 1 172 . 1 1 28 28 ASP C C 13 174.1890 0.20 . 1 . . . . 28 ASP C . 26535 1 173 . 1 1 28 28 ASP CA C 13 52.5050 0.20 . 1 . . . . 28 ASP CA . 26535 1 174 . 1 1 28 28 ASP N N 15 127.2870 0.20 . 1 . . . . 28 ASP N . 26535 1 175 . 1 1 29 29 GLY H H 1 8.5790 0.02 . 1 . . . . 29 GLY HN . 26535 1 176 . 1 1 29 29 GLY C C 13 172.6340 0.20 . 1 . . . . 29 GLY C . 26535 1 177 . 1 1 29 29 GLY CA C 13 44.6940 0.20 . 1 . . . . 29 GLY CA . 26535 1 178 . 1 1 29 29 GLY N N 15 107.9740 0.20 . 1 . . . . 29 GLY N . 26535 1 179 . 1 1 30 30 VAL H H 1 9.0640 0.02 . 1 . . . . 30 VAL HN . 26535 1 180 . 1 1 30 30 VAL HG11 H 1 0.7250 0.02 . 1 . . . . 30 VAL HG11 . 26535 1 181 . 1 1 30 30 VAL HG12 H 1 0.7250 0.02 . 1 . . . . 30 VAL HG11 . 26535 1 182 . 1 1 30 30 VAL HG13 H 1 0.7250 0.02 . 1 . . . . 30 VAL HG11 . 26535 1 183 . 1 1 30 30 VAL HG21 H 1 0.6462 0.02 . 1 . . . . 30 VAL HG21 . 26535 1 184 . 1 1 30 30 VAL HG22 H 1 0.6462 0.02 . 1 . . . . 30 VAL HG21 . 26535 1 185 . 1 1 30 30 VAL HG23 H 1 0.6462 0.02 . 1 . . . . 30 VAL HG21 . 26535 1 186 . 1 1 30 30 VAL C C 13 174.2780 0.20 . 1 . . . . 30 VAL C . 26535 1 187 . 1 1 30 30 VAL CA C 13 58.6710 0.20 . 1 . . . . 30 VAL CA . 26535 1 188 . 1 1 30 30 VAL CG1 C 13 22.0178 0.20 . 1 . . . . 30 VAL CG1 . 26535 1 189 . 1 1 30 30 VAL CG2 C 13 19.1793 0.20 . 1 . . . . 30 VAL CG2 . 26535 1 190 . 1 1 30 30 VAL N N 15 118.9690 0.20 . 1 . . . . 30 VAL N . 26535 1 191 . 1 1 31 31 SER H H 1 8.2000 0.02 . 1 . . . . 31 SER HN . 26535 1 192 . 1 1 31 31 SER C C 13 172.4230 0.20 . 1 . . . . 31 SER C . 26535 1 193 . 1 1 31 31 SER CA C 13 57.9170 0.20 . 1 . . . . 31 SER CA . 26535 1 194 . 1 1 31 31 SER N N 15 111.9470 0.20 . 1 . . . . 31 SER N . 26535 1 195 . 1 1 32 32 THR H H 1 6.8770 0.02 . 1 . . . . 32 THR HN . 26535 1 196 . 1 1 32 32 THR C C 13 173.8650 0.20 . 1 . . . . 32 THR C . 26535 1 197 . 1 1 32 32 THR CA C 13 58.4650 0.20 . 1 . . . . 32 THR CA . 26535 1 198 . 1 1 32 32 THR N N 15 104.2770 0.20 . 1 . . . . 32 THR N . 26535 1 199 . 1 1 33 33 ALA H H 1 10.5060 0.02 . 1 . . . . 33 ALA HN . 26535 1 200 . 1 1 33 33 ALA C C 13 180.6820 0.20 . 1 . . . . 33 ALA C . 26535 1 201 . 1 1 33 33 ALA CA C 13 54.3540 0.20 . 1 . . . . 33 ALA CA . 26535 1 202 . 1 1 33 33 ALA N N 15 128.6530 0.20 . 1 . . . . 33 ALA N . 26535 1 203 . 1 1 34 34 HIS H H 1 9.5340 0.02 . 1 . . . . 34 HIS HN . 26535 1 204 . 1 1 34 34 HIS C C 13 178.2230 0.20 . 1 . . . . 34 HIS C . 26535 1 205 . 1 1 34 34 HIS CA C 13 59.5270 0.20 . 1 . . . . 34 HIS CA . 26535 1 206 . 1 1 34 34 HIS N N 15 120.2490 0.20 . 1 . . . . 34 HIS N . 26535 1 207 . 1 1 35 35 GLU H H 1 7.8090 0.02 . 1 . . . . 35 GLU HN . 26535 1 208 . 1 1 35 35 GLU C C 13 179.8280 0.20 . 1 . . . . 35 GLU C . 26535 1 209 . 1 1 35 35 GLU CA C 13 58.4650 0.20 . 1 . . . . 35 GLU CA . 26535 1 210 . 1 1 35 35 GLU N N 15 117.3450 0.20 . 1 . . . . 35 GLU N . 26535 1 211 . 1 1 36 36 ALA H H 1 7.9080 0.02 . 1 . . . . 36 ALA HN . 26535 1 212 . 1 1 36 36 ALA C C 13 178.4880 0.20 . 1 . . . . 36 ALA C . 26535 1 213 . 1 1 36 36 ALA CA C 13 55.1030 0.20 . 1 . . . . 36 ALA CA . 26535 1 214 . 1 1 36 36 ALA N N 15 123.5720 0.20 . 1 . . . . 36 ALA N . 26535 1 215 . 1 1 37 37 ALA H H 1 8.4510 0.02 . 1 . . . . 37 ALA HN . 26535 1 216 . 1 1 37 37 ALA C C 13 180.9910 0.20 . 1 . . . . 37 ALA C . 26535 1 217 . 1 1 37 37 ALA CA C 13 54.8190 0.20 . 1 . . . . 37 ALA CA . 26535 1 218 . 1 1 37 37 ALA N N 15 120.7070 0.20 . 1 . . . . 37 ALA N . 26535 1 219 . 1 1 38 38 LEU H H 1 7.4780 0.02 . 1 . . . . 38 LEU HN . 26535 1 220 . 1 1 38 38 LEU HD11 H 1 0.7368 0.02 . 1 . . . . 38 LEU HD11 . 26535 1 221 . 1 1 38 38 LEU HD12 H 1 0.7368 0.02 . 1 . . . . 38 LEU HD11 . 26535 1 222 . 1 1 38 38 LEU HD13 H 1 0.7368 0.02 . 1 . . . . 38 LEU HD11 . 26535 1 223 . 1 1 38 38 LEU HD21 H 1 0.7698 0.02 . 1 . . . . 38 LEU HD21 . 26535 1 224 . 1 1 38 38 LEU HD22 H 1 0.7698 0.02 . 1 . . . . 38 LEU HD21 . 26535 1 225 . 1 1 38 38 LEU HD23 H 1 0.7698 0.02 . 1 . . . . 38 LEU HD21 . 26535 1 226 . 1 1 38 38 LEU C C 13 180.5620 0.20 . 1 . . . . 38 LEU C . 26535 1 227 . 1 1 38 38 LEU CA C 13 57.4560 0.20 . 1 . . . . 38 LEU CA . 26535 1 228 . 1 1 38 38 LEU CD1 C 13 24.8149 0.20 . 1 . . . . 38 LEU CD1 . 26535 1 229 . 1 1 38 38 LEU CD2 C 13 22.7212 0.20 . 1 . . . . 38 LEU CD2 . 26535 1 230 . 1 1 38 38 LEU N N 15 118.8330 0.20 . 1 . . . . 38 LEU N . 26535 1 231 . 1 1 39 39 SER H H 1 8.2320 0.02 . 1 . . . . 39 SER HN . 26535 1 232 . 1 1 39 39 SER C C 13 177.1040 0.20 . 1 . . . . 39 SER C . 26535 1 233 . 1 1 39 39 SER CA C 13 63.1820 0.20 . 1 . . . . 39 SER CA . 26535 1 234 . 1 1 39 39 SER N N 15 118.7160 0.20 . 1 . . . . 39 SER N . 26535 1 235 . 1 1 40 40 LEU H H 1 8.5780 0.02 . 1 . . . . 40 LEU HN . 26535 1 236 . 1 1 40 40 LEU HD11 H 1 0.9024 0.02 . 1 . . . . 40 LEU HD11 . 26535 1 237 . 1 1 40 40 LEU HD12 H 1 0.9024 0.02 . 1 . . . . 40 LEU HD11 . 26535 1 238 . 1 1 40 40 LEU HD13 H 1 0.9024 0.02 . 1 . . . . 40 LEU HD11 . 26535 1 239 . 1 1 40 40 LEU HD21 H 1 0.9484 0.02 . 1 . . . . 40 LEU HD21 . 26535 1 240 . 1 1 40 40 LEU HD22 H 1 0.9484 0.02 . 1 . . . . 40 LEU HD21 . 26535 1 241 . 1 1 40 40 LEU HD23 H 1 0.9484 0.02 . 1 . . . . 40 LEU HD21 . 26535 1 242 . 1 1 40 40 LEU C C 13 177.4130 0.20 . 1 . . . . 40 LEU C . 26535 1 243 . 1 1 40 40 LEU CA C 13 57.1440 0.20 . 1 . . . . 40 LEU CA . 26535 1 244 . 1 1 40 40 LEU CD1 C 13 25.9956 0.20 . 1 . . . . 40 LEU CD1 . 26535 1 245 . 1 1 40 40 LEU CD2 C 13 24.0095 0.20 . 1 . . . . 40 LEU CD2 . 26535 1 246 . 1 1 40 40 LEU N N 15 122.2860 0.20 . 1 . . . . 40 LEU N . 26535 1 247 . 1 1 41 41 ALA H H 1 7.2990 0.02 . 1 . . . . 41 ALA HN . 26535 1 248 . 1 1 41 41 ALA C C 13 178.8560 0.20 . 1 . . . . 41 ALA C . 26535 1 249 . 1 1 41 41 ALA CA C 13 53.0050 0.20 . 1 . . . . 41 ALA CA . 26535 1 250 . 1 1 41 41 ALA N N 15 117.7180 0.20 . 1 . . . . 41 ALA N . 26535 1 251 . 1 1 42 42 SER H H 1 7.3640 0.02 . 1 . . . . 42 SER HN . 26535 1 252 . 1 1 42 42 SER C C 13 173.1150 0.20 . 1 . . . . 42 SER C . 26535 1 253 . 1 1 42 42 SER CA C 13 58.6180 0.20 . 1 . . . . 42 SER CA . 26535 1 254 . 1 1 42 42 SER N N 15 110.2720 0.20 . 1 . . . . 42 SER N . 26535 1 255 . 1 1 43 43 ASN H H 1 7.7930 0.02 . 1 . . . . 43 ASN HN . 26535 1 256 . 1 1 43 43 ASN CA C 13 51.7860 0.20 . 1 . . . . 43 ASN CA . 26535 1 257 . 1 1 43 43 ASN N N 15 119.4130 0.20 . 1 . . . . 43 ASN N . 26535 1 258 . 1 1 44 44 HIS C C 13 174.5280 0.20 . 1 . . . . 44 HIS C . 26535 1 259 . 1 1 44 44 HIS CA C 13 54.3090 0.20 . 1 . . . . 44 HIS CA . 26535 1 260 . 1 1 45 45 TYR H H 1 7.9940 0.02 . 1 . . . . 45 TYR HN . 26535 1 261 . 1 1 45 45 TYR C C 13 175.4110 0.20 . 1 . . . . 45 TYR C . 26535 1 262 . 1 1 45 45 TYR CA C 13 57.7390 0.20 . 1 . . . . 45 TYR CA . 26535 1 263 . 1 1 45 45 TYR N N 15 123.6780 0.20 . 1 . . . . 45 TYR N . 26535 1 264 . 1 1 46 46 SER H H 1 9.3830 0.02 . 1 . . . . 46 SER HN . 26535 1 265 . 1 1 46 46 SER C C 13 172.5110 0.20 . 1 . . . . 46 SER C . 26535 1 266 . 1 1 46 46 SER CA C 13 59.7810 0.20 . 1 . . . . 46 SER CA . 26535 1 267 . 1 1 46 46 SER N N 15 117.2680 0.20 . 1 . . . . 46 SER N . 26535 1 268 . 1 1 47 47 LEU H H 1 7.1640 0.02 . 1 . . . . 47 LEU HN . 26535 1 269 . 1 1 47 47 LEU HD11 H 1 0.7255 0.02 . 1 . . . . 47 LEU HD11 . 26535 1 270 . 1 1 47 47 LEU HD12 H 1 0.7255 0.02 . 1 . . . . 47 LEU HD11 . 26535 1 271 . 1 1 47 47 LEU HD13 H 1 0.7255 0.02 . 1 . . . . 47 LEU HD11 . 26535 1 272 . 1 1 47 47 LEU HD21 H 1 0.5482 0.02 . 1 . . . . 47 LEU HD21 . 26535 1 273 . 1 1 47 47 LEU HD22 H 1 0.5482 0.02 . 1 . . . . 47 LEU HD21 . 26535 1 274 . 1 1 47 47 LEU HD23 H 1 0.5482 0.02 . 1 . . . . 47 LEU HD21 . 26535 1 275 . 1 1 47 47 LEU C C 13 173.6740 0.20 . 1 . . . . 47 LEU C . 26535 1 276 . 1 1 47 47 LEU CA C 13 55.1310 0.20 . 1 . . . . 47 LEU CA . 26535 1 277 . 1 1 47 47 LEU CD1 C 13 28.7778 0.20 . 1 . . . . 47 LEU CD1 . 26535 1 278 . 1 1 47 47 LEU CD2 C 13 27.2529 0.20 . 1 . . . . 47 LEU CD2 . 26535 1 279 . 1 1 47 47 LEU N N 15 118.0650 0.20 . 1 . . . . 47 LEU N . 26535 1 280 . 1 1 48 48 ILE H H 1 8.1980 0.02 . 1 . . . . 48 ILE HN . 26535 1 281 . 1 1 48 48 ILE HD11 H 1 0.6572 0.02 . 1 . . . . 48 ILE HD11 . 26535 1 282 . 1 1 48 48 ILE HD12 H 1 0.6572 0.02 . 1 . . . . 48 ILE HD11 . 26535 1 283 . 1 1 48 48 ILE HD13 H 1 0.6572 0.02 . 1 . . . . 48 ILE HD11 . 26535 1 284 . 1 1 48 48 ILE C C 13 173.7320 0.20 . 1 . . . . 48 ILE C . 26535 1 285 . 1 1 48 48 ILE CA C 13 59.0710 0.20 . 1 . . . . 48 ILE CA . 26535 1 286 . 1 1 48 48 ILE CD1 C 13 14.6915 0.20 . 1 . . . . 48 ILE CD1 . 26535 1 287 . 1 1 48 48 ILE N N 15 125.8450 0.20 . 1 . . . . 48 ILE N . 26535 1 288 . 1 1 49 49 VAL H H 1 9.0050 0.02 . 1 . . . . 49 VAL HN . 26535 1 289 . 1 1 49 49 VAL HG11 H 1 0.6944 0.02 . 1 . . . . 49 VAL HG11 . 26535 1 290 . 1 1 49 49 VAL HG12 H 1 0.6944 0.02 . 1 . . . . 49 VAL HG11 . 26535 1 291 . 1 1 49 49 VAL HG13 H 1 0.6944 0.02 . 1 . . . . 49 VAL HG11 . 26535 1 292 . 1 1 49 49 VAL HG21 H 1 0.5934 0.02 . 1 . . . . 49 VAL HG21 . 26535 1 293 . 1 1 49 49 VAL HG22 H 1 0.5934 0.02 . 1 . . . . 49 VAL HG21 . 26535 1 294 . 1 1 49 49 VAL HG23 H 1 0.5934 0.02 . 1 . . . . 49 VAL HG21 . 26535 1 295 . 1 1 49 49 VAL C C 13 173.2760 0.20 . 1 . . . . 49 VAL C . 26535 1 296 . 1 1 49 49 VAL CA C 13 61.0280 0.20 . 1 . . . . 49 VAL CA . 26535 1 297 . 1 1 49 49 VAL CG1 C 13 21.3943 0.20 . 1 . . . . 49 VAL CG1 . 26535 1 298 . 1 1 49 49 VAL CG2 C 13 21.0860 0.20 . 1 . . . . 49 VAL CG2 . 26535 1 299 . 1 1 49 49 VAL N N 15 129.9480 0.20 . 1 . . . . 49 VAL N . 26535 1 300 . 1 1 50 50 LEU H H 1 8.7050 0.02 . 1 . . . . 50 LEU HN . 26535 1 301 . 1 1 50 50 LEU HD11 H 1 0.7168 0.02 . 1 . . . . 50 LEU HD11 . 26535 1 302 . 1 1 50 50 LEU HD12 H 1 0.7168 0.02 . 1 . . . . 50 LEU HD11 . 26535 1 303 . 1 1 50 50 LEU HD13 H 1 0.7168 0.02 . 1 . . . . 50 LEU HD11 . 26535 1 304 . 1 1 50 50 LEU HD21 H 1 0.8500 0.02 . 1 . . . . 50 LEU HD21 . 26535 1 305 . 1 1 50 50 LEU HD22 H 1 0.8500 0.02 . 1 . . . . 50 LEU HD21 . 26535 1 306 . 1 1 50 50 LEU HD23 H 1 0.8500 0.02 . 1 . . . . 50 LEU HD21 . 26535 1 307 . 1 1 50 50 LEU C C 13 173.6610 0.20 . 1 . . . . 50 LEU C . 26535 1 308 . 1 1 50 50 LEU CA C 13 53.5150 0.20 . 1 . . . . 50 LEU CA . 26535 1 309 . 1 1 50 50 LEU CD1 C 13 27.2346 0.20 . 1 . . . . 50 LEU CD1 . 26535 1 310 . 1 1 50 50 LEU CD2 C 13 25.0980 0.20 . 1 . . . . 50 LEU CD2 . 26535 1 311 . 1 1 50 50 LEU N N 15 129.9480 0.20 . 1 . . . . 50 LEU N . 26535 1 312 . 1 1 51 51 ASP H H 1 8.0010 0.02 . 1 . . . . 51 ASP HN . 26535 1 313 . 1 1 51 51 ASP C C 13 174.8520 0.20 . 1 . . . . 51 ASP C . 26535 1 314 . 1 1 51 51 ASP CA C 13 51.9560 0.20 . 1 . . . . 51 ASP CA . 26535 1 315 . 1 1 51 51 ASP N N 15 128.5840 0.20 . 1 . . . . 51 ASP N . 26535 1 316 . 1 1 52 52 LEU H H 1 6.4270 0.02 . 1 . . . . 52 LEU HN . 26535 1 317 . 1 1 52 52 LEU HD11 H 1 1.0295 0.02 . 1 . . . . 52 LEU HD11 . 26535 1 318 . 1 1 52 52 LEU HD12 H 1 1.0295 0.02 . 1 . . . . 52 LEU HD11 . 26535 1 319 . 1 1 52 52 LEU HD13 H 1 1.0295 0.02 . 1 . . . . 52 LEU HD11 . 26535 1 320 . 1 1 52 52 LEU HD21 H 1 0.5687 0.02 . 1 . . . . 52 LEU HD21 . 26535 1 321 . 1 1 52 52 LEU HD22 H 1 0.5687 0.02 . 1 . . . . 52 LEU HD21 . 26535 1 322 . 1 1 52 52 LEU HD23 H 1 0.5687 0.02 . 1 . . . . 52 LEU HD21 . 26535 1 323 . 1 1 52 52 LEU C C 13 178.3410 0.20 . 1 . . . . 52 LEU C . 26535 1 324 . 1 1 52 52 LEU CA C 13 55.6980 0.20 . 1 . . . . 52 LEU CA . 26535 1 325 . 1 1 52 52 LEU CD1 C 13 26.2808 0.20 . 1 . . . . 52 LEU CD1 . 26535 1 326 . 1 1 52 52 LEU CD2 C 13 21.1492 0.20 . 1 . . . . 52 LEU CD2 . 26535 1 327 . 1 1 52 52 LEU N N 15 116.2590 0.20 . 1 . . . . 52 LEU N . 26535 1 328 . 1 1 53 53 GLY H H 1 8.2650 0.02 . 1 . . . . 53 GLY HN . 26535 1 329 . 1 1 53 53 GLY C C 13 171.4360 0.20 . 1 . . . . 53 GLY C . 26535 1 330 . 1 1 53 53 GLY CA C 13 45.7760 0.20 . 1 . . . . 53 GLY CA . 26535 1 331 . 1 1 53 53 GLY N N 15 107.0160 0.20 . 1 . . . . 53 GLY N . 26535 1 332 . 1 1 54 54 LEU H H 1 7.2300 0.02 . 1 . . . . 54 LEU HN . 26535 1 333 . 1 1 54 54 LEU HD11 H 1 0.5802 0.02 . 1 . . . . 54 LEU HD11 . 26535 1 334 . 1 1 54 54 LEU HD12 H 1 0.5802 0.02 . 1 . . . . 54 LEU HD11 . 26535 1 335 . 1 1 54 54 LEU HD13 H 1 0.5802 0.02 . 1 . . . . 54 LEU HD11 . 26535 1 336 . 1 1 54 54 LEU HD21 H 1 0.6476 0.02 . 1 . . . . 54 LEU HD21 . 26535 1 337 . 1 1 54 54 LEU HD22 H 1 0.6476 0.02 . 1 . . . . 54 LEU HD21 . 26535 1 338 . 1 1 54 54 LEU HD23 H 1 0.6476 0.02 . 1 . . . . 54 LEU HD21 . 26535 1 339 . 1 1 54 54 LEU CA C 13 51.6440 0.20 . 1 . . . . 54 LEU CA . 26535 1 340 . 1 1 54 54 LEU CD1 C 13 24.6713 0.20 . 1 . . . . 54 LEU CD1 . 26535 1 341 . 1 1 54 54 LEU CD2 C 13 22.1720 0.20 . 1 . . . . 54 LEU CD2 . 26535 1 342 . 1 1 54 54 LEU N N 15 131.4150 0.20 . 1 . . . . 54 LEU N . 26535 1 343 . 1 1 55 55 PRO C C 13 177.3390 0.20 . 1 . . . . 55 PRO C . 26535 1 344 . 1 1 55 55 PRO CA C 13 64.4010 0.20 . 1 . . . . 55 PRO CA . 26535 1 345 . 1 1 56 56 ASP H H 1 9.2240 0.02 . 1 . . . . 56 ASP HN . 26535 1 346 . 1 1 56 56 ASP C C 13 175.3820 0.20 . 1 . . . . 56 ASP C . 26535 1 347 . 1 1 56 56 ASP CA C 13 53.4590 0.20 . 1 . . . . 56 ASP CA . 26535 1 348 . 1 1 56 56 ASP N N 15 112.8100 0.20 . 1 . . . . 56 ASP N . 26535 1 349 . 1 1 57 57 GLU H H 1 7.1920 0.02 . 1 . . . . 57 GLU HN . 26535 1 350 . 1 1 57 57 GLU C C 13 172.7760 0.20 . 1 . . . . 57 GLU C . 26535 1 351 . 1 1 57 57 GLU CA C 13 54.8480 0.20 . 1 . . . . 57 GLU CA . 26535 1 352 . 1 1 57 57 GLU N N 15 122.3990 0.20 . 1 . . . . 57 GLU N . 26535 1 353 . 1 1 58 58 ASP H H 1 8.2960 0.02 . 1 . . . . 58 ASP HN . 26535 1 354 . 1 1 58 58 ASP C C 13 179.1650 0.20 . 1 . . . . 58 ASP C . 26535 1 355 . 1 1 58 58 ASP CA C 13 54.6210 0.20 . 1 . . . . 58 ASP CA . 26535 1 356 . 1 1 58 58 ASP N N 15 122.1310 0.20 . 1 . . . . 58 ASP N . 26535 1 357 . 1 1 59 59 GLY H H 1 10.3280 0.02 . 1 . . . . 59 GLY HN . 26535 1 358 . 1 1 59 59 GLY C C 13 175.4110 0.20 . 1 . . . . 59 GLY C . 26535 1 359 . 1 1 59 59 GLY CA C 13 47.1370 0.20 . 1 . . . . 59 GLY CA . 26535 1 360 . 1 1 59 59 GLY N N 15 115.4310 0.20 . 1 . . . . 59 GLY N . 26535 1 361 . 1 1 60 60 LEU H H 1 8.9880 0.02 . 1 . . . . 60 LEU HN . 26535 1 362 . 1 1 60 60 LEU HD11 H 1 0.8332 0.02 . 1 . . . . 60 LEU HD11 . 26535 1 363 . 1 1 60 60 LEU HD12 H 1 0.8332 0.02 . 1 . . . . 60 LEU HD11 . 26535 1 364 . 1 1 60 60 LEU HD13 H 1 0.8332 0.02 . 1 . . . . 60 LEU HD11 . 26535 1 365 . 1 1 60 60 LEU HD21 H 1 0.9287 0.02 . 1 . . . . 60 LEU HD21 . 26535 1 366 . 1 1 60 60 LEU HD22 H 1 0.9287 0.02 . 1 . . . . 60 LEU HD21 . 26535 1 367 . 1 1 60 60 LEU HD23 H 1 0.9287 0.02 . 1 . . . . 60 LEU HD21 . 26535 1 368 . 1 1 60 60 LEU C C 13 179.7390 0.20 . 1 . . . . 60 LEU C . 26535 1 369 . 1 1 60 60 LEU CA C 13 57.2040 0.20 . 1 . . . . 60 LEU CA . 26535 1 370 . 1 1 60 60 LEU CD1 C 13 23.8120 0.20 . 1 . . . . 60 LEU CD1 . 26535 1 371 . 1 1 60 60 LEU CD2 C 13 24.6617 0.20 . 1 . . . . 60 LEU CD2 . 26535 1 372 . 1 1 60 60 LEU N N 15 120.6370 0.20 . 1 . . . . 60 LEU N . 26535 1 373 . 1 1 61 61 HIS H H 1 7.4620 0.02 . 1 . . . . 61 HIS HN . 26535 1 374 . 1 1 61 61 HIS C C 13 178.4440 0.20 . 1 . . . . 61 HIS C . 26535 1 375 . 1 1 61 61 HIS CA C 13 58.4760 0.20 . 1 . . . . 61 HIS CA . 26535 1 376 . 1 1 61 61 HIS N N 15 121.4340 0.20 . 1 . . . . 61 HIS N . 26535 1 377 . 1 1 62 62 PHE H H 1 8.0750 0.02 . 1 . . . . 62 PHE HN . 26535 1 378 . 1 1 62 62 PHE C C 13 176.4720 0.20 . 1 . . . . 62 PHE C . 26535 1 379 . 1 1 62 62 PHE CA C 13 60.8010 0.20 . 1 . . . . 62 PHE CA . 26535 1 380 . 1 1 62 62 PHE N N 15 122.3490 0.20 . 1 . . . . 62 PHE N . 26535 1 381 . 1 1 63 63 LEU H H 1 8.5550 0.02 . 1 . . . . 63 LEU HN . 26535 1 382 . 1 1 63 63 LEU HD11 H 1 0.7583 0.02 . 1 . . . . 63 LEU HD11 . 26535 1 383 . 1 1 63 63 LEU HD12 H 1 0.7583 0.02 . 1 . . . . 63 LEU HD11 . 26535 1 384 . 1 1 63 63 LEU HD13 H 1 0.7583 0.02 . 1 . . . . 63 LEU HD11 . 26535 1 385 . 1 1 63 63 LEU HD21 H 1 0.6966 0.02 . 1 . . . . 63 LEU HD21 . 26535 1 386 . 1 1 63 63 LEU HD22 H 1 0.6966 0.02 . 1 . . . . 63 LEU HD21 . 26535 1 387 . 1 1 63 63 LEU HD23 H 1 0.6966 0.02 . 1 . . . . 63 LEU HD21 . 26535 1 388 . 1 1 63 63 LEU C C 13 177.5310 0.20 . 1 . . . . 63 LEU C . 26535 1 389 . 1 1 63 63 LEU CA C 13 57.1430 0.20 . 1 . . . . 63 LEU CA . 26535 1 390 . 1 1 63 63 LEU CD1 C 13 27.0290 0.20 . 1 . . . . 63 LEU CD1 . 26535 1 391 . 1 1 63 63 LEU CD2 C 13 23.2228 0.20 . 1 . . . . 63 LEU CD2 . 26535 1 392 . 1 1 63 63 LEU N N 15 121.1500 0.20 . 1 . . . . 63 LEU N . 26535 1 393 . 1 1 64 64 SER H H 1 7.9150 0.02 . 1 . . . . 64 SER HN . 26535 1 394 . 1 1 64 64 SER C C 13 177.3990 0.20 . 1 . . . . 64 SER C . 26535 1 395 . 1 1 64 64 SER CA C 13 60.9970 0.20 . 1 . . . . 64 SER CA . 26535 1 396 . 1 1 64 64 SER N N 15 112.3600 0.20 . 1 . . . . 64 SER N . 26535 1 397 . 1 1 65 65 ARG H H 1 7.5860 0.02 . 1 . . . . 65 ARG HN . 26535 1 398 . 1 1 65 65 ARG C C 13 178.0170 0.20 . 1 . . . . 65 ARG C . 26535 1 399 . 1 1 65 65 ARG CA C 13 59.2410 0.20 . 1 . . . . 65 ARG CA . 26535 1 400 . 1 1 65 65 ARG N N 15 121.2970 0.20 . 1 . . . . 65 ARG N . 26535 1 401 . 1 1 66 66 MET H H 1 8.0960 0.02 . 1 . . . . 66 MET HN . 26535 1 402 . 1 1 66 66 MET C C 13 179.2390 0.20 . 1 . . . . 66 MET C . 26535 1 403 . 1 1 66 66 MET CA C 13 58.1080 0.20 . 1 . . . . 66 MET CA . 26535 1 404 . 1 1 66 66 MET N N 15 118.8040 0.20 . 1 . . . . 66 MET N . 26535 1 405 . 1 1 67 67 ARG H H 1 8.1940 0.02 . 1 . . . . 67 ARG HN . 26535 1 406 . 1 1 67 67 ARG C C 13 180.9170 0.20 . 1 . . . . 67 ARG C . 26535 1 407 . 1 1 67 67 ARG CA C 13 57.1720 0.20 . 1 . . . . 67 ARG CA . 26535 1 408 . 1 1 67 67 ARG N N 15 116.0810 0.20 . 1 . . . . 67 ARG N . 26535 1 409 . 1 1 68 68 ARG H H 1 8.0150 0.02 . 1 . . . . 68 ARG HN . 26535 1 410 . 1 1 68 68 ARG C C 13 177.8690 0.20 . 1 . . . . 68 ARG C . 26535 1 411 . 1 1 68 68 ARG CA C 13 58.6750 0.20 . 1 . . . . 68 ARG CA . 26535 1 412 . 1 1 68 68 ARG N N 15 122.9330 0.20 . 1 . . . . 68 ARG N . 26535 1 413 . 1 1 69 69 GLU H H 1 7.5940 0.02 . 1 . . . . 69 GLU HN . 26535 1 414 . 1 1 69 69 GLU C C 13 175.0580 0.20 . 1 . . . . 69 GLU C . 26535 1 415 . 1 1 69 69 GLU CA C 13 55.5850 0.20 . 1 . . . . 69 GLU CA . 26535 1 416 . 1 1 69 69 GLU N N 15 118.7520 0.20 . 1 . . . . 69 GLU N . 26535 1 417 . 1 1 70 70 LYS H H 1 7.6840 0.02 . 1 . . . . 70 LYS HN . 26535 1 418 . 1 1 70 70 LYS C C 13 175.3520 0.20 . 1 . . . . 70 LYS C . 26535 1 419 . 1 1 70 70 LYS CA C 13 56.7470 0.20 . 1 . . . . 70 LYS CA . 26535 1 420 . 1 1 70 70 LYS N N 15 112.3900 0.20 . 1 . . . . 70 LYS N . 26535 1 421 . 1 1 71 71 MET H H 1 7.8750 0.02 . 1 . . . . 71 MET HN . 26535 1 422 . 1 1 71 71 MET CA C 13 56.0380 0.20 . 1 . . . . 71 MET CA . 26535 1 423 . 1 1 71 71 MET N N 15 119.7400 0.20 . 1 . . . . 71 MET N . 26535 1 424 . 1 1 72 72 THR H H 1 8.3310 0.02 . 1 . . . . 72 THR HN . 26535 1 425 . 1 1 72 72 THR C C 13 175.5580 0.20 . 1 . . . . 72 THR C . 26535 1 426 . 1 1 72 72 THR N N 15 116.6470 0.20 . 1 . . . . 72 THR N . 26535 1 427 . 1 1 73 73 GLN H H 1 9.3120 0.02 . 1 . . . . 73 GLN HN . 26535 1 428 . 1 1 73 73 GLN N N 15 125.5030 0.20 . 1 . . . . 73 GLN N . 26535 1 429 . 1 1 74 74 PRO C C 13 175.1910 0.20 . 1 . . . . 74 PRO C . 26535 1 430 . 1 1 74 74 PRO CA C 13 62.1330 0.20 . 1 . . . . 74 PRO CA . 26535 1 431 . 1 1 75 75 VAL H H 1 9.0510 0.02 . 1 . . . . 75 VAL HN . 26535 1 432 . 1 1 75 75 VAL HG11 H 1 0.7894 0.02 . 1 . . . . 75 VAL HG11 . 26535 1 433 . 1 1 75 75 VAL HG12 H 1 0.7894 0.02 . 1 . . . . 75 VAL HG11 . 26535 1 434 . 1 1 75 75 VAL HG13 H 1 0.7894 0.02 . 1 . . . . 75 VAL HG11 . 26535 1 435 . 1 1 75 75 VAL HG21 H 1 0.7240 0.02 . 1 . . . . 75 VAL HG21 . 26535 1 436 . 1 1 75 75 VAL HG22 H 1 0.7240 0.02 . 1 . . . . 75 VAL HG21 . 26535 1 437 . 1 1 75 75 VAL HG23 H 1 0.7240 0.02 . 1 . . . . 75 VAL HG21 . 26535 1 438 . 1 1 75 75 VAL C C 13 174.1450 0.20 . 1 . . . . 75 VAL C . 26535 1 439 . 1 1 75 75 VAL CA C 13 59.9220 0.20 . 1 . . . . 75 VAL CA . 26535 1 440 . 1 1 75 75 VAL CG1 C 13 21.3022 0.20 . 1 . . . . 75 VAL CG1 . 26535 1 441 . 1 1 75 75 VAL CG2 C 13 21.5119 0.20 . 1 . . . . 75 VAL CG2 . 26535 1 442 . 1 1 75 75 VAL N N 15 122.6970 0.20 . 1 . . . . 75 VAL N . 26535 1 443 . 1 1 76 76 LEU H H 1 8.9190 0.02 . 1 . . . . 76 LEU HN . 26535 1 444 . 1 1 76 76 LEU HD11 H 1 0.6430 0.02 . 1 . . . . 76 LEU HD11 . 26535 1 445 . 1 1 76 76 LEU HD12 H 1 0.6430 0.02 . 1 . . . . 76 LEU HD11 . 26535 1 446 . 1 1 76 76 LEU HD13 H 1 0.6430 0.02 . 1 . . . . 76 LEU HD11 . 26535 1 447 . 1 1 76 76 LEU HD21 H 1 0.4846 0.02 . 1 . . . . 76 LEU HD21 . 26535 1 448 . 1 1 76 76 LEU HD22 H 1 0.4846 0.02 . 1 . . . . 76 LEU HD21 . 26535 1 449 . 1 1 76 76 LEU HD23 H 1 0.4846 0.02 . 1 . . . . 76 LEU HD21 . 26535 1 450 . 1 1 76 76 LEU C C 13 174.9550 0.20 . 1 . . . . 76 LEU C . 26535 1 451 . 1 1 76 76 LEU CA C 13 52.9360 0.20 . 1 . . . . 76 LEU CA . 26535 1 452 . 1 1 76 76 LEU CD1 C 13 26.6517 0.20 . 1 . . . . 76 LEU CD1 . 26535 1 453 . 1 1 76 76 LEU CD2 C 13 26.2112 0.20 . 1 . . . . 76 LEU CD2 . 26535 1 454 . 1 1 76 76 LEU N N 15 131.4870 0.20 . 1 . . . . 76 LEU N . 26535 1 455 . 1 1 77 77 ILE H H 1 7.9670 0.02 . 1 . . . . 77 ILE HN . 26535 1 456 . 1 1 77 77 ILE HD11 H 1 0.7731 0.02 . 1 . . . . 77 ILE HD11 . 26535 1 457 . 1 1 77 77 ILE HD12 H 1 0.7731 0.02 . 1 . . . . 77 ILE HD11 . 26535 1 458 . 1 1 77 77 ILE HD13 H 1 0.7731 0.02 . 1 . . . . 77 ILE HD11 . 26535 1 459 . 1 1 77 77 ILE C C 13 172.7910 0.20 . 1 . . . . 77 ILE C . 26535 1 460 . 1 1 77 77 ILE CA C 13 60.6340 0.20 . 1 . . . . 77 ILE CA . 26535 1 461 . 1 1 77 77 ILE CD1 C 13 15.6831 0.20 . 1 . . . . 77 ILE CD1 . 26535 1 462 . 1 1 77 77 ILE N N 15 128.3540 0.20 . 1 . . . . 77 ILE N . 26535 1 463 . 1 1 78 78 LEU H H 1 7.7110 0.02 . 1 . . . . 78 LEU HN . 26535 1 464 . 1 1 78 78 LEU HD11 H 1 0.0729 0.02 . 1 . . . . 78 LEU HD11 . 26535 1 465 . 1 1 78 78 LEU HD12 H 1 0.0729 0.02 . 1 . . . . 78 LEU HD11 . 26535 1 466 . 1 1 78 78 LEU HD13 H 1 0.0729 0.02 . 1 . . . . 78 LEU HD11 . 26535 1 467 . 1 1 78 78 LEU C C 13 174.5280 0.20 . 1 . . . . 78 LEU C . 26535 1 468 . 1 1 78 78 LEU CA C 13 52.6620 0.20 . 1 . . . . 78 LEU CA . 26535 1 469 . 1 1 78 78 LEU CD1 C 13 24.3096 0.20 . 1 . . . . 78 LEU CD1 . 26535 1 470 . 1 1 78 78 LEU N N 15 133.1250 0.20 . 1 . . . . 78 LEU N . 26535 1 471 . 1 1 79 79 THR H H 1 7.5740 0.02 . 1 . . . . 79 THR HN . 26535 1 472 . 1 1 79 79 THR C C 13 171.6130 0.20 . 1 . . . . 79 THR C . 26535 1 473 . 1 1 79 79 THR CA C 13 58.8890 0.20 . 1 . . . . 79 THR CA . 26535 1 474 . 1 1 79 79 THR N N 15 114.4820 0.20 . 1 . . . . 79 THR N . 26535 1 475 . 1 1 80 80 ALA H H 1 7.9840 0.02 . 1 . . . . 80 ALA HN . 26535 1 476 . 1 1 80 80 ALA C C 13 177.9140 0.20 . 1 . . . . 80 ALA C . 26535 1 477 . 1 1 80 80 ALA CA C 13 52.2860 0.20 . 1 . . . . 80 ALA CA . 26535 1 478 . 1 1 80 80 ALA N N 15 128.9080 0.20 . 1 . . . . 80 ALA N . 26535 1 479 . 1 1 81 81 ARG H H 1 8.7420 0.02 . 1 . . . . 81 ARG HN . 26535 1 480 . 1 1 81 81 ARG C C 13 176.0010 0.20 . 1 . . . . 81 ARG C . 26535 1 481 . 1 1 81 81 ARG CA C 13 57.8620 0.20 . 1 . . . . 81 ARG CA . 26535 1 482 . 1 1 81 81 ARG N N 15 120.5380 0.20 . 1 . . . . 81 ARG N . 26535 1 483 . 1 1 82 82 ASP H H 1 8.2930 0.02 . 1 . . . . 82 ASP HN . 26535 1 484 . 1 1 82 82 ASP C C 13 177.2810 0.20 . 1 . . . . 82 ASP C . 26535 1 485 . 1 1 82 82 ASP CA C 13 53.4150 0.20 . 1 . . . . 82 ASP CA . 26535 1 486 . 1 1 82 82 ASP N N 15 127.0830 0.20 . 1 . . . . 82 ASP N . 26535 1 487 . 1 1 83 83 THR H H 1 8.0820 0.02 . 1 . . . . 83 THR HN . 26535 1 488 . 1 1 83 83 THR C C 13 175.5580 0.20 . 1 . . . . 83 THR C . 26535 1 489 . 1 1 83 83 THR CA C 13 61.6260 0.20 . 1 . . . . 83 THR CA . 26535 1 490 . 1 1 83 83 THR N N 15 113.2840 0.20 . 1 . . . . 83 THR N . 26535 1 491 . 1 1 84 84 LEU H H 1 8.7800 0.02 . 1 . . . . 84 LEU HN . 26535 1 492 . 1 1 84 84 LEU HD11 H 1 0.8569 0.02 . 1 . . . . 84 LEU HD11 . 26535 1 493 . 1 1 84 84 LEU HD12 H 1 0.8569 0.02 . 1 . . . . 84 LEU HD11 . 26535 1 494 . 1 1 84 84 LEU HD13 H 1 0.8569 0.02 . 1 . . . . 84 LEU HD11 . 26535 1 495 . 1 1 84 84 LEU HD21 H 1 0.8523 0.02 . 1 . . . . 84 LEU HD21 . 26535 1 496 . 1 1 84 84 LEU HD22 H 1 0.8523 0.02 . 1 . . . . 84 LEU HD21 . 26535 1 497 . 1 1 84 84 LEU HD23 H 1 0.8523 0.02 . 1 . . . . 84 LEU HD21 . 26535 1 498 . 1 1 84 84 LEU C C 13 177.7670 0.20 . 1 . . . . 84 LEU C . 26535 1 499 . 1 1 84 84 LEU CA C 13 58.3410 0.20 . 1 . . . . 84 LEU CA . 26535 1 500 . 1 1 84 84 LEU CD1 C 13 25.6539 0.20 . 1 . . . . 84 LEU CD1 . 26535 1 501 . 1 1 84 84 LEU CD2 C 13 24.8436 0.20 . 1 . . . . 84 LEU CD2 . 26535 1 502 . 1 1 84 84 LEU N N 15 124.7060 0.20 . 1 . . . . 84 LEU N . 26535 1 503 . 1 1 85 85 GLU H H 1 8.6350 0.02 . 1 . . . . 85 GLU HN . 26535 1 504 . 1 1 85 85 GLU C C 13 179.4160 0.20 . 1 . . . . 85 GLU C . 26535 1 505 . 1 1 85 85 GLU CA C 13 59.8810 0.20 . 1 . . . . 85 GLU CA . 26535 1 506 . 1 1 85 85 GLU N N 15 116.2930 0.20 . 1 . . . . 85 GLU N . 26535 1 507 . 1 1 86 86 ASP H H 1 7.6280 0.02 . 1 . . . . 86 ASP HN . 26535 1 508 . 1 1 86 86 ASP C C 13 177.7080 0.20 . 1 . . . . 86 ASP C . 26535 1 509 . 1 1 86 86 ASP CA C 13 57.7910 0.20 . 1 . . . . 86 ASP CA . 26535 1 510 . 1 1 86 86 ASP N N 15 120.6220 0.20 . 1 . . . . 86 ASP N . 26535 1 511 . 1 1 87 87 ARG H H 1 7.4600 0.02 . 1 . . . . 87 ARG HN . 26535 1 512 . 1 1 87 87 ARG C C 13 177.6640 0.20 . 1 . . . . 87 ARG C . 26535 1 513 . 1 1 87 87 ARG CA C 13 58.2730 0.20 . 1 . . . . 87 ARG CA . 26535 1 514 . 1 1 87 87 ARG N N 15 120.4020 0.20 . 1 . . . . 87 ARG N . 26535 1 515 . 1 1 88 88 ILE H H 1 7.7470 0.02 . 1 . . . . 88 ILE HN . 26535 1 516 . 1 1 88 88 ILE HD11 H 1 0.6162 0.02 . 1 . . . . 88 ILE HD11 . 26535 1 517 . 1 1 88 88 ILE HD12 H 1 0.6162 0.02 . 1 . . . . 88 ILE HD11 . 26535 1 518 . 1 1 88 88 ILE HD13 H 1 0.6162 0.02 . 1 . . . . 88 ILE HD11 . 26535 1 519 . 1 1 88 88 ILE C C 13 177.5750 0.20 . 1 . . . . 88 ILE C . 26535 1 520 . 1 1 88 88 ILE CA C 13 64.8760 0.20 . 1 . . . . 88 ILE CA . 26535 1 521 . 1 1 88 88 ILE CD1 C 13 14.0231 0.20 . 1 . . . . 88 ILE CD1 . 26535 1 522 . 1 1 88 88 ILE N N 15 116.2370 0.20 . 1 . . . . 88 ILE N . 26535 1 523 . 1 1 89 89 SER H H 1 7.9930 0.02 . 1 . . . . 89 SER HN . 26535 1 524 . 1 1 89 89 SER C C 13 178.5470 0.20 . 1 . . . . 89 SER C . 26535 1 525 . 1 1 89 89 SER CA C 13 61.2150 0.20 . 1 . . . . 89 SER CA . 26535 1 526 . 1 1 89 89 SER N N 15 113.5820 0.20 . 1 . . . . 89 SER N . 26535 1 527 . 1 1 90 90 GLY H H 1 8.5550 0.02 . 1 . . . . 90 GLY HN . 26535 1 528 . 1 1 90 90 GLY C C 13 174.3660 0.20 . 1 . . . . 90 GLY C . 26535 1 529 . 1 1 90 90 GLY CA C 13 47.2560 0.20 . 1 . . . . 90 GLY CA . 26535 1 530 . 1 1 90 90 GLY N N 15 110.9700 0.20 . 1 . . . . 90 GLY N . 26535 1 531 . 1 1 91 91 LEU H H 1 7.6110 0.02 . 1 . . . . 91 LEU HN . 26535 1 532 . 1 1 91 91 LEU HD11 H 1 0.6142 0.02 . 1 . . . . 91 LEU HD11 . 26535 1 533 . 1 1 91 91 LEU HD12 H 1 0.6142 0.02 . 1 . . . . 91 LEU HD11 . 26535 1 534 . 1 1 91 91 LEU HD13 H 1 0.6142 0.02 . 1 . . . . 91 LEU HD11 . 26535 1 535 . 1 1 91 91 LEU HD21 H 1 0.6496 0.02 . 1 . . . . 91 LEU HD21 . 26535 1 536 . 1 1 91 91 LEU HD22 H 1 0.6496 0.02 . 1 . . . . 91 LEU HD21 . 26535 1 537 . 1 1 91 91 LEU HD23 H 1 0.6496 0.02 . 1 . . . . 91 LEU HD21 . 26535 1 538 . 1 1 91 91 LEU C C 13 180.5190 0.20 . 1 . . . . 91 LEU C . 26535 1 539 . 1 1 91 91 LEU CA C 13 57.7590 0.20 . 1 . . . . 91 LEU CA . 26535 1 540 . 1 1 91 91 LEU CD1 C 13 21.7162 0.20 . 1 . . . . 91 LEU CD1 . 26535 1 541 . 1 1 91 91 LEU CD2 C 13 27.3181 0.20 . 1 . . . . 91 LEU CD2 . 26535 1 542 . 1 1 91 91 LEU N N 15 122.2260 0.20 . 1 . . . . 91 LEU N . 26535 1 543 . 1 1 92 92 ASP H H 1 9.0170 0.02 . 1 . . . . 92 ASP HN . 26535 1 544 . 1 1 92 92 ASP C C 13 178.5030 0.20 . 1 . . . . 92 ASP C . 26535 1 545 . 1 1 92 92 ASP CA C 13 57.3150 0.20 . 1 . . . . 92 ASP CA . 26535 1 546 . 1 1 92 92 ASP N N 15 120.4680 0.20 . 1 . . . . 92 ASP N . 26535 1 547 . 1 1 93 93 THR H H 1 7.9130 0.02 . 1 . . . . 93 THR HN . 26535 1 548 . 1 1 93 93 THR C C 13 173.9830 0.20 . 1 . . . . 93 THR C . 26535 1 549 . 1 1 93 93 THR CA C 13 64.9780 0.20 . 1 . . . . 93 THR CA . 26535 1 550 . 1 1 93 93 THR N N 15 116.3830 0.20 . 1 . . . . 93 THR N . 26535 1 551 . 1 1 94 94 GLY H H 1 7.7180 0.02 . 1 . . . . 94 GLY HN . 26535 1 552 . 1 1 94 94 GLY C C 13 174.1010 0.20 . 1 . . . . 94 GLY C . 26535 1 553 . 1 1 94 94 GLY CA C 13 44.5860 0.20 . 1 . . . . 94 GLY CA . 26535 1 554 . 1 1 94 94 GLY N N 15 104.7160 0.20 . 1 . . . . 94 GLY N . 26535 1 555 . 1 1 95 95 ALA H H 1 7.9700 0.02 . 1 . . . . 95 ALA HN . 26535 1 556 . 1 1 95 95 ALA C C 13 173.6150 0.20 . 1 . . . . 95 ALA C . 26535 1 557 . 1 1 95 95 ALA CA C 13 52.1490 0.20 . 1 . . . . 95 ALA CA . 26535 1 558 . 1 1 95 95 ALA N N 15 126.5930 0.20 . 1 . . . . 95 ALA N . 26535 1 559 . 1 1 96 96 ASP H H 1 8.7640 0.02 . 1 . . . . 96 ASP HN . 26535 1 560 . 1 1 96 96 ASP C C 13 174.5870 0.20 . 1 . . . . 96 ASP C . 26535 1 561 . 1 1 96 96 ASP CA C 13 55.3310 0.20 . 1 . . . . 96 ASP CA . 26535 1 562 . 1 1 96 96 ASP N N 15 117.2770 0.20 . 1 . . . . 96 ASP N . 26535 1 563 . 1 1 97 97 ASP H H 1 7.9670 0.02 . 1 . . . . 97 ASP HN . 26535 1 564 . 1 1 97 97 ASP C C 13 173.7920 0.20 . 1 . . . . 97 ASP C . 26535 1 565 . 1 1 97 97 ASP CA C 13 52.3880 0.20 . 1 . . . . 97 ASP CA . 26535 1 566 . 1 1 97 97 ASP N N 15 112.7430 0.20 . 1 . . . . 97 ASP N . 26535 1 567 . 1 1 98 98 TYR H H 1 10.5630 0.02 . 1 . . . . 98 TYR HN . 26535 1 568 . 1 1 98 98 TYR C C 13 173.1880 0.20 . 1 . . . . 98 TYR C . 26535 1 569 . 1 1 98 98 TYR CA C 13 57.0750 0.20 . 1 . . . . 98 TYR CA . 26535 1 570 . 1 1 98 98 TYR N N 15 128.2080 0.20 . 1 . . . . 98 TYR N . 26535 1 571 . 1 1 99 99 LEU H H 1 9.7070 0.02 . 1 . . . . 99 LEU HN . 26535 1 572 . 1 1 99 99 LEU HD11 H 1 0.7012 0.02 . 1 . . . . 99 LEU HD11 . 26535 1 573 . 1 1 99 99 LEU HD12 H 1 0.7012 0.02 . 1 . . . . 99 LEU HD11 . 26535 1 574 . 1 1 99 99 LEU HD13 H 1 0.7012 0.02 . 1 . . . . 99 LEU HD11 . 26535 1 575 . 1 1 99 99 LEU HD21 H 1 0.9318 0.02 . 1 . . . . 99 LEU HD21 . 26535 1 576 . 1 1 99 99 LEU HD22 H 1 0.9318 0.02 . 1 . . . . 99 LEU HD21 . 26535 1 577 . 1 1 99 99 LEU HD23 H 1 0.9318 0.02 . 1 . . . . 99 LEU HD21 . 26535 1 578 . 1 1 99 99 LEU C C 13 173.5420 0.20 . 1 . . . . 99 LEU C . 26535 1 579 . 1 1 99 99 LEU CA C 13 53.0380 0.20 . 1 . . . . 99 LEU CA . 26535 1 580 . 1 1 99 99 LEU CD1 C 13 25.9559 0.20 . 1 . . . . 99 LEU CD1 . 26535 1 581 . 1 1 99 99 LEU CD2 C 13 24.1345 0.20 . 1 . . . . 99 LEU CD2 . 26535 1 582 . 1 1 99 99 LEU N N 15 135.9590 0.20 . 1 . . . . 99 LEU N . 26535 1 583 . 1 1 100 100 VAL H H 1 7.6130 0.02 . 1 . . . . 100 VAL HN . 26535 1 584 . 1 1 100 100 VAL HG11 H 1 1.0992 0.02 . 1 . . . . 100 VAL HG11 . 26535 1 585 . 1 1 100 100 VAL HG12 H 1 1.0992 0.02 . 1 . . . . 100 VAL HG11 . 26535 1 586 . 1 1 100 100 VAL HG13 H 1 1.0992 0.02 . 1 . . . . 100 VAL HG11 . 26535 1 587 . 1 1 100 100 VAL HG21 H 1 1.0150 0.02 . 1 . . . . 100 VAL HG21 . 26535 1 588 . 1 1 100 100 VAL HG22 H 1 1.0150 0.02 . 1 . . . . 100 VAL HG21 . 26535 1 589 . 1 1 100 100 VAL HG23 H 1 1.0150 0.02 . 1 . . . . 100 VAL HG21 . 26535 1 590 . 1 1 100 100 VAL C C 13 175.3950 0.20 . 1 . . . . 100 VAL C . 26535 1 591 . 1 1 100 100 VAL CA C 13 59.5390 0.20 . 1 . . . . 100 VAL CA . 26535 1 592 . 1 1 100 100 VAL CG1 C 13 22.0780 0.20 . 1 . . . . 100 VAL CG1 . 26535 1 593 . 1 1 100 100 VAL CG2 C 13 19.8168 0.20 . 1 . . . . 100 VAL CG2 . 26535 1 594 . 1 1 100 100 VAL N N 15 119.1740 0.20 . 1 . . . . 100 VAL N . 26535 1 595 . 1 1 101 101 LYS H H 1 7.4640 0.02 . 1 . . . . 101 LYS HN . 26535 1 596 . 1 1 101 101 LYS CA C 13 53.3810 0.20 . 1 . . . . 101 LYS CA . 26535 1 597 . 1 1 101 101 LYS N N 15 120.7020 0.20 . 1 . . . . 101 LYS N . 26535 1 598 . 1 1 102 102 PRO C C 13 174.3950 0.20 . 1 . . . . 102 PRO C . 26535 1 599 . 1 1 102 102 PRO CA C 13 62.4130 0.20 . 1 . . . . 102 PRO CA . 26535 1 600 . 1 1 103 103 PHE H H 1 7.5400 0.02 . 1 . . . . 103 PHE HN . 26535 1 601 . 1 1 103 103 PHE C C 13 173.2620 0.20 . 1 . . . . 103 PHE C . 26535 1 602 . 1 1 103 103 PHE CA C 13 53.7570 0.20 . 1 . . . . 103 PHE CA . 26535 1 603 . 1 1 103 103 PHE N N 15 116.8830 0.20 . 1 . . . . 103 PHE N . 26535 1 604 . 1 1 104 104 ALA H H 1 9.0870 0.02 . 1 . . . . 104 ALA HN . 26535 1 605 . 1 1 104 104 ALA CA C 13 49.6850 0.20 . 1 . . . . 104 ALA CA . 26535 1 606 . 1 1 104 104 ALA N N 15 124.2990 0.20 . 1 . . . . 104 ALA N . 26535 1 607 . 1 1 105 105 LEU HD11 H 1 0.9064 0.02 . 1 . . . . 105 LEU HD11 . 26535 1 608 . 1 1 105 105 LEU HD12 H 1 0.9064 0.02 . 1 . . . . 105 LEU HD11 . 26535 1 609 . 1 1 105 105 LEU HD13 H 1 0.9064 0.02 . 1 . . . . 105 LEU HD11 . 26535 1 610 . 1 1 105 105 LEU HD21 H 1 0.9220 0.02 . 1 . . . . 105 LEU HD21 . 26535 1 611 . 1 1 105 105 LEU HD22 H 1 0.9220 0.02 . 1 . . . . 105 LEU HD21 . 26535 1 612 . 1 1 105 105 LEU HD23 H 1 0.9220 0.02 . 1 . . . . 105 LEU HD21 . 26535 1 613 . 1 1 105 105 LEU C C 13 177.8260 0.20 . 1 . . . . 105 LEU C . 26535 1 614 . 1 1 105 105 LEU CA C 13 58.2040 0.20 . 1 . . . . 105 LEU CA . 26535 1 615 . 1 1 105 105 LEU CD1 C 13 24.1078 0.20 . 1 . . . . 105 LEU CD1 . 26535 1 616 . 1 1 105 105 LEU CD2 C 13 23.4934 0.20 . 1 . . . . 105 LEU CD2 . 26535 1 617 . 1 1 106 106 GLU H H 1 9.9030 0.02 . 1 . . . . 106 GLU HN . 26535 1 618 . 1 1 106 106 GLU C C 13 180.4310 0.20 . 1 . . . . 106 GLU C . 26535 1 619 . 1 1 106 106 GLU CA C 13 59.3330 0.20 . 1 . . . . 106 GLU CA . 26535 1 620 . 1 1 106 106 GLU N N 15 114.9650 0.20 . 1 . . . . 106 GLU N . 26535 1 621 . 1 1 107 107 GLU H H 1 7.3690 0.02 . 1 . . . . 107 GLU HN . 26535 1 622 . 1 1 107 107 GLU C C 13 177.5900 0.20 . 1 . . . . 107 GLU C . 26535 1 623 . 1 1 107 107 GLU CA C 13 59.1280 0.20 . 1 . . . . 107 GLU CA . 26535 1 624 . 1 1 107 107 GLU N N 15 119.4420 0.20 . 1 . . . . 107 GLU N . 26535 1 625 . 1 1 108 108 LEU H H 1 7.7540 0.02 . 1 . . . . 108 LEU HN . 26535 1 626 . 1 1 108 108 LEU HD11 H 1 0.5606 0.02 . 1 . . . . 108 LEU HD11 . 26535 1 627 . 1 1 108 108 LEU HD12 H 1 0.5606 0.02 . 1 . . . . 108 LEU HD11 . 26535 1 628 . 1 1 108 108 LEU HD13 H 1 0.5606 0.02 . 1 . . . . 108 LEU HD11 . 26535 1 629 . 1 1 108 108 LEU HD21 H 1 0.7542 0.02 . 1 . . . . 108 LEU HD21 . 26535 1 630 . 1 1 108 108 LEU HD22 H 1 0.7542 0.02 . 1 . . . . 108 LEU HD21 . 26535 1 631 . 1 1 108 108 LEU HD23 H 1 0.7542 0.02 . 1 . . . . 108 LEU HD21 . 26535 1 632 . 1 1 108 108 LEU C C 13 177.8990 0.20 . 1 . . . . 108 LEU C . 26535 1 633 . 1 1 108 108 LEU CA C 13 58.8210 0.20 . 1 . . . . 108 LEU CA . 26535 1 634 . 1 1 108 108 LEU CD1 C 13 24.9319 0.20 . 1 . . . . 108 LEU CD1 . 26535 1 635 . 1 1 108 108 LEU CD2 C 13 24.8624 0.20 . 1 . . . . 108 LEU CD2 . 26535 1 636 . 1 1 108 108 LEU N N 15 121.6060 0.20 . 1 . . . . 108 LEU N . 26535 1 637 . 1 1 109 109 ASN H H 1 8.5050 0.02 . 1 . . . . 109 ASN HN . 26535 1 638 . 1 1 109 109 ASN C C 13 178.4730 0.20 . 1 . . . . 109 ASN C . 26535 1 639 . 1 1 109 109 ASN CA C 13 55.7410 0.20 . 1 . . . . 109 ASN CA . 26535 1 640 . 1 1 109 109 ASN N N 15 115.9820 0.20 . 1 . . . . 109 ASN N . 26535 1 641 . 1 1 110 110 ALA H H 1 7.5470 0.02 . 1 . . . . 110 ALA HN . 26535 1 642 . 1 1 110 110 ALA C C 13 179.8860 0.20 . 1 . . . . 110 ALA C . 26535 1 643 . 1 1 110 110 ALA CA C 13 54.4070 0.20 . 1 . . . . 110 ALA CA . 26535 1 644 . 1 1 110 110 ALA N N 15 122.7520 0.20 . 1 . . . . 110 ALA N . 26535 1 645 . 1 1 111 111 ARG H H 1 8.4130 0.02 . 1 . . . . 111 ARG HN . 26535 1 646 . 1 1 111 111 ARG C C 13 178.5910 0.20 . 1 . . . . 111 ARG C . 26535 1 647 . 1 1 111 111 ARG CA C 13 59.9480 0.20 . 1 . . . . 111 ARG CA . 26535 1 648 . 1 1 111 111 ARG N N 15 120.7910 0.20 . 1 . . . . 111 ARG N . 26535 1 649 . 1 1 112 112 ILE H H 1 8.3980 0.02 . 1 . . . . 112 ILE HN . 26535 1 650 . 1 1 112 112 ILE HD11 H 1 0.6031 0.02 . 1 . . . . 112 ILE HD11 . 26535 1 651 . 1 1 112 112 ILE HD12 H 1 0.6031 0.02 . 1 . . . . 112 ILE HD11 . 26535 1 652 . 1 1 112 112 ILE HD13 H 1 0.6031 0.02 . 1 . . . . 112 ILE HD11 . 26535 1 653 . 1 1 112 112 ILE C C 13 177.6930 0.20 . 1 . . . . 112 ILE C . 26535 1 654 . 1 1 112 112 ILE CA C 13 66.0730 0.20 . 1 . . . . 112 ILE CA . 26535 1 655 . 1 1 112 112 ILE CD1 C 13 13.4012 0.20 . 1 . . . . 112 ILE CD1 . 26535 1 656 . 1 1 112 112 ILE N N 15 122.1470 0.20 . 1 . . . . 112 ILE N . 26535 1 657 . 1 1 113 113 ARG H H 1 7.9370 0.02 . 1 . . . . 113 ARG HN . 26535 1 658 . 1 1 113 113 ARG C C 13 179.6660 0.20 . 1 . . . . 113 ARG C . 26535 1 659 . 1 1 113 113 ARG CA C 13 60.4280 0.20 . 1 . . . . 113 ARG CA . 26535 1 660 . 1 1 113 113 ARG N N 15 117.7200 0.20 . 1 . . . . 113 ARG N . 26535 1 661 . 1 1 114 114 ALA H H 1 7.7910 0.02 . 1 . . . . 114 ALA HN . 26535 1 662 . 1 1 114 114 ALA C C 13 177.5900 0.20 . 1 . . . . 114 ALA C . 26535 1 663 . 1 1 114 114 ALA CA C 13 54.9880 0.20 . 1 . . . . 114 ALA CA . 26535 1 664 . 1 1 114 114 ALA N N 15 121.3810 0.20 . 1 . . . . 114 ALA N . 26535 1 665 . 1 1 115 115 LEU H H 1 7.9370 0.02 . 1 . . . . 115 LEU HN . 26535 1 666 . 1 1 115 115 LEU HD21 H 1 0.6768 0.02 . 1 . . . . 115 LEU HD21 . 26535 1 667 . 1 1 115 115 LEU HD22 H 1 0.6768 0.02 . 1 . . . . 115 LEU HD21 . 26535 1 668 . 1 1 115 115 LEU HD23 H 1 0.6768 0.02 . 1 . . . . 115 LEU HD21 . 26535 1 669 . 1 1 115 115 LEU C C 13 175.9710 0.20 . 1 . . . . 115 LEU C . 26535 1 670 . 1 1 115 115 LEU CA C 13 54.4530 0.20 . 1 . . . . 115 LEU CA . 26535 1 671 . 1 1 115 115 LEU CD2 C 13 22.8317 0.20 . 1 . . . . 115 LEU CD2 . 26535 1 672 . 1 1 115 115 LEU N N 15 121.3350 0.20 . 1 . . . . 115 LEU N . 26535 1 673 . 1 1 116 116 LEU H H 1 8.2790 0.02 . 1 . . . . 116 LEU HN . 26535 1 674 . 1 1 116 116 LEU HD11 H 1 0.7493 0.02 . 1 . . . . 116 LEU HD11 . 26535 1 675 . 1 1 116 116 LEU HD12 H 1 0.7493 0.02 . 1 . . . . 116 LEU HD11 . 26535 1 676 . 1 1 116 116 LEU HD13 H 1 0.7493 0.02 . 1 . . . . 116 LEU HD11 . 26535 1 677 . 1 1 116 116 LEU HD21 H 1 0.8561 0.02 . 1 . . . . 116 LEU HD21 . 26535 1 678 . 1 1 116 116 LEU HD22 H 1 0.8561 0.02 . 1 . . . . 116 LEU HD21 . 26535 1 679 . 1 1 116 116 LEU HD23 H 1 0.8561 0.02 . 1 . . . . 116 LEU HD21 . 26535 1 680 . 1 1 116 116 LEU CA C 13 54.4410 0.20 . 1 . . . . 116 LEU CA . 26535 1 681 . 1 1 116 116 LEU CD1 C 13 26.4222 0.20 . 1 . . . . 116 LEU CD1 . 26535 1 682 . 1 1 116 116 LEU CD2 C 13 24.5844 0.20 . 1 . . . . 116 LEU CD2 . 26535 1 683 . 1 1 116 116 LEU N N 15 121.3050 0.20 . 1 . . . . 116 LEU N . 26535 1 684 . 1 1 125 125 ASN C C 13 173.7620 0.20 . 1 . . . . 125 ASN C . 26535 1 685 . 1 1 126 126 GLU H H 1 7.9990 0.02 . 1 . . . . 126 GLU HN . 26535 1 686 . 1 1 126 126 GLU C C 13 175.2760 0.20 . 1 . . . . 126 GLU C . 26535 1 687 . 1 1 126 126 GLU CA C 13 54.6800 0.20 . 1 . . . . 126 GLU CA . 26535 1 688 . 1 1 126 126 GLU N N 15 121.6620 0.20 . 1 . . . . 126 GLU N . 26535 1 689 . 1 1 127 127 ILE H H 1 8.8990 0.02 . 1 . . . . 127 ILE HN . 26535 1 690 . 1 1 127 127 ILE HD11 H 1 0.8134 0.02 . 1 . . . . 127 ILE HD11 . 26535 1 691 . 1 1 127 127 ILE HD12 H 1 0.8134 0.02 . 1 . . . . 127 ILE HD11 . 26535 1 692 . 1 1 127 127 ILE HD13 H 1 0.8134 0.02 . 1 . . . . 127 ILE HD11 . 26535 1 693 . 1 1 127 127 ILE C C 13 174.4980 0.20 . 1 . . . . 127 ILE C . 26535 1 694 . 1 1 127 127 ILE CA C 13 59.9490 0.20 . 1 . . . . 127 ILE CA . 26535 1 695 . 1 1 127 127 ILE CD1 C 13 13.8929 0.20 . 1 . . . . 127 ILE CD1 . 26535 1 696 . 1 1 127 127 ILE N N 15 123.0840 0.20 . 1 . . . . 127 ILE N . 26535 1 697 . 1 1 128 128 SER H H 1 8.5830 0.02 . 1 . . . . 128 SER HN . 26535 1 698 . 1 1 128 128 SER C C 13 173.8800 0.20 . 1 . . . . 128 SER C . 26535 1 699 . 1 1 128 128 SER CA C 13 56.7330 0.20 . 1 . . . . 128 SER CA . 26535 1 700 . 1 1 128 128 SER N N 15 120.6610 0.20 . 1 . . . . 128 SER N . 26535 1 701 . 1 1 129 129 VAL H H 1 8.7710 0.02 . 1 . . . . 129 VAL HN . 26535 1 702 . 1 1 129 129 VAL HG11 H 1 0.9047 0.02 . 1 . . . . 129 VAL HG11 . 26535 1 703 . 1 1 129 129 VAL HG12 H 1 0.9047 0.02 . 1 . . . . 129 VAL HG11 . 26535 1 704 . 1 1 129 129 VAL HG13 H 1 0.9047 0.02 . 1 . . . . 129 VAL HG11 . 26535 1 705 . 1 1 129 129 VAL HG21 H 1 0.8562 0.02 . 1 . . . . 129 VAL HG21 . 26535 1 706 . 1 1 129 129 VAL HG22 H 1 0.8562 0.02 . 1 . . . . 129 VAL HG21 . 26535 1 707 . 1 1 129 129 VAL HG23 H 1 0.8562 0.02 . 1 . . . . 129 VAL HG21 . 26535 1 708 . 1 1 129 129 VAL C C 13 175.9160 0.20 . 1 . . . . 129 VAL C . 26535 1 709 . 1 1 129 129 VAL CA C 13 61.2150 0.20 . 1 . . . . 129 VAL CA . 26535 1 710 . 1 1 129 129 VAL CG1 C 13 21.1321 0.20 . 1 . . . . 129 VAL CG1 . 26535 1 711 . 1 1 129 129 VAL CG2 C 13 21.0659 0.20 . 1 . . . . 129 VAL CG2 . 26535 1 712 . 1 1 129 129 VAL N N 15 125.4530 0.20 . 1 . . . . 129 VAL N . 26535 1 713 . 1 1 130 130 GLY C C 13 172.3770 0.20 . 1 . . . . 130 GLY C . 26535 1 714 . 1 1 130 130 GLY CA C 13 46.9140 0.20 . 1 . . . . 130 GLY CA . 26535 1 715 . 1 1 131 131 ASN H H 1 8.4880 0.02 . 1 . . . . 131 ASN HN . 26535 1 716 . 1 1 131 131 ASN C C 13 174.5860 0.20 . 1 . . . . 131 ASN C . 26535 1 717 . 1 1 131 131 ASN CA C 13 53.0720 0.20 . 1 . . . . 131 ASN CA . 26535 1 718 . 1 1 131 131 ASN N N 15 125.0250 0.20 . 1 . . . . 131 ASN N . 26535 1 719 . 1 1 132 132 LEU H H 1 8.1230 0.02 . 1 . . . . 132 LEU HN . 26535 1 720 . 1 1 132 132 LEU HD11 H 1 0.9498 0.02 . 1 . . . . 132 LEU HD11 . 26535 1 721 . 1 1 132 132 LEU HD12 H 1 0.9498 0.02 . 1 . . . . 132 LEU HD11 . 26535 1 722 . 1 1 132 132 LEU HD13 H 1 0.9498 0.02 . 1 . . . . 132 LEU HD11 . 26535 1 723 . 1 1 132 132 LEU HD21 H 1 0.9071 0.02 . 1 . . . . 132 LEU HD21 . 26535 1 724 . 1 1 132 132 LEU HD22 H 1 0.9071 0.02 . 1 . . . . 132 LEU HD21 . 26535 1 725 . 1 1 132 132 LEU HD23 H 1 0.9071 0.02 . 1 . . . . 132 LEU HD21 . 26535 1 726 . 1 1 132 132 LEU C C 13 175.3120 0.20 . 1 . . . . 132 LEU C . 26535 1 727 . 1 1 132 132 LEU CA C 13 53.7910 0.20 . 1 . . . . 132 LEU CA . 26535 1 728 . 1 1 132 132 LEU CD1 C 13 25.8493 0.20 . 1 . . . . 132 LEU CD1 . 26535 1 729 . 1 1 132 132 LEU CD2 C 13 25.8175 0.20 . 1 . . . . 132 LEU CD2 . 26535 1 730 . 1 1 132 132 LEU N N 15 123.9330 0.20 . 1 . . . . 132 LEU N . 26535 1 731 . 1 1 133 133 ARG H H 1 9.0440 0.02 . 1 . . . . 133 ARG HN . 26535 1 732 . 1 1 133 133 ARG C C 13 173.2670 0.20 . 1 . . . . 133 ARG C . 26535 1 733 . 1 1 133 133 ARG CA C 13 54.3730 0.20 . 1 . . . . 133 ARG CA . 26535 1 734 . 1 1 133 133 ARG N N 15 125.1110 0.20 . 1 . . . . 133 ARG N . 26535 1 735 . 1 1 134 134 LEU H H 1 9.2310 0.02 . 1 . . . . 134 LEU HN . 26535 1 736 . 1 1 134 134 LEU HD11 H 1 0.6570 0.02 . 1 . . . . 134 LEU HD11 . 26535 1 737 . 1 1 134 134 LEU HD12 H 1 0.6570 0.02 . 1 . . . . 134 LEU HD11 . 26535 1 738 . 1 1 134 134 LEU HD13 H 1 0.6570 0.02 . 1 . . . . 134 LEU HD11 . 26535 1 739 . 1 1 134 134 LEU HD21 H 1 0.7673 0.02 . 1 . . . . 134 LEU HD21 . 26535 1 740 . 1 1 134 134 LEU HD22 H 1 0.7673 0.02 . 1 . . . . 134 LEU HD21 . 26535 1 741 . 1 1 134 134 LEU HD23 H 1 0.7673 0.02 . 1 . . . . 134 LEU HD21 . 26535 1 742 . 1 1 134 134 LEU C C 13 174.6910 0.20 . 1 . . . . 134 LEU C . 26535 1 743 . 1 1 134 134 LEU CA C 13 53.9280 0.20 . 1 . . . . 134 LEU CA . 26535 1 744 . 1 1 134 134 LEU CD1 C 13 25.0677 0.20 . 1 . . . . 134 LEU CD1 . 26535 1 745 . 1 1 134 134 LEU CD2 C 13 25.9471 0.20 . 1 . . . . 134 LEU CD2 . 26535 1 746 . 1 1 134 134 LEU N N 15 127.7580 0.20 . 1 . . . . 134 LEU N . 26535 1 747 . 1 1 135 135 ASN H H 1 9.4200 0.02 . 1 . . . . 135 ASN HN . 26535 1 748 . 1 1 135 135 ASN C C 13 175.4230 0.20 . 1 . . . . 135 ASN C . 26535 1 749 . 1 1 135 135 ASN CA C 13 52.1830 0.20 . 1 . . . . 135 ASN CA . 26535 1 750 . 1 1 135 135 ASN N N 15 126.0260 0.20 . 1 . . . . 135 ASN N . 26535 1 751 . 1 1 136 136 VAL H H 1 8.5940 0.02 . 1 . . . . 136 VAL HN . 26535 1 752 . 1 1 136 136 VAL HG11 H 1 0.9799 0.02 . 1 . . . . 136 VAL HG11 . 26535 1 753 . 1 1 136 136 VAL HG12 H 1 0.9799 0.02 . 1 . . . . 136 VAL HG11 . 26535 1 754 . 1 1 136 136 VAL HG13 H 1 0.9799 0.02 . 1 . . . . 136 VAL HG11 . 26535 1 755 . 1 1 136 136 VAL HG21 H 1 0.9762 0.02 . 1 . . . . 136 VAL HG21 . 26535 1 756 . 1 1 136 136 VAL HG22 H 1 0.9762 0.02 . 1 . . . . 136 VAL HG21 . 26535 1 757 . 1 1 136 136 VAL HG23 H 1 0.9762 0.02 . 1 . . . . 136 VAL HG21 . 26535 1 758 . 1 1 136 136 VAL C C 13 177.8110 0.20 . 1 . . . . 136 VAL C . 26535 1 759 . 1 1 136 136 VAL CA C 13 64.1920 0.20 . 1 . . . . 136 VAL CA . 26535 1 760 . 1 1 136 136 VAL CG1 C 13 21.2215 0.20 . 1 . . . . 136 VAL CG1 . 26535 1 761 . 1 1 136 136 VAL CG2 C 13 20.9009 0.20 . 1 . . . . 136 VAL CG2 . 26535 1 762 . 1 1 136 136 VAL N N 15 123.7630 0.20 . 1 . . . . 136 VAL N . 26535 1 763 . 1 1 137 137 THR H H 1 8.0050 0.02 . 1 . . . . 137 THR HN . 26535 1 764 . 1 1 137 137 THR C C 13 176.0210 0.20 . 1 . . . . 137 THR C . 26535 1 765 . 1 1 137 137 THR CA C 13 65.0810 0.20 . 1 . . . . 137 THR CA . 26535 1 766 . 1 1 137 137 THR N N 15 116.2910 0.20 . 1 . . . . 137 THR N . 26535 1 767 . 1 1 138 138 ARG H H 1 7.9010 0.02 . 1 . . . . 138 ARG HN . 26535 1 768 . 1 1 138 138 ARG C C 13 174.6590 0.20 . 1 . . . . 138 ARG C . 26535 1 769 . 1 1 138 138 ARG CA C 13 55.2620 0.20 . 1 . . . . 138 ARG CA . 26535 1 770 . 1 1 138 138 ARG N N 15 117.5440 0.20 . 1 . . . . 138 ARG N . 26535 1 771 . 1 1 139 139 ARG H H 1 7.7760 0.02 . 1 . . . . 139 ARG HN . 26535 1 772 . 1 1 139 139 ARG C C 13 174.2980 0.20 . 1 . . . . 139 ARG C . 26535 1 773 . 1 1 139 139 ARG CA C 13 56.0830 0.20 . 1 . . . . 139 ARG CA . 26535 1 774 . 1 1 139 139 ARG N N 15 118.1790 0.20 . 1 . . . . 139 ARG N . 26535 1 775 . 1 1 140 140 LEU H H 1 7.4800 0.02 . 1 . . . . 140 LEU HN . 26535 1 776 . 1 1 140 140 LEU HD11 H 1 0.7252 0.02 . 1 . . . . 140 LEU HD11 . 26535 1 777 . 1 1 140 140 LEU HD12 H 1 0.7252 0.02 . 1 . . . . 140 LEU HD11 . 26535 1 778 . 1 1 140 140 LEU HD13 H 1 0.7252 0.02 . 1 . . . . 140 LEU HD11 . 26535 1 779 . 1 1 140 140 LEU HD21 H 1 0.6028 0.02 . 1 . . . . 140 LEU HD21 . 26535 1 780 . 1 1 140 140 LEU HD22 H 1 0.6028 0.02 . 1 . . . . 140 LEU HD21 . 26535 1 781 . 1 1 140 140 LEU HD23 H 1 0.6028 0.02 . 1 . . . . 140 LEU HD21 . 26535 1 782 . 1 1 140 140 LEU C C 13 174.4600 0.20 . 1 . . . . 140 LEU C . 26535 1 783 . 1 1 140 140 LEU CA C 13 52.6280 0.20 . 1 . . . . 140 LEU CA . 26535 1 784 . 1 1 140 140 LEU CD1 C 13 25.5434 0.20 . 1 . . . . 140 LEU CD1 . 26535 1 785 . 1 1 140 140 LEU CD2 C 13 22.9790 0.20 . 1 . . . . 140 LEU CD2 . 26535 1 786 . 1 1 140 140 LEU N N 15 119.6300 0.20 . 1 . . . . 140 LEU N . 26535 1 787 . 1 1 141 141 VAL H H 1 8.2100 0.02 . 1 . . . . 141 VAL HN . 26535 1 788 . 1 1 141 141 VAL HG11 H 1 0.8497 0.02 . 1 . . . . 141 VAL HG11 . 26535 1 789 . 1 1 141 141 VAL HG12 H 1 0.8497 0.02 . 1 . . . . 141 VAL HG11 . 26535 1 790 . 1 1 141 141 VAL HG13 H 1 0.8497 0.02 . 1 . . . . 141 VAL HG11 . 26535 1 791 . 1 1 141 141 VAL HG21 H 1 0.9277 0.02 . 1 . . . . 141 VAL HG21 . 26535 1 792 . 1 1 141 141 VAL HG22 H 1 0.9277 0.02 . 1 . . . . 141 VAL HG21 . 26535 1 793 . 1 1 141 141 VAL HG23 H 1 0.9277 0.02 . 1 . . . . 141 VAL HG21 . 26535 1 794 . 1 1 141 141 VAL C C 13 173.8320 0.20 . 1 . . . . 141 VAL C . 26535 1 795 . 1 1 141 141 VAL CA C 13 59.6760 0.20 . 1 . . . . 141 VAL CA . 26535 1 796 . 1 1 141 141 VAL CG1 C 13 22.0255 0.20 . 1 . . . . 141 VAL CG1 . 26535 1 797 . 1 1 141 141 VAL CG2 C 13 22.2562 0.20 . 1 . . . . 141 VAL CG2 . 26535 1 798 . 1 1 141 141 VAL N N 15 121.2190 0.20 . 1 . . . . 141 VAL N . 26535 1 799 . 1 1 142 142 TRP H H 1 9.4420 0.02 . 1 . . . . 142 TRP HN . 26535 1 800 . 1 1 142 142 TRP HE1 H 1 9.9650 0.02 . 1 . . . . 142 TRP HE1 . 26535 1 801 . 1 1 142 142 TRP C C 13 174.6490 0.20 . 1 . . . . 142 TRP C . 26535 1 802 . 1 1 142 142 TRP CA C 13 56.7670 0.20 . 1 . . . . 142 TRP CA . 26535 1 803 . 1 1 142 142 TRP N N 15 126.7660 0.20 . 1 . . . . 142 TRP N . 26535 1 804 . 1 1 142 142 TRP NE1 N 15 128.8560 0.20 . 1 . . . . 142 TRP NE1 . 26535 1 805 . 1 1 143 143 LEU H H 1 8.7470 0.02 . 1 . . . . 143 LEU HN . 26535 1 806 . 1 1 143 143 LEU HD11 H 1 0.9639 0.02 . 1 . . . . 143 LEU HD11 . 26535 1 807 . 1 1 143 143 LEU HD12 H 1 0.9639 0.02 . 1 . . . . 143 LEU HD11 . 26535 1 808 . 1 1 143 143 LEU HD13 H 1 0.9639 0.02 . 1 . . . . 143 LEU HD11 . 26535 1 809 . 1 1 143 143 LEU HD21 H 1 0.9030 0.02 . 1 . . . . 143 LEU HD21 . 26535 1 810 . 1 1 143 143 LEU HD22 H 1 0.9030 0.02 . 1 . . . . 143 LEU HD21 . 26535 1 811 . 1 1 143 143 LEU HD23 H 1 0.9030 0.02 . 1 . . . . 143 LEU HD21 . 26535 1 812 . 1 1 143 143 LEU C C 13 177.4860 0.20 . 1 . . . . 143 LEU C . 26535 1 813 . 1 1 143 143 LEU CA C 13 52.2430 0.20 . 1 . . . . 143 LEU CA . 26535 1 814 . 1 1 143 143 LEU CD1 C 13 25.9771 0.20 . 1 . . . . 143 LEU CD1 . 26535 1 815 . 1 1 143 143 LEU CD2 C 13 24.3830 0.20 . 1 . . . . 143 LEU CD2 . 26535 1 816 . 1 1 143 143 LEU N N 15 123.6030 0.20 . 1 . . . . 143 LEU N . 26535 1 817 . 1 1 144 144 GLY H H 1 9.2540 0.02 . 1 . . . . 144 GLY HN . 26535 1 818 . 1 1 144 144 GLY CA C 13 46.6750 0.20 . 1 . . . . 144 GLY CA . 26535 1 819 . 1 1 144 144 GLY N N 15 117.4600 0.20 . 1 . . . . 144 GLY N . 26535 1 820 . 1 1 145 145 GLU C C 13 176.1980 0.20 . 1 . . . . 145 GLU C . 26535 1 821 . 1 1 145 145 GLU CA C 13 56.1170 0.20 . 1 . . . . 145 GLU CA . 26535 1 822 . 1 1 146 146 THR H H 1 8.0360 0.02 . 1 . . . . 146 THR HN . 26535 1 823 . 1 1 146 146 THR C C 13 173.0780 0.20 . 1 . . . . 146 THR C . 26535 1 824 . 1 1 146 146 THR CA C 13 61.8990 0.20 . 1 . . . . 146 THR CA . 26535 1 825 . 1 1 146 146 THR N N 15 117.7990 0.20 . 1 . . . . 146 THR N . 26535 1 826 . 1 1 147 147 ALA H H 1 8.7270 0.02 . 1 . . . . 147 ALA HN . 26535 1 827 . 1 1 147 147 ALA C C 13 177.2240 0.20 . 1 . . . . 147 ALA C . 26535 1 828 . 1 1 147 147 ALA CA C 13 52.0810 0.20 . 1 . . . . 147 ALA CA . 26535 1 829 . 1 1 147 147 ALA N N 15 131.1780 0.20 . 1 . . . . 147 ALA N . 26535 1 830 . 1 1 148 148 LEU H H 1 8.4630 0.02 . 1 . . . . 148 LEU HN . 26535 1 831 . 1 1 148 148 LEU HD11 H 1 0.6509 0.02 . 1 . . . . 148 LEU HD11 . 26535 1 832 . 1 1 148 148 LEU HD12 H 1 0.6509 0.02 . 1 . . . . 148 LEU HD11 . 26535 1 833 . 1 1 148 148 LEU HD13 H 1 0.6509 0.02 . 1 . . . . 148 LEU HD11 . 26535 1 834 . 1 1 148 148 LEU HD21 H 1 0.7501 0.02 . 1 . . . . 148 LEU HD21 . 26535 1 835 . 1 1 148 148 LEU HD22 H 1 0.7501 0.02 . 1 . . . . 148 LEU HD21 . 26535 1 836 . 1 1 148 148 LEU HD23 H 1 0.7501 0.02 . 1 . . . . 148 LEU HD21 . 26535 1 837 . 1 1 148 148 LEU C C 13 175.7810 0.20 . 1 . . . . 148 LEU C . 26535 1 838 . 1 1 148 148 LEU CA C 13 53.0040 0.20 . 1 . . . . 148 LEU CA . 26535 1 839 . 1 1 148 148 LEU CD1 C 13 26.0200 0.20 . 1 . . . . 148 LEU CD1 . 26535 1 840 . 1 1 148 148 LEU CD2 C 13 23.7568 0.20 . 1 . . . . 148 LEU CD2 . 26535 1 841 . 1 1 148 148 LEU N N 15 124.2860 0.20 . 1 . . . . 148 LEU N . 26535 1 842 . 1 1 149 149 ASP H H 1 8.4960 0.02 . 1 . . . . 149 ASP HN . 26535 1 843 . 1 1 149 149 ASP C C 13 180.9410 0.20 . 1 . . . . 149 ASP C . 26535 1 844 . 1 1 149 149 ASP CA C 13 52.7310 0.20 . 1 . . . . 149 ASP CA . 26535 1 845 . 1 1 149 149 ASP N N 15 124.6620 0.20 . 1 . . . . 149 ASP N . 26535 1 846 . 1 1 150 150 LEU H H 1 8.1250 0.02 . 1 . . . . 150 LEU HN . 26535 1 847 . 1 1 150 150 LEU HD11 H 1 0.7977 0.02 . 1 . . . . 150 LEU HD11 . 26535 1 848 . 1 1 150 150 LEU HD12 H 1 0.7977 0.02 . 1 . . . . 150 LEU HD11 . 26535 1 849 . 1 1 150 150 LEU HD13 H 1 0.7977 0.02 . 1 . . . . 150 LEU HD11 . 26535 1 850 . 1 1 150 150 LEU HD21 H 1 0.8235 0.02 . 1 . . . . 150 LEU HD21 . 26535 1 851 . 1 1 150 150 LEU HD22 H 1 0.8235 0.02 . 1 . . . . 150 LEU HD21 . 26535 1 852 . 1 1 150 150 LEU HD23 H 1 0.8235 0.02 . 1 . . . . 150 LEU HD21 . 26535 1 853 . 1 1 150 150 LEU C C 13 180.0300 0.20 . 1 . . . . 150 LEU C . 26535 1 854 . 1 1 150 150 LEU CA C 13 52.5380 0.20 . 1 . . . . 150 LEU CA . 26535 1 855 . 1 1 150 150 LEU CD1 C 13 27.2278 0.20 . 1 . . . . 150 LEU CD1 . 26535 1 856 . 1 1 150 150 LEU CD2 C 13 27.2912 0.20 . 1 . . . . 150 LEU CD2 . 26535 1 857 . 1 1 150 150 LEU N N 15 123.4790 0.20 . 1 . . . . 150 LEU N . 26535 1 858 . 1 1 151 151 THR H H 1 8.7250 0.02 . 1 . . . . 151 THR HN . 26535 1 859 . 1 1 151 151 THR N N 15 116.3460 0.20 . 1 . . . . 151 THR N . 26535 1 860 . 1 1 153 153 LYS C C 13 178.3550 0.20 . 1 . . . . 153 LYS C . 26535 1 861 . 1 1 153 153 LYS CA C 13 58.8210 0.20 . 1 . . . . 153 LYS CA . 26535 1 862 . 1 1 154 154 GLU H H 1 7.1470 0.02 . 1 . . . . 154 GLU HN . 26535 1 863 . 1 1 154 154 GLU C C 13 178.5960 0.20 . 1 . . . . 154 GLU C . 26535 1 864 . 1 1 154 154 GLU CA C 13 59.2990 0.20 . 1 . . . . 154 GLU CA . 26535 1 865 . 1 1 154 154 GLU N N 15 117.6360 0.20 . 1 . . . . 154 GLU N . 26535 1 866 . 1 1 155 155 TYR H H 1 8.9490 0.02 . 1 . . . . 155 TYR HN . 26535 1 867 . 1 1 155 155 TYR C C 13 177.7690 0.20 . 1 . . . . 155 TYR C . 26535 1 868 . 1 1 155 155 TYR CA C 13 61.8970 0.20 . 1 . . . . 155 TYR CA . 26535 1 869 . 1 1 155 155 TYR N N 15 119.0790 0.20 . 1 . . . . 155 TYR N . 26535 1 870 . 1 1 156 156 ALA H H 1 8.0320 0.02 . 1 . . . . 156 ALA HN . 26535 1 871 . 1 1 156 156 ALA C C 13 180.0930 0.20 . 1 . . . . 156 ALA C . 26535 1 872 . 1 1 156 156 ALA CA C 13 54.8860 0.20 . 1 . . . . 156 ALA CA . 26535 1 873 . 1 1 156 156 ALA N N 15 123.9460 0.20 . 1 . . . . 156 ALA N . 26535 1 874 . 1 1 157 157 LEU H H 1 7.4320 0.02 . 1 . . . . 157 LEU HN . 26535 1 875 . 1 1 157 157 LEU HD11 H 1 0.7251 0.02 . 1 . . . . 157 LEU HD11 . 26535 1 876 . 1 1 157 157 LEU HD12 H 1 0.7251 0.02 . 1 . . . . 157 LEU HD11 . 26535 1 877 . 1 1 157 157 LEU HD13 H 1 0.7251 0.02 . 1 . . . . 157 LEU HD11 . 26535 1 878 . 1 1 157 157 LEU HD21 H 1 0.5852 0.02 . 1 . . . . 157 LEU HD21 . 26535 1 879 . 1 1 157 157 LEU HD22 H 1 0.5852 0.02 . 1 . . . . 157 LEU HD21 . 26535 1 880 . 1 1 157 157 LEU HD23 H 1 0.5852 0.02 . 1 . . . . 157 LEU HD21 . 26535 1 881 . 1 1 157 157 LEU C C 13 177.7270 0.20 . 1 . . . . 157 LEU C . 26535 1 882 . 1 1 157 157 LEU CA C 13 57.0070 0.20 . 1 . . . . 157 LEU CA . 26535 1 883 . 1 1 157 157 LEU CD1 C 13 25.6349 0.20 . 1 . . . . 157 LEU CD1 . 26535 1 884 . 1 1 157 157 LEU CD2 C 13 26.3740 0.20 . 1 . . . . 157 LEU CD2 . 26535 1 885 . 1 1 157 157 LEU N N 15 117.1010 0.20 . 1 . . . . 157 LEU N . 26535 1 886 . 1 1 158 158 LEU H H 1 8.3500 0.02 . 1 . . . . 158 LEU HN . 26535 1 887 . 1 1 158 158 LEU HD11 H 1 0.7707 0.02 . 1 . . . . 158 LEU HD11 . 26535 1 888 . 1 1 158 158 LEU HD12 H 1 0.7707 0.02 . 1 . . . . 158 LEU HD11 . 26535 1 889 . 1 1 158 158 LEU HD13 H 1 0.7707 0.02 . 1 . . . . 158 LEU HD11 . 26535 1 890 . 1 1 158 158 LEU C C 13 178.4700 0.20 . 1 . . . . 158 LEU C . 26535 1 891 . 1 1 158 158 LEU CA C 13 56.9390 0.20 . 1 . . . . 158 LEU CA . 26535 1 892 . 1 1 158 158 LEU CD1 C 13 25.4887 0.20 . 1 . . . . 158 LEU CD1 . 26535 1 893 . 1 1 158 158 LEU N N 15 118.6090 0.20 . 1 . . . . 158 LEU N . 26535 1 894 . 1 1 159 159 SER H H 1 8.4130 0.02 . 1 . . . . 159 SER HN . 26535 1 895 . 1 1 159 159 SER C C 13 175.7060 0.20 . 1 . . . . 159 SER C . 26535 1 896 . 1 1 159 159 SER CA C 13 61.5910 0.20 . 1 . . . . 159 SER CA . 26535 1 897 . 1 1 159 159 SER N N 15 113.0770 0.20 . 1 . . . . 159 SER N . 26535 1 898 . 1 1 160 160 ARG H H 1 6.9920 0.02 . 1 . . . . 160 ARG HN . 26535 1 899 . 1 1 160 160 ARG C C 13 178.4810 0.20 . 1 . . . . 160 ARG C . 26535 1 900 . 1 1 160 160 ARG CA C 13 57.2470 0.20 . 1 . . . . 160 ARG CA . 26535 1 901 . 1 1 160 160 ARG N N 15 120.9700 0.20 . 1 . . . . 160 ARG N . 26535 1 902 . 1 1 161 161 LEU H H 1 7.8630 0.02 . 1 . . . . 161 LEU HN . 26535 1 903 . 1 1 161 161 LEU HD11 H 1 0.8064 0.02 . 1 . . . . 161 LEU HD11 . 26535 1 904 . 1 1 161 161 LEU HD12 H 1 0.8064 0.02 . 1 . . . . 161 LEU HD11 . 26535 1 905 . 1 1 161 161 LEU HD13 H 1 0.8064 0.02 . 1 . . . . 161 LEU HD11 . 26535 1 906 . 1 1 161 161 LEU HD21 H 1 0.7489 0.02 . 1 . . . . 161 LEU HD21 . 26535 1 907 . 1 1 161 161 LEU HD22 H 1 0.7489 0.02 . 1 . . . . 161 LEU HD21 . 26535 1 908 . 1 1 161 161 LEU HD23 H 1 0.7489 0.02 . 1 . . . . 161 LEU HD21 . 26535 1 909 . 1 1 161 161 LEU C C 13 180.0720 0.20 . 1 . . . . 161 LEU C . 26535 1 910 . 1 1 161 161 LEU CA C 13 57.3490 0.20 . 1 . . . . 161 LEU CA . 26535 1 911 . 1 1 161 161 LEU CD1 C 13 23.0136 0.20 . 1 . . . . 161 LEU CD1 . 26535 1 912 . 1 1 161 161 LEU CD2 C 13 22.9238 0.20 . 1 . . . . 161 LEU CD2 . 26535 1 913 . 1 1 161 161 LEU N N 15 116.5380 0.20 . 1 . . . . 161 LEU N . 26535 1 914 . 1 1 162 162 MET H H 1 8.7670 0.02 . 1 . . . . 162 MET HN . 26535 1 915 . 1 1 162 162 MET C C 13 178.5640 0.20 . 1 . . . . 162 MET C . 26535 1 916 . 1 1 162 162 MET CA C 13 59.3250 0.20 . 1 . . . . 162 MET CA . 26535 1 917 . 1 1 162 162 MET N N 15 116.9020 0.20 . 1 . . . . 162 MET N . 26535 1 918 . 1 1 163 163 MET H H 1 8.0380 0.02 . 1 . . . . 163 MET HN . 26535 1 919 . 1 1 163 163 MET C C 13 176.7430 0.20 . 1 . . . . 163 MET C . 26535 1 920 . 1 1 163 163 MET CA C 13 58.3410 0.20 . 1 . . . . 163 MET CA . 26535 1 921 . 1 1 163 163 MET N N 15 119.4530 0.20 . 1 . . . . 163 MET N . 26535 1 922 . 1 1 164 164 LYS H H 1 6.9960 0.02 . 1 . . . . 164 LYS HN . 26535 1 923 . 1 1 164 164 LYS C C 13 175.0990 0.20 . 1 . . . . 164 LYS C . 26535 1 924 . 1 1 164 164 LYS CA C 13 52.5590 0.20 . 1 . . . . 164 LYS CA . 26535 1 925 . 1 1 164 164 LYS N N 15 117.8710 0.20 . 1 . . . . 164 LYS N . 26535 1 926 . 1 1 165 165 ALA H H 1 6.8620 0.02 . 1 . . . . 165 ALA HN . 26535 1 927 . 1 1 165 165 ALA C C 13 178.8370 0.20 . 1 . . . . 165 ALA C . 26535 1 928 . 1 1 165 165 ALA CA C 13 54.2360 0.20 . 1 . . . . 165 ALA CA . 26535 1 929 . 1 1 165 165 ALA N N 15 122.9280 0.20 . 1 . . . . 165 ALA N . 26535 1 930 . 1 1 166 166 GLY H H 1 8.7630 0.02 . 1 . . . . 166 GLY HN . 26535 1 931 . 1 1 166 166 GLY C C 13 173.3820 0.20 . 1 . . . . 166 GLY C . 26535 1 932 . 1 1 166 166 GLY CA C 13 45.0320 0.20 . 1 . . . . 166 GLY CA . 26535 1 933 . 1 1 166 166 GLY N N 15 109.9080 0.20 . 1 . . . . 166 GLY N . 26535 1 934 . 1 1 167 167 SER H H 1 8.5770 0.02 . 1 . . . . 167 SER HN . 26535 1 935 . 1 1 167 167 SER CA C 13 55.2960 0.20 . 1 . . . . 167 SER CA . 26535 1 936 . 1 1 167 167 SER N N 15 116.9860 0.20 . 1 . . . . 167 SER N . 26535 1 937 . 1 1 168 168 PRO C C 13 175.6540 0.20 . 1 . . . . 168 PRO C . 26535 1 938 . 1 1 168 168 PRO CA C 13 62.1390 0.20 . 1 . . . . 168 PRO CA . 26535 1 939 . 1 1 169 169 VAL H H 1 9.1530 0.02 . 1 . . . . 169 VAL HN . 26535 1 940 . 1 1 169 169 VAL HG11 H 1 1.0148 0.02 . 1 . . . . 169 VAL HG11 . 26535 1 941 . 1 1 169 169 VAL HG12 H 1 1.0148 0.02 . 1 . . . . 169 VAL HG11 . 26535 1 942 . 1 1 169 169 VAL HG13 H 1 1.0148 0.02 . 1 . . . . 169 VAL HG11 . 26535 1 943 . 1 1 169 169 VAL HG21 H 1 1.0215 0.02 . 1 . . . . 169 VAL HG21 . 26535 1 944 . 1 1 169 169 VAL HG22 H 1 1.0215 0.02 . 1 . . . . 169 VAL HG21 . 26535 1 945 . 1 1 169 169 VAL HG23 H 1 1.0215 0.02 . 1 . . . . 169 VAL HG21 . 26535 1 946 . 1 1 169 169 VAL C C 13 174.8160 0.20 . 1 . . . . 169 VAL C . 26535 1 947 . 1 1 169 169 VAL CA C 13 61.4210 0.20 . 1 . . . . 169 VAL CA . 26535 1 948 . 1 1 169 169 VAL CG1 C 13 21.8386 0.20 . 1 . . . . 169 VAL CG1 . 26535 1 949 . 1 1 169 169 VAL CG2 C 13 22.5105 0.20 . 1 . . . . 169 VAL CG2 . 26535 1 950 . 1 1 169 169 VAL N N 15 124.9490 0.20 . 1 . . . . 169 VAL N . 26535 1 951 . 1 1 170 170 HIS H H 1 8.5900 0.02 . 1 . . . . 170 HIS HN . 26535 1 952 . 1 1 170 170 HIS C C 13 177.2770 0.20 . 1 . . . . 170 HIS C . 26535 1 953 . 1 1 170 170 HIS CA C 13 57.7610 0.20 . 1 . . . . 170 HIS CA . 26535 1 954 . 1 1 170 170 HIS N N 15 128.3950 0.20 . 1 . . . . 170 HIS N . 26535 1 955 . 1 1 171 171 ARG H H 1 8.3420 0.02 . 1 . . . . 171 ARG HN . 26535 1 956 . 1 1 171 171 ARG C C 13 176.7850 0.20 . 1 . . . . 171 ARG C . 26535 1 957 . 1 1 171 171 ARG CA C 13 60.3940 0.20 . 1 . . . . 171 ARG CA . 26535 1 958 . 1 1 171 171 ARG N N 15 126.4690 0.20 . 1 . . . . 171 ARG N . 26535 1 959 . 1 1 172 172 GLU H H 1 11.3050 0.02 . 1 . . . . 172 GLU HN . 26535 1 960 . 1 1 172 172 GLU C C 13 179.6110 0.20 . 1 . . . . 172 GLU C . 26535 1 961 . 1 1 172 172 GLU CA C 13 59.9150 0.20 . 1 . . . . 172 GLU CA . 26535 1 962 . 1 1 172 172 GLU N N 15 121.9390 0.20 . 1 . . . . 172 GLU N . 26535 1 963 . 1 1 173 173 ILE H H 1 7.2060 0.02 . 1 . . . . 173 ILE HN . 26535 1 964 . 1 1 173 173 ILE HD11 H 1 0.9187 0.02 . 1 . . . . 173 ILE HD11 . 26535 1 965 . 1 1 173 173 ILE HD12 H 1 0.9187 0.02 . 1 . . . . 173 ILE HD11 . 26535 1 966 . 1 1 173 173 ILE HD13 H 1 0.9187 0.02 . 1 . . . . 173 ILE HD11 . 26535 1 967 . 1 1 173 173 ILE C C 13 178.1250 0.20 . 1 . . . . 173 ILE C . 26535 1 968 . 1 1 173 173 ILE CA C 13 62.9260 0.20 . 1 . . . . 173 ILE CA . 26535 1 969 . 1 1 173 173 ILE CD1 C 13 11.8386 0.20 . 1 . . . . 173 ILE CD1 . 26535 1 970 . 1 1 173 173 ILE N N 15 119.1310 0.20 . 1 . . . . 173 ILE N . 26535 1 971 . 1 1 174 174 LEU H H 1 7.3980 0.02 . 1 . . . . 174 LEU HN . 26535 1 972 . 1 1 174 174 LEU HD11 H 1 0.9637 0.02 . 1 . . . . 174 LEU HD11 . 26535 1 973 . 1 1 174 174 LEU HD12 H 1 0.9637 0.02 . 1 . . . . 174 LEU HD11 . 26535 1 974 . 1 1 174 174 LEU HD13 H 1 0.9637 0.02 . 1 . . . . 174 LEU HD11 . 26535 1 975 . 1 1 174 174 LEU HD21 H 1 0.7668 0.02 . 1 . . . . 174 LEU HD21 . 26535 1 976 . 1 1 174 174 LEU HD22 H 1 0.7668 0.02 . 1 . . . . 174 LEU HD21 . 26535 1 977 . 1 1 174 174 LEU HD23 H 1 0.7668 0.02 . 1 . . . . 174 LEU HD21 . 26535 1 978 . 1 1 174 174 LEU C C 13 179.1610 0.20 . 1 . . . . 174 LEU C . 26535 1 979 . 1 1 174 174 LEU CA C 13 57.2120 0.20 . 1 . . . . 174 LEU CA . 26535 1 980 . 1 1 174 174 LEU CD1 C 13 27.1635 0.20 . 1 . . . . 174 LEU CD1 . 26535 1 981 . 1 1 174 174 LEU CD2 C 13 22.1751 0.20 . 1 . . . . 174 LEU CD2 . 26535 1 982 . 1 1 174 174 LEU N N 15 118.8680 0.20 . 1 . . . . 174 LEU N . 26535 1 983 . 1 1 175 175 TYR H H 1 8.9380 0.02 . 1 . . . . 175 TYR HN . 26535 1 984 . 1 1 175 175 TYR C C 13 178.6380 0.20 . 1 . . . . 175 TYR C . 26535 1 985 . 1 1 175 175 TYR CA C 13 61.6590 0.20 . 1 . . . . 175 TYR CA . 26535 1 986 . 1 1 175 175 TYR N N 15 116.6760 0.20 . 1 . . . . 175 TYR N . 26535 1 987 . 1 1 176 176 ASN H H 1 7.6080 0.02 . 1 . . . . 176 ASN HN . 26535 1 988 . 1 1 176 176 ASN C C 13 178.2090 0.20 . 1 . . . . 176 ASN C . 26535 1 989 . 1 1 176 176 ASN CA C 13 55.6380 0.20 . 1 . . . . 176 ASN CA . 26535 1 990 . 1 1 176 176 ASN N N 15 116.8060 0.20 . 1 . . . . 176 ASN N . 26535 1 991 . 1 1 177 177 ASP H H 1 7.7630 0.02 . 1 . . . . 177 ASP HN . 26535 1 992 . 1 1 177 177 ASP C C 13 177.9150 0.20 . 1 . . . . 177 ASP C . 26535 1 993 . 1 1 177 177 ASP CA C 13 56.0490 0.20 . 1 . . . . 177 ASP CA . 26535 1 994 . 1 1 177 177 ASP N N 15 117.8460 0.20 . 1 . . . . 177 ASP N . 26535 1 995 . 1 1 178 178 ILE H H 1 7.3230 0.02 . 1 . . . . 178 ILE HN . 26535 1 996 . 1 1 178 178 ILE HD11 H 1 0.6084 0.02 . 1 . . . . 178 ILE HD11 . 26535 1 997 . 1 1 178 178 ILE HD12 H 1 0.6084 0.02 . 1 . . . . 178 ILE HD11 . 26535 1 998 . 1 1 178 178 ILE HD13 H 1 0.6084 0.02 . 1 . . . . 178 ILE HD11 . 26535 1 999 . 1 1 178 178 ILE C C 13 175.9470 0.20 . 1 . . . . 178 ILE C . 26535 1 1000 . 1 1 178 178 ILE CA C 13 60.8730 0.20 . 1 . . . . 178 ILE CA . 26535 1 1001 . 1 1 178 178 ILE CD1 C 13 14.4688 0.20 . 1 . . . . 178 ILE CD1 . 26535 1 1002 . 1 1 178 178 ILE N N 15 110.4000 0.20 . 1 . . . . 178 ILE N . 26535 1 1003 . 1 1 179 179 TYR H H 1 8.0180 0.02 . 1 . . . . 179 TYR HN . 26535 1 1004 . 1 1 179 179 TYR C C 13 177.2550 0.20 . 1 . . . . 179 TYR C . 26535 1 1005 . 1 1 179 179 TYR CA C 13 58.4430 0.20 . 1 . . . . 179 TYR CA . 26535 1 1006 . 1 1 179 179 TYR N N 15 122.2320 0.20 . 1 . . . . 179 TYR N . 26535 1 1007 . 1 1 180 180 SER H H 1 8.2220 0.02 . 1 . . . . 180 SER HN . 26535 1 1008 . 1 1 180 180 SER C C 13 177.5690 0.20 . 1 . . . . 180 SER C . 26535 1 1009 . 1 1 180 180 SER CA C 13 56.8700 0.20 . 1 . . . . 180 SER CA . 26535 1 1010 . 1 1 180 180 SER N N 15 116.2720 0.20 . 1 . . . . 180 SER N . 26535 1 1011 . 1 1 182 182 ASP H H 1 8.1010 0.02 . 1 . . . . 182 ASP HN . 26535 1 1012 . 1 1 182 182 ASP C C 13 175.9050 0.20 . 1 . . . . 182 ASP C . 26535 1 1013 . 1 1 182 182 ASP CA C 13 57.3830 0.20 . 1 . . . . 182 ASP CA . 26535 1 1014 . 1 1 182 182 ASP N N 15 118.5030 0.20 . 1 . . . . 182 ASP N . 26535 1 1015 . 1 1 183 183 ASN H H 1 7.8580 0.02 . 1 . . . . 183 ASN HN . 26535 1 1016 . 1 1 183 183 ASN C C 13 174.4490 0.20 . 1 . . . . 183 ASN C . 26535 1 1017 . 1 1 183 183 ASN CA C 13 55.2620 0.20 . 1 . . . . 183 ASN CA . 26535 1 1018 . 1 1 183 183 ASN N N 15 117.8650 0.20 . 1 . . . . 183 ASN N . 26535 1 1019 . 1 1 184 184 GLU H H 1 8.1370 0.02 . 1 . . . . 184 GLU HN . 26535 1 1020 . 1 1 184 184 GLU CA C 13 59.2990 0.20 . 1 . . . . 184 GLU CA . 26535 1 1021 . 1 1 184 184 GLU N N 15 121.0470 0.20 . 1 . . . . 184 GLU N . 26535 1 1022 . 1 1 185 185 PRO CA C 13 61.6510 0.20 . 1 . . . . 185 PRO CA . 26535 1 1023 . 1 1 186 186 ALA H H 1 8.6870 0.02 . 1 . . . . 186 ALA HN . 26535 1 1024 . 1 1 186 186 ALA C C 13 178.1250 0.20 . 1 . . . . 186 ALA C . 26535 1 1025 . 1 1 186 186 ALA CA C 13 56.1360 0.20 . 1 . . . . 186 ALA CA . 26535 1 1026 . 1 1 186 186 ALA N N 15 123.6420 0.20 . 1 . . . . 186 ALA N . 26535 1 1027 . 1 1 187 187 THR H H 1 7.5580 0.02 . 1 . . . . 187 THR HN . 26535 1 1028 . 1 1 187 187 THR C C 13 174.8790 0.20 . 1 . . . . 187 THR C . 26535 1 1029 . 1 1 187 187 THR CA C 13 60.1890 0.20 . 1 . . . . 187 THR CA . 26535 1 1030 . 1 1 187 187 THR N N 15 109.4750 0.20 . 1 . . . . 187 THR N . 26535 1 1031 . 1 1 188 188 ASN H H 1 8.7700 0.02 . 1 . . . . 188 ASN HN . 26535 1 1032 . 1 1 188 188 ASN C C 13 178.5220 0.20 . 1 . . . . 188 ASN C . 26535 1 1033 . 1 1 188 188 ASN CA C 13 54.9540 0.20 . 1 . . . . 188 ASN CA . 26535 1 1034 . 1 1 188 188 ASN N N 15 122.7080 0.20 . 1 . . . . 188 ASN N . 26535 1 1035 . 1 1 189 189 THR H H 1 8.1590 0.02 . 1 . . . . 189 THR HN . 26535 1 1036 . 1 1 189 189 THR C C 13 175.3290 0.20 . 1 . . . . 189 THR C . 26535 1 1037 . 1 1 189 189 THR CA C 13 61.6590 0.20 . 1 . . . . 189 THR CA . 26535 1 1038 . 1 1 189 189 THR N N 15 113.1300 0.20 . 1 . . . . 189 THR N . 26535 1 1039 . 1 1 190 190 LEU H H 1 8.4430 0.02 . 1 . . . . 190 LEU HN . 26535 1 1040 . 1 1 190 190 LEU C C 13 176.7110 0.20 . 1 . . . . 190 LEU C . 26535 1 1041 . 1 1 190 190 LEU CA C 13 55.9810 0.20 . 1 . . . . 190 LEU CA . 26535 1 1042 . 1 1 190 190 LEU N N 15 123.2610 0.20 . 1 . . . . 190 LEU N . 26535 1 1043 . 1 1 191 191 GLU H H 1 9.4310 0.02 . 1 . . . . 191 GLU HN . 26535 1 1044 . 1 1 191 191 GLU C C 13 178.2290 0.20 . 1 . . . . 191 GLU C . 26535 1 1045 . 1 1 191 191 GLU CA C 13 61.3860 0.20 . 1 . . . . 191 GLU CA . 26535 1 1046 . 1 1 191 191 GLU N N 15 118.5890 0.20 . 1 . . . . 191 GLU N . 26535 1 1047 . 1 1 192 192 VAL H H 1 7.6660 0.02 . 1 . . . . 192 VAL HN . 26535 1 1048 . 1 1 192 192 VAL C C 13 180.6790 0.20 . 1 . . . . 192 VAL C . 26535 1 1049 . 1 1 192 192 VAL N N 15 122.4610 0.20 . 1 . . . . 192 VAL N . 26535 1 1050 . 1 1 193 193 HIS H H 1 8.2310 0.02 . 1 . . . . 193 HIS HN . 26535 1 1051 . 1 1 193 193 HIS C C 13 179.0360 0.20 . 1 . . . . 193 HIS C . 26535 1 1052 . 1 1 193 193 HIS CA C 13 58.3410 0.20 . 1 . . . . 193 HIS CA . 26535 1 1053 . 1 1 193 193 HIS N N 15 117.8330 0.20 . 1 . . . . 193 HIS N . 26535 1 1054 . 1 1 194 194 ILE H H 1 8.8750 0.02 . 1 . . . . 194 ILE HN . 26535 1 1055 . 1 1 194 194 ILE HD11 H 1 -0.0123 0.02 . 1 . . . . 194 ILE HD11 . 26535 1 1056 . 1 1 194 194 ILE HD12 H 1 -0.0123 0.02 . 1 . . . . 194 ILE HD11 . 26535 1 1057 . 1 1 194 194 ILE HD13 H 1 -0.0123 0.02 . 1 . . . . 194 ILE HD11 . 26535 1 1058 . 1 1 194 194 ILE C C 13 177.5810 0.20 . 1 . . . . 194 ILE C . 26535 1 1059 . 1 1 194 194 ILE CA C 13 62.1730 0.20 . 1 . . . . 194 ILE CA . 26535 1 1060 . 1 1 194 194 ILE CD1 C 13 8.2255 0.20 . 1 . . . . 194 ILE CD1 . 26535 1 1061 . 1 1 194 194 ILE N N 15 120.1660 0.20 . 1 . . . . 194 ILE N . 26535 1 1062 . 1 1 195 195 HIS H H 1 7.9380 0.02 . 1 . . . . 195 HIS HN . 26535 1 1063 . 1 1 195 195 HIS C C 13 176.3140 0.20 . 1 . . . . 195 HIS C . 26535 1 1064 . 1 1 195 195 HIS CA C 13 59.9490 0.20 . 1 . . . . 195 HIS CA . 26535 1 1065 . 1 1 195 195 HIS N N 15 120.9800 0.20 . 1 . . . . 195 HIS N . 26535 1 1066 . 1 1 196 196 ASN H H 1 8.3760 0.02 . 1 . . . . 196 ASN HN . 26535 1 1067 . 1 1 196 196 ASN CA C 13 54.1670 0.20 . 1 . . . . 196 ASN CA . 26535 1 1068 . 1 1 196 196 ASN N N 15 121.0850 0.20 . 1 . . . . 196 ASN N . 26535 1 1069 . 1 1 197 197 LEU HD11 H 1 0.5047 0.02 . 1 . . . . 197 LEU HD11 . 26535 1 1070 . 1 1 197 197 LEU HD12 H 1 0.5047 0.02 . 1 . . . . 197 LEU HD11 . 26535 1 1071 . 1 1 197 197 LEU HD13 H 1 0.5047 0.02 . 1 . . . . 197 LEU HD11 . 26535 1 1072 . 1 1 197 197 LEU HD21 H 1 0.7644 0.02 . 1 . . . . 197 LEU HD21 . 26535 1 1073 . 1 1 197 197 LEU HD22 H 1 0.7644 0.02 . 1 . . . . 197 LEU HD21 . 26535 1 1074 . 1 1 197 197 LEU HD23 H 1 0.7644 0.02 . 1 . . . . 197 LEU HD21 . 26535 1 1075 . 1 1 197 197 LEU C C 13 179.0880 0.20 . 1 . . . . 197 LEU C . 26535 1 1076 . 1 1 197 197 LEU CA C 13 56.8710 0.20 . 1 . . . . 197 LEU CA . 26535 1 1077 . 1 1 197 197 LEU CD1 C 13 25.4878 0.20 . 1 . . . . 197 LEU CD1 . 26535 1 1078 . 1 1 197 197 LEU CD2 C 13 25.0566 0.20 . 1 . . . . 197 LEU CD2 . 26535 1 1079 . 1 1 198 198 ARG H H 1 8.7940 0.02 . 1 . . . . 198 ARG HN . 26535 1 1080 . 1 1 198 198 ARG C C 13 179.0040 0.20 . 1 . . . . 198 ARG C . 26535 1 1081 . 1 1 198 198 ARG CA C 13 58.3010 0.20 . 1 . . . . 198 ARG CA . 26535 1 1082 . 1 1 198 198 ARG N N 15 120.0710 0.20 . 1 . . . . 198 ARG N . 26535 1 1083 . 1 1 199 199 GLU H H 1 7.4940 0.02 . 1 . . . . 199 GLU HN . 26535 1 1084 . 1 1 199 199 GLU C C 13 178.1980 0.20 . 1 . . . . 199 GLU C . 26535 1 1085 . 1 1 199 199 GLU CA C 13 58.5810 0.20 . 1 . . . . 199 GLU CA . 26535 1 1086 . 1 1 199 199 GLU N N 15 117.3680 0.20 . 1 . . . . 199 GLU N . 26535 1 1087 . 1 1 200 200 LYS H H 1 7.2260 0.02 . 1 . . . . 200 LYS HN . 26535 1 1088 . 1 1 200 200 LYS C C 13 178.3970 0.20 . 1 . . . . 200 LYS C . 26535 1 1089 . 1 1 200 200 LYS CA C 13 58.7520 0.20 . 1 . . . . 200 LYS CA . 26535 1 1090 . 1 1 200 200 LYS N N 15 116.9000 0.20 . 1 . . . . 200 LYS N . 26535 1 1091 . 1 1 201 201 ILE H H 1 7.9500 0.02 . 1 . . . . 201 ILE HN . 26535 1 1092 . 1 1 201 201 ILE C C 13 174.7740 0.20 . 1 . . . . 201 ILE C . 26535 1 1093 . 1 1 201 201 ILE CA C 13 60.9760 0.20 . 1 . . . . 201 ILE CA . 26535 1 1094 . 1 1 201 201 ILE N N 15 108.6420 0.20 . 1 . . . . 201 ILE N . 26535 1 1095 . 1 1 202 202 GLY H H 1 7.8330 0.02 . 1 . . . . 202 GLY HN . 26535 1 1096 . 1 1 202 202 GLY C C 13 175.2350 0.20 . 1 . . . . 202 GLY C . 26535 1 1097 . 1 1 202 202 GLY CA C 13 44.2780 0.20 . 1 . . . . 202 GLY CA . 26535 1 1098 . 1 1 202 202 GLY N N 15 113.9470 0.20 . 1 . . . . 202 GLY N . 26535 1 1099 . 1 1 203 203 LYS H H 1 8.3090 0.02 . 1 . . . . 203 LYS HN . 26535 1 1100 . 1 1 203 203 LYS C C 13 178.1670 0.20 . 1 . . . . 203 LYS C . 26535 1 1101 . 1 1 203 203 LYS CA C 13 59.7440 0.20 . 1 . . . . 203 LYS CA . 26535 1 1102 . 1 1 203 203 LYS N N 15 126.2120 0.20 . 1 . . . . 203 LYS N . 26535 1 1103 . 1 1 204 204 SER H H 1 8.1840 0.02 . 1 . . . . 204 SER HN . 26535 1 1104 . 1 1 204 204 SER C C 13 175.0990 0.20 . 1 . . . . 204 SER C . 26535 1 1105 . 1 1 204 204 SER CA C 13 58.8540 0.20 . 1 . . . . 204 SER CA . 26535 1 1106 . 1 1 204 204 SER N N 15 109.5740 0.20 . 1 . . . . 204 SER N . 26535 1 1107 . 1 1 205 205 ARG H H 1 7.5420 0.02 . 1 . . . . 205 ARG HN . 26535 1 1108 . 1 1 205 205 ARG C C 13 176.2400 0.20 . 1 . . . . 205 ARG C . 26535 1 1109 . 1 1 205 205 ARG CA C 13 57.0070 0.20 . 1 . . . . 205 ARG CA . 26535 1 1110 . 1 1 205 205 ARG N N 15 119.7610 0.20 . 1 . . . . 205 ARG N . 26535 1 1111 . 1 1 206 206 ILE H H 1 6.8180 0.02 . 1 . . . . 206 ILE HN . 26535 1 1112 . 1 1 206 206 ILE HD11 H 1 0.6053 0.02 . 1 . . . . 206 ILE HD11 . 26535 1 1113 . 1 1 206 206 ILE HD12 H 1 0.6053 0.02 . 1 . . . . 206 ILE HD11 . 26535 1 1114 . 1 1 206 206 ILE HD13 H 1 0.6053 0.02 . 1 . . . . 206 ILE HD11 . 26535 1 1115 . 1 1 206 206 ILE C C 13 175.5280 0.20 . 1 . . . . 206 ILE C . 26535 1 1116 . 1 1 206 206 ILE CA C 13 58.9910 0.20 . 1 . . . . 206 ILE CA . 26535 1 1117 . 1 1 206 206 ILE CD1 C 13 13.6162 0.20 . 1 . . . . 206 ILE CD1 . 26535 1 1118 . 1 1 206 206 ILE N N 15 113.7830 0.20 . 1 . . . . 206 ILE N . 26535 1 1119 . 1 1 207 207 ARG H H 1 9.9060 0.02 . 1 . . . . 207 ARG HN . 26535 1 1120 . 1 1 207 207 ARG C C 13 175.6640 0.20 . 1 . . . . 207 ARG C . 26535 1 1121 . 1 1 207 207 ARG CA C 13 52.9690 0.20 . 1 . . . . 207 ARG CA . 26535 1 1122 . 1 1 207 207 ARG N N 15 129.5940 0.20 . 1 . . . . 207 ARG N . 26535 1 1123 . 1 1 208 208 THR H H 1 9.2400 0.02 . 1 . . . . 208 THR HN . 26535 1 1124 . 1 1 208 208 THR C C 13 173.4240 0.20 . 1 . . . . 208 THR C . 26535 1 1125 . 1 1 208 208 THR CA C 13 63.4050 0.20 . 1 . . . . 208 THR CA . 26535 1 1126 . 1 1 208 208 THR N N 15 123.7060 0.20 . 1 . . . . 208 THR N . 26535 1 1127 . 1 1 209 209 VAL H H 1 8.3340 0.02 . 1 . . . . 209 VAL HN . 26535 1 1128 . 1 1 209 209 VAL HG11 H 1 0.7064 0.02 . 1 . . . . 209 VAL HG11 . 26535 1 1129 . 1 1 209 209 VAL HG12 H 1 0.7064 0.02 . 1 . . . . 209 VAL HG11 . 26535 1 1130 . 1 1 209 209 VAL HG13 H 1 0.7064 0.02 . 1 . . . . 209 VAL HG11 . 26535 1 1131 . 1 1 209 209 VAL HG21 H 1 0.6455 0.02 . 1 . . . . 209 VAL HG21 . 26535 1 1132 . 1 1 209 209 VAL HG22 H 1 0.6455 0.02 . 1 . . . . 209 VAL HG21 . 26535 1 1133 . 1 1 209 209 VAL HG23 H 1 0.6455 0.02 . 1 . . . . 209 VAL HG21 . 26535 1 1134 . 1 1 209 209 VAL CA C 13 60.5310 0.20 . 1 . . . . 209 VAL CA . 26535 1 1135 . 1 1 209 209 VAL CG1 C 13 20.8839 0.20 . 1 . . . . 209 VAL CG1 . 26535 1 1136 . 1 1 209 209 VAL CG2 C 13 19.3949 0.20 . 1 . . . . 209 VAL CG2 . 26535 1 1137 . 1 1 209 209 VAL N N 15 130.2000 0.20 . 1 . . . . 209 VAL N . 26535 1 1138 . 1 1 210 210 ARG H H 1 9.2060 0.02 . 1 . . . . 210 ARG HN . 26535 1 1139 . 1 1 210 210 ARG C C 13 177.2030 0.20 . 1 . . . . 210 ARG C . 26535 1 1140 . 1 1 210 210 ARG N N 15 129.1900 0.20 . 1 . . . . 210 ARG N . 26535 1 1141 . 1 1 211 211 GLY H H 1 10.5170 0.02 . 1 . . . . 211 GLY HN . 26535 1 1142 . 1 1 211 211 GLY C C 13 173.4760 0.20 . 1 . . . . 211 GLY C . 26535 1 1143 . 1 1 211 211 GLY CA C 13 44.7240 0.20 . 1 . . . . 211 GLY CA . 26535 1 1144 . 1 1 211 211 GLY N N 15 118.1960 0.20 . 1 . . . . 211 GLY N . 26535 1 1145 . 1 1 212 212 PHE H H 1 8.2730 0.02 . 1 . . . . 212 PHE HN . 26535 1 1146 . 1 1 212 212 PHE C C 13 174.3350 0.20 . 1 . . . . 212 PHE C . 26535 1 1147 . 1 1 212 212 PHE CA C 13 60.0180 0.20 . 1 . . . . 212 PHE CA . 26535 1 1148 . 1 1 212 212 PHE N N 15 120.5290 0.20 . 1 . . . . 212 PHE N . 26535 1 1149 . 1 1 213 213 GLY H H 1 8.6030 0.02 . 1 . . . . 213 GLY HN . 26535 1 1150 . 1 1 213 213 GLY C C 13 171.6540 0.20 . 1 . . . . 213 GLY C . 26535 1 1151 . 1 1 213 213 GLY CA C 13 46.3670 0.20 . 1 . . . . 213 GLY CA . 26535 1 1152 . 1 1 213 213 GLY N N 15 106.1130 0.20 . 1 . . . . 213 GLY N . 26535 1 1153 . 1 1 214 214 TYR H H 1 8.1910 0.02 . 1 . . . . 214 TYR HN . 26535 1 1154 . 1 1 214 214 TYR C C 13 172.8690 0.20 . 1 . . . . 214 TYR C . 26535 1 1155 . 1 1 214 214 TYR CA C 13 57.0410 0.20 . 1 . . . . 214 TYR CA . 26535 1 1156 . 1 1 214 214 TYR N N 15 122.4070 0.20 . 1 . . . . 214 TYR N . 26535 1 1157 . 1 1 215 215 MET H H 1 9.0360 0.02 . 1 . . . . 215 MET HN . 26535 1 1158 . 1 1 215 215 MET C C 13 173.4660 0.20 . 1 . . . . 215 MET C . 26535 1 1159 . 1 1 215 215 MET CA C 13 53.7910 0.20 . 1 . . . . 215 MET CA . 26535 1 1160 . 1 1 215 215 MET N N 15 119.2850 0.20 . 1 . . . . 215 MET N . 26535 1 1161 . 1 1 216 216 LEU H H 1 9.7470 0.02 . 1 . . . . 216 LEU HN . 26535 1 1162 . 1 1 216 216 LEU HD11 H 1 0.7909 0.02 . 1 . . . . 216 LEU HD11 . 26535 1 1163 . 1 1 216 216 LEU HD12 H 1 0.7909 0.02 . 1 . . . . 216 LEU HD11 . 26535 1 1164 . 1 1 216 216 LEU HD13 H 1 0.7909 0.02 . 1 . . . . 216 LEU HD11 . 26535 1 1165 . 1 1 216 216 LEU HD21 H 1 0.7377 0.02 . 1 . . . . 216 LEU HD21 . 26535 1 1166 . 1 1 216 216 LEU HD22 H 1 0.7377 0.02 . 1 . . . . 216 LEU HD21 . 26535 1 1167 . 1 1 216 216 LEU HD23 H 1 0.7377 0.02 . 1 . . . . 216 LEU HD21 . 26535 1 1168 . 1 1 216 216 LEU C C 13 174.9420 0.20 . 1 . . . . 216 LEU C . 26535 1 1169 . 1 1 216 216 LEU CA C 13 53.5860 0.20 . 1 . . . . 216 LEU CA . 26535 1 1170 . 1 1 216 216 LEU CD1 C 13 27.4873 0.20 . 1 . . . . 216 LEU CD1 . 26535 1 1171 . 1 1 216 216 LEU CD2 C 13 25.1270 0.20 . 1 . . . . 216 LEU CD2 . 26535 1 1172 . 1 1 216 216 LEU N N 15 130.5610 0.20 . 1 . . . . 216 LEU N . 26535 1 1173 . 1 1 217 217 ALA H H 1 8.4700 0.02 . 1 . . . . 217 ALA HN . 26535 1 1174 . 1 1 217 217 ALA C C 13 176.6490 0.20 . 1 . . . . 217 ALA C . 26535 1 1175 . 1 1 217 217 ALA CA C 13 51.5320 0.20 . 1 . . . . 217 ALA CA . 26535 1 1176 . 1 1 217 217 ALA N N 15 131.1330 0.20 . 1 . . . . 217 ALA N . 26535 1 1177 . 1 1 218 218 ASN H H 1 8.5080 0.02 . 1 . . . . 218 ASN HN . 26535 1 1178 . 1 1 218 218 ASN C C 13 175.8420 0.20 . 1 . . . . 218 ASN C . 26535 1 1179 . 1 1 218 218 ASN CA C 13 52.2510 0.20 . 1 . . . . 218 ASN CA . 26535 1 1180 . 1 1 218 218 ASN N N 15 118.6550 0.20 . 1 . . . . 218 ASN N . 26535 1 1181 . 1 1 219 219 ASN H H 1 8.1330 0.02 . 1 . . . . 219 ASN HN . 26535 1 1182 . 1 1 219 219 ASN C C 13 174.6490 0.20 . 1 . . . . 219 ASN C . 26535 1 1183 . 1 1 219 219 ASN CA C 13 52.8330 0.20 . 1 . . . . 219 ASN CA . 26535 1 1184 . 1 1 219 219 ASN N N 15 118.2500 0.20 . 1 . . . . 219 ASN N . 26535 1 1185 . 1 1 220 220 ASP H H 1 8.2430 0.02 . 1 . . . . 220 ASP HN . 26535 1 1186 . 1 1 220 220 ASP C C 13 176.3290 0.20 . 1 . . . . 220 ASP C . 26535 1 1187 . 1 1 220 220 ASP CA C 13 53.6190 0.20 . 1 . . . . 220 ASP CA . 26535 1 1188 . 1 1 220 220 ASP N N 15 121.2860 0.20 . 1 . . . . 220 ASP N . 26535 1 1189 . 1 1 221 221 ASP H H 1 7.8570 0.02 . 1 . . . . 221 ASP HN . 26535 1 1190 . 1 1 221 221 ASP C C 13 176.7010 0.20 . 1 . . . . 221 ASP C . 26535 1 1191 . 1 1 221 221 ASP CA C 13 54.2010 0.20 . 1 . . . . 221 ASP CA . 26535 1 1192 . 1 1 221 221 ASP N N 15 123.6710 0.20 . 1 . . . . 221 ASP N . 26535 1 1193 . 1 1 222 222 THR H H 1 8.0380 0.02 . 1 . . . . 222 THR HN . 26535 1 1194 . 1 1 222 222 THR C C 13 174.0520 0.20 . 1 . . . . 222 THR C . 26535 1 1195 . 1 1 222 222 THR CA C 13 62.4130 0.20 . 1 . . . . 222 THR CA . 26535 1 1196 . 1 1 222 222 THR N N 15 113.8470 0.20 . 1 . . . . 222 THR N . 26535 1 1197 . 1 1 223 223 GLU H H 1 7.7440 0.02 . 1 . . . . 223 GLU HN . 26535 1 1198 . 1 1 223 223 GLU CA C 13 56.9730 0.20 . 1 . . . . 223 GLU CA . 26535 1 1199 . 1 1 223 223 GLU N N 15 126.1960 0.20 . 1 . . . . 223 GLU N . 26535 1 stop_ save_