data_26347 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 26347 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for FOXO3a (141-284) phosphorylated on S253 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-07-12 _Entry.Accession_date 2024-07-25 _Entry.Last_release_date 2024-07-25 _Entry.Original_release_date 2024-07-25 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Shota Enomoto . . . . 26347 2 Shoichi Nakatsuka . . . . 26347 3 Mariko Yokogawa . . . . 26347 4 Masanori Osawa . . . . 26347 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26347 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 325 26347 '15N chemical shifts' 132 26347 '1H chemical shifts' 132 26347 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2025-09-15 . original BMRB . 26347 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26344 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for FOXO3a (1-146) phosphorylated on T32' 26347 BMRB 26345 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for FOXO3a (1-146)' 26347 BMRB 26346 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for FOXO3a (141-284)' 26347 BMRB 26348 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for full length 14-3-3z' 26347 BMRB 26350 'Backbone 1H and 15N Chemical Shift Assignments for FOXO3a (1-284) phosphorylated on T32 and S253' 26347 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 26347 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 39259470 _Citation.DOI 10.1007/s12104-024-10200-7 _Citation.Full_citation . _Citation.Title ; NMR (1)H, (13)C, (15)N backbone resonance assignments of 14-3-3z binding region of human FOXO3a (residues 1-284). ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 18 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-2718 _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 275 _Citation.Page_last 283 _Citation.Year 2024 _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 Shota Enomoto S. . . . 26347 1 2 Shoichi Nakatsuka S. . . . 26347 1 3 Tomoya Kuwayama T. . . . 26347 1 4 Kosaku Kawatsu K. . . . 26347 1 5 Mariko Yokogawa M. . . . 26347 1 6 Masanori Osawa M. . . . 26347 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 26347 _Assembly.ID 1 _Assembly.Name 'FOXO3a (141-284) phosphorylated on S253' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'FOXO3a (141-284) phosphorylated on S253' 1 $entity_1 . . yes native no no . . . 26347 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 26347 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'FOXO3a (141-284) phosphorylated on S253' _Entity.Type polymer _Entity.Polymer_common_type protein _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 ; GPLGSAGGSGQPRKCSSRRN AWGNLSYADLITRAIESSPD KRLTLSQIYEWMVRCVPYFK DKGDSNSSAGWKNSIRHNLS LHSRFMRVQNEGTGKSSWWI INPDGGKSGKAPRRRAVXMD NSNKYTKSRGRAAKKKAALQ TAPESADDS ; _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 yes _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 149 _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 16484 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'X = phosphorylated serine (SEP)' _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 -5 GLY . 26347 1 2 -4 PRO . 26347 1 3 -3 LEU . 26347 1 4 -2 GLY . 26347 1 5 -1 SER . 26347 1 6 141 ALA . 26347 1 7 142 GLY . 26347 1 8 143 GLY . 26347 1 9 144 SER . 26347 1 10 145 GLY . 26347 1 11 146 GLN . 26347 1 12 147 PRO . 26347 1 13 148 ARG . 26347 1 14 149 LYS . 26347 1 15 150 CYS . 26347 1 16 151 SER . 26347 1 17 152 SER . 26347 1 18 153 ARG . 26347 1 19 154 ARG . 26347 1 20 155 ASN . 26347 1 21 156 ALA . 26347 1 22 157 TRP . 26347 1 23 158 GLY . 26347 1 24 159 ASN . 26347 1 25 160 LEU . 26347 1 26 161 SER . 26347 1 27 162 TYR . 26347 1 28 163 ALA . 26347 1 29 164 ASP . 26347 1 30 165 LEU . 26347 1 31 166 ILE . 26347 1 32 167 THR . 26347 1 33 168 ARG . 26347 1 34 169 ALA . 26347 1 35 170 ILE . 26347 1 36 171 GLU . 26347 1 37 172 SER . 26347 1 38 173 SER . 26347 1 39 174 PRO . 26347 1 40 175 ASP . 26347 1 41 176 LYS . 26347 1 42 177 ARG . 26347 1 43 178 LEU . 26347 1 44 179 THR . 26347 1 45 180 LEU . 26347 1 46 181 SER . 26347 1 47 182 GLN . 26347 1 48 183 ILE . 26347 1 49 184 TYR . 26347 1 50 185 GLU . 26347 1 51 186 TRP . 26347 1 52 187 MET . 26347 1 53 188 VAL . 26347 1 54 189 ARG . 26347 1 55 190 CYS . 26347 1 56 191 VAL . 26347 1 57 192 PRO . 26347 1 58 193 TYR . 26347 1 59 194 PHE . 26347 1 60 195 LYS . 26347 1 61 196 ASP . 26347 1 62 197 LYS . 26347 1 63 198 GLY . 26347 1 64 199 ASP . 26347 1 65 200 SER . 26347 1 66 201 ASN . 26347 1 67 202 SER . 26347 1 68 203 SER . 26347 1 69 204 ALA . 26347 1 70 205 GLY . 26347 1 71 206 TRP . 26347 1 72 207 LYS . 26347 1 73 208 ASN . 26347 1 74 209 SER . 26347 1 75 210 ILE . 26347 1 76 211 ARG . 26347 1 77 212 HIS . 26347 1 78 213 ASN . 26347 1 79 214 LEU . 26347 1 80 215 SER . 26347 1 81 216 LEU . 26347 1 82 217 HIS . 26347 1 83 218 SER . 26347 1 84 219 ARG . 26347 1 85 220 PHE . 26347 1 86 221 MET . 26347 1 87 222 ARG . 26347 1 88 223 VAL . 26347 1 89 224 GLN . 26347 1 90 225 ASN . 26347 1 91 226 GLU . 26347 1 92 227 GLY . 26347 1 93 228 THR . 26347 1 94 229 GLY . 26347 1 95 230 LYS . 26347 1 96 231 SER . 26347 1 97 232 SER . 26347 1 98 233 TRP . 26347 1 99 234 TRP . 26347 1 100 235 ILE . 26347 1 101 236 ILE . 26347 1 102 237 ASN . 26347 1 103 238 PRO . 26347 1 104 239 ASP . 26347 1 105 240 GLY . 26347 1 106 241 GLY . 26347 1 107 242 LYS . 26347 1 108 243 SER . 26347 1 109 244 GLY . 26347 1 110 245 LYS . 26347 1 111 246 ALA . 26347 1 112 247 PRO . 26347 1 113 248 ARG . 26347 1 114 249 ARG . 26347 1 115 250 ARG . 26347 1 116 251 ALA . 26347 1 117 252 VAL . 26347 1 118 253 SEP . 26347 1 119 254 MET . 26347 1 120 255 ASP . 26347 1 121 256 ASN . 26347 1 122 257 SER . 26347 1 123 258 ASN . 26347 1 124 259 LYS . 26347 1 125 260 TYR . 26347 1 126 261 THR . 26347 1 127 262 LYS . 26347 1 128 263 SER . 26347 1 129 264 ARG . 26347 1 130 265 GLY . 26347 1 131 266 ARG . 26347 1 132 267 ALA . 26347 1 133 268 ALA . 26347 1 134 269 LYS . 26347 1 135 270 LYS . 26347 1 136 271 LYS . 26347 1 137 272 ALA . 26347 1 138 273 ALA . 26347 1 139 274 LEU . 26347 1 140 275 GLN . 26347 1 141 276 THR . 26347 1 142 277 ALA . 26347 1 143 278 PRO . 26347 1 144 279 GLU . 26347 1 145 280 SER . 26347 1 146 281 ALA . 26347 1 147 282 ASP . 26347 1 148 283 ASP . 26347 1 149 284 SER . 26347 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 26347 1 . PRO 2 2 26347 1 . LEU 3 3 26347 1 . GLY 4 4 26347 1 . SER 5 5 26347 1 . ALA 6 6 26347 1 . GLY 7 7 26347 1 . GLY 8 8 26347 1 . SER 9 9 26347 1 . GLY 10 10 26347 1 . GLN 11 11 26347 1 . PRO 12 12 26347 1 . ARG 13 13 26347 1 . LYS 14 14 26347 1 . CYS 15 15 26347 1 . SER 16 16 26347 1 . SER 17 17 26347 1 . ARG 18 18 26347 1 . ARG 19 19 26347 1 . ASN 20 20 26347 1 . ALA 21 21 26347 1 . TRP 22 22 26347 1 . GLY 23 23 26347 1 . ASN 24 24 26347 1 . LEU 25 25 26347 1 . SER 26 26 26347 1 . TYR 27 27 26347 1 . ALA 28 28 26347 1 . ASP 29 29 26347 1 . LEU 30 30 26347 1 . ILE 31 31 26347 1 . THR 32 32 26347 1 . ARG 33 33 26347 1 . ALA 34 34 26347 1 . ILE 35 35 26347 1 . GLU 36 36 26347 1 . SER 37 37 26347 1 . SER 38 38 26347 1 . PRO 39 39 26347 1 . ASP 40 40 26347 1 . LYS 41 41 26347 1 . ARG 42 42 26347 1 . LEU 43 43 26347 1 . THR 44 44 26347 1 . LEU 45 45 26347 1 . SER 46 46 26347 1 . GLN 47 47 26347 1 . ILE 48 48 26347 1 . TYR 49 49 26347 1 . GLU 50 50 26347 1 . TRP 51 51 26347 1 . MET 52 52 26347 1 . VAL 53 53 26347 1 . ARG 54 54 26347 1 . CYS 55 55 26347 1 . VAL 56 56 26347 1 . PRO 57 57 26347 1 . TYR 58 58 26347 1 . PHE 59 59 26347 1 . LYS 60 60 26347 1 . ASP 61 61 26347 1 . LYS 62 62 26347 1 . GLY 63 63 26347 1 . ASP 64 64 26347 1 . SER 65 65 26347 1 . ASN 66 66 26347 1 . SER 67 67 26347 1 . SER 68 68 26347 1 . ALA 69 69 26347 1 . GLY 70 70 26347 1 . TRP 71 71 26347 1 . LYS 72 72 26347 1 . ASN 73 73 26347 1 . SER 74 74 26347 1 . ILE 75 75 26347 1 . ARG 76 76 26347 1 . HIS 77 77 26347 1 . ASN 78 78 26347 1 . LEU 79 79 26347 1 . SER 80 80 26347 1 . LEU 81 81 26347 1 . HIS 82 82 26347 1 . SER 83 83 26347 1 . ARG 84 84 26347 1 . PHE 85 85 26347 1 . MET 86 86 26347 1 . ARG 87 87 26347 1 . VAL 88 88 26347 1 . GLN 89 89 26347 1 . ASN 90 90 26347 1 . GLU 91 91 26347 1 . GLY 92 92 26347 1 . THR 93 93 26347 1 . GLY 94 94 26347 1 . LYS 95 95 26347 1 . SER 96 96 26347 1 . SER 97 97 26347 1 . TRP 98 98 26347 1 . TRP 99 99 26347 1 . ILE 100 100 26347 1 . ILE 101 101 26347 1 . ASN 102 102 26347 1 . PRO 103 103 26347 1 . ASP 104 104 26347 1 . GLY 105 105 26347 1 . GLY 106 106 26347 1 . LYS 107 107 26347 1 . SER 108 108 26347 1 . GLY 109 109 26347 1 . LYS 110 110 26347 1 . ALA 111 111 26347 1 . PRO 112 112 26347 1 . ARG 113 113 26347 1 . ARG 114 114 26347 1 . ARG 115 115 26347 1 . ALA 116 116 26347 1 . VAL 117 117 26347 1 . SEP 118 118 26347 1 . MET 119 119 26347 1 . ASP 120 120 26347 1 . ASN 121 121 26347 1 . SER 122 122 26347 1 . ASN 123 123 26347 1 . LYS 124 124 26347 1 . TYR 125 125 26347 1 . THR 126 126 26347 1 . LYS 127 127 26347 1 . SER 128 128 26347 1 . ARG 129 129 26347 1 . GLY 130 130 26347 1 . ARG 131 131 26347 1 . ALA 132 132 26347 1 . ALA 133 133 26347 1 . LYS 134 134 26347 1 . LYS 135 135 26347 1 . LYS 136 136 26347 1 . ALA 137 137 26347 1 . ALA 138 138 26347 1 . LEU 139 139 26347 1 . GLN 140 140 26347 1 . THR 141 141 26347 1 . ALA 142 142 26347 1 . PRO 143 143 26347 1 . GLU 144 144 26347 1 . SER 145 145 26347 1 . ALA 146 146 26347 1 . ASP 147 147 26347 1 . ASP 148 148 26347 1 . SER 149 149 26347 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 26347 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 26347 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 26347 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' 'E. coli' . 562 Escherichia coli . . . plasmid . . pGEX6P-1 . . . 26347 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_SEP _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_SEP _Chem_comp.Entry_ID 26347 _Chem_comp.ID SEP _Chem_comp.Provenance PDB _Chem_comp.Name PHOSPHOSERINE _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code SEP _Chem_comp.PDB_code SEP _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2020-07-10 _Chem_comp.Modified_date 2020-07-10 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code S _Chem_comp.Three_letter_code SEP _Chem_comp.Number_atoms_all 19 _Chem_comp.Number_atoms_nh 11 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1 _Chem_comp.Mon_nstd_flag no _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID SER _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 PHOSPHONOSERINE _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C3 H8 N O6 P' _Chem_comp.Formula_weight 185.072 _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 no _Chem_comp.Model_coordinates_db_code 1BX6 _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 BZQFBWGGLXLEPQ-REOHCLBHSA-N InChIKey InChI 1.03 26347 SEP C(C(C(=O)O)N)OP(=O)(O)O SMILES 'OpenEye OEToolkits' 1.5.0 26347 SEP C([C@@H](C(=O)O)N)OP(=O)(O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 26347 SEP InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1 InChI InChI 1.03 26347 SEP N[C@@H](CO[P](O)(O)=O)C(O)=O SMILES_CANONICAL CACTVS 3.341 26347 SEP N[CH](CO[P](O)(O)=O)C(O)=O SMILES CACTVS 3.341 26347 SEP O=P(O)(O)OCC(C(=O)O)N SMILES ACDLabs 10.04 26347 SEP 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 '(2S)-2-amino-3-phosphonooxy-propanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 26347 SEP O-phosphono-L-serine 'SYSTEMATIC NAME' ACDLabs 10.04 26347 SEP 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 N N N N . N . . N 0 . . . 1 N N . . . . 12.751 . 44.134 . -4.949 . 1.855 0.421 1.751 1 . 26347 SEP CA CA CA CA . C . . S 0 . . . 1 N N . . . . 12.373 . 44.600 . -6.265 . 0.401 0.620 1.687 2 . 26347 SEP CB CB CB CB . C . . N 0 . . . 1 N N . . . . 11.077 . 45.353 . -6.305 . -0.139 0.015 0.391 3 . 26347 SEP OG OG OG OG . O . . N 0 . . . 1 N N . . . . 10.895 . 45.809 . -7.608 . 0.477 0.655 -0.727 4 . 26347 SEP C C C C . C . . N 0 . . . 1 N N . . . . 13.435 . 45.364 . -6.941 . -0.249 -0.053 2.867 5 . 26347 SEP O O O O . O . . N 0 . . . 1 N N . . . . 14.373 . 45.871 . -6.303 . 0.254 -1.038 3.354 6 . 26347 SEP OXT OXT OXT OXT . O . . N 0 . . . 1 N Y . . . . 13.281 . 45.410 . -8.244 . -1.389 0.439 3.377 7 . 26347 SEP P P P P . P . . N 0 . . . 1 N N . . . . 9.607 . 45.328 . -8.384 . -0.135 -0.027 -2.050 8 . 26347 SEP O1P O1P O1P O1P . O . . N 0 . . . 1 N N . . . . 9.500 . 46.086 . -9.633 . -1.601 0.172 -2.074 9 . 26347 SEP O2P O2P O2P O2P . O . . N 0 . . . 1 N N . . . . 9.829 . 43.907 . -8.669 . 0.520 0.649 -3.356 10 . 26347 SEP O3P O3P O3P O3P . O . . N 0 . . . 1 N N . . . . 8.402 . 45.541 . -7.535 . 0.191 -1.603 -2.041 11 . 26347 SEP H H H H . H . . N 0 . . . 1 N N . . . . 13.632 . 43.621 . -4.921 . 2.237 0.796 0.895 12 . 26347 SEP H2 H2 H2 2HN . H . . N 0 . . . 1 N Y . . . . 12.001 . 43.575 . -4.540 . 2.013 -0.574 1.727 13 . 26347 SEP HA HA HA HA . H . . N 0 . . . 1 N N . . . . 12.213 . 43.656 . -6.837 . 0.179 1.687 1.711 14 . 26347 SEP HB2 HB2 HB2 1HB . H . . N 0 . . . 1 N N . . . . 10.214 . 44.753 . -5.930 . 0.082 -1.051 0.367 15 . 26347 SEP HB3 HB3 HB3 2HB . H . . N 0 . . . 1 N N . . . . 11.026 . 46.170 . -5.548 . -1.218 0.163 0.344 16 . 26347 SEP HXT HXT HXT HXT . H . . N 0 . . . 1 N Y . . . . 13.966 . 45.902 . -8.680 . -1.807 0.006 4.134 17 . 26347 SEP HOP2 HOP2 HOP2 2HOP . H . . N 0 . . . 0 N N . . . . 9.054 . 43.617 . -9.135 . 0.127 0.212 -4.124 18 . 26347 SEP HOP3 HOP3 HOP3 3HOP . H . . N 0 . . . 0 N N . . . . 7.627 . 45.251 . -8.001 . 1.154 -1.689 -2.025 19 . 26347 SEP 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 N CA N N 1 . 26347 SEP 2 . SING N H N N 2 . 26347 SEP 3 . SING N H2 N N 3 . 26347 SEP 4 . SING CA CB N N 4 . 26347 SEP 5 . SING CA C N N 5 . 26347 SEP 6 . SING CA HA N N 6 . 26347 SEP 7 . SING CB OG N N 7 . 26347 SEP 8 . SING CB HB2 N N 8 . 26347 SEP 9 . SING CB HB3 N N 9 . 26347 SEP 10 . SING OG P N N 10 . 26347 SEP 11 . DOUB C O N N 11 . 26347 SEP 12 . SING C OXT N N 12 . 26347 SEP 13 . SING OXT HXT N N 13 . 26347 SEP 14 . DOUB P O1P N N 14 . 26347 SEP 15 . SING P O2P N N 15 . 26347 SEP 16 . SING P O3P N N 16 . 26347 SEP 17 . SING O2P HOP2 N N 17 . 26347 SEP 18 . SING O3P HOP3 N N 18 . 26347 SEP stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26347 _Sample.ID 1 _Sample.Name '13C 15N FOXO3a (141-284) phosphorylated on S253' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'FOXO3a (141-284) phosphorylated on S253' '[U-13C; U-15N]' 1 $assembly_1 1 $entity_1 . protein 466 . . uM . . . . 26347 1 2 DTT 'natural abundance' . . . . . 'reducing agent' 1 . . mM . . . . 26347 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 26347 1 4 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 26347 1 5 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 26347 1 6 D2O [U-2H] . . . . . solvent 10 . . % . . . . 26347 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 26347 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_conditions_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 . pH 26347 1 pressure 1 . atm 26347 1 temperature 303 . K 26347 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 26347 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version 3.190 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 26347 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 26347 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.2.0 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 26347 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 26347 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker AVANCE NEO 600 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 26347 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26347 1 2 '3D CBCA(CO)NH' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26347 1 3 '3D HNCACB' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26347 1 4 '3D HNCO' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26347 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 26347 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name chem_shift_reference_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 . . . . . 26347 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.0 . . . . . 26347 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26347 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 26347 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Assigned chemical shift of FOXO3a (141-284) phosphorylated on S253' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 26347 1 2 '3D CBCA(CO)NH' 1 $sample_1 isotropic 26347 1 3 '3D HNCACB' 1 $sample_1 isotropic 26347 1 4 '3D HNCO' 1 $sample_1 isotropic 26347 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 26347 1 2 $software_2 . . 26347 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 PRO C C 13 177.059 0.01 . 1 . . . . . -4 PRO C . 26347 1 2 . 1 . 1 2 2 PRO CA C 13 63.104 0.3 . 1 . . . . . -4 PRO CA . 26347 1 3 . 1 . 1 2 2 PRO CB C 13 32.309 0.3 . 1 . . . . . -4 PRO CB . 26347 1 4 . 1 . 1 3 3 LEU H H 1 8.486 0.01 . 1 . . . . . -3 LEU H . 26347 1 5 . 1 . 1 3 3 LEU C C 13 178.053 0.01 . 1 . . . . . -3 LEU C . 26347 1 6 . 1 . 1 3 3 LEU CA C 13 55.474 0.3 . 1 . . . . . -3 LEU CA . 26347 1 7 . 1 . 1 3 3 LEU CB C 13 42.359 0.3 . 1 . . . . . -3 LEU CB . 26347 1 8 . 1 . 1 3 3 LEU N N 15 122.396 0.05 . 1 . . . . . -3 LEU N . 26347 1 9 . 1 . 1 4 4 GLY H H 1 8.380 0.01 . 1 . . . . . -2 GLY H . 26347 1 10 . 1 . 1 4 4 GLY C C 13 174.374 0.01 . 1 . . . . . -2 GLY C . 26347 1 11 . 1 . 1 4 4 GLY CA C 13 45.313 0.3 . 1 . . . . . -2 GLY CA . 26347 1 12 . 1 . 1 4 4 GLY N N 15 109.832 0.05 . 1 . . . . . -2 GLY N . 26347 1 13 . 1 . 1 5 5 SER H H 1 8.190 0.01 . 1 . . . . . -1 SER H . 26347 1 14 . 1 . 1 5 5 SER C C 13 174.620 0.01 . 1 . . . . . -1 SER C . 26347 1 15 . 1 . 1 5 5 SER CA C 13 58.160 0.3 . 1 . . . . . -1 SER CA . 26347 1 16 . 1 . 1 5 5 SER CB C 13 63.947 0.3 . 1 . . . . . -1 SER CB . 26347 1 17 . 1 . 1 5 5 SER N N 15 115.780 0.05 . 1 . . . . . -1 SER N . 26347 1 18 . 1 . 1 6 6 ALA H H 1 8.407 0.01 . 1 . . . . . 141 ALA H . 26347 1 19 . 1 . 1 6 6 ALA C C 13 178.277 0.01 . 1 . . . . . 141 ALA C . 26347 1 20 . 1 . 1 6 6 ALA CA C 13 52.624 0.3 . 1 . . . . . 141 ALA CA . 26347 1 21 . 1 . 1 6 6 ALA CB C 13 19.117 0.3 . 1 . . . . . 141 ALA CB . 26347 1 22 . 1 . 1 6 6 ALA N N 15 126.120 0.05 . 1 . . . . . 141 ALA N . 26347 1 23 . 1 . 1 7 7 GLY H H 1 8.324 0.01 . 1 . . . . . 142 GLY H . 26347 1 24 . 1 . 1 7 7 GLY C C 13 174.815 0.01 . 1 . . . . . 142 GLY C . 26347 1 25 . 1 . 1 7 7 GLY CA C 13 45.353 0.3 . 1 . . . . . 142 GLY CA . 26347 1 26 . 1 . 1 7 7 GLY N N 15 107.998 0.05 . 1 . . . . . 142 GLY N . 26347 1 27 . 1 . 1 8 8 GLY H H 1 8.220 0.01 . 1 . . . . . 143 GLY H . 26347 1 28 . 1 . 1 8 8 GLY CA C 13 45.180 0.3 . 1 . . . . . 143 GLY CA . 26347 1 29 . 1 . 1 8 8 GLY N N 15 108.792 0.05 . 1 . . . . . 143 GLY N . 26347 1 30 . 1 . 1 9 9 SER H H 1 8.325 0.01 . 1 . . . . . 144 SER H . 26347 1 31 . 1 . 1 9 9 SER C C 13 175.197 0.01 . 1 . . . . . 144 SER C . 26347 1 32 . 1 . 1 9 9 SER CA C 13 58.452 0.3 . 1 . . . . . 144 SER CA . 26347 1 33 . 1 . 1 9 9 SER CB C 13 63.839 0.3 . 1 . . . . . 144 SER CB . 26347 1 34 . 1 . 1 9 9 SER N N 15 115.678 0.05 . 1 . . . . . 144 SER N . 26347 1 35 . 1 . 1 10 10 GLY H H 1 8.469 0.01 . 1 . . . . . 145 GLY H . 26347 1 36 . 1 . 1 10 10 GLY C C 13 173.863 0.01 . 1 . . . . . 145 GLY C . 26347 1 37 . 1 . 1 10 10 GLY CA C 13 45.163 0.3 . 1 . . . . . 145 GLY CA . 26347 1 38 . 1 . 1 10 10 GLY N N 15 110.720 0.05 . 1 . . . . . 145 GLY N . 26347 1 39 . 1 . 1 11 11 GLN H H 1 8.118 0.01 . 1 . . . . . 146 GLN H . 26347 1 40 . 1 . 1 11 11 GLN CA C 13 53.682 0.1 . 1 . . . . . 146 GLN CA . 26347 1 41 . 1 . 1 11 11 GLN CB C 13 28.990 0.1 . 1 . . . . . 146 GLN CB . 26347 1 42 . 1 . 1 11 11 GLN N N 15 120.607 0.05 . 1 . . . . . 146 GLN N . 26347 1 43 . 1 . 1 17 17 SER CA C 13 56.490 0.1 . 1 . . . . . 152 SER CA . 26347 1 44 . 1 . 1 17 17 SER CB C 13 64.057 0.1 . 1 . . . . . 152 SER CB . 26347 1 45 . 1 . 1 18 18 ARG H H 1 8.303 0.01 . 1 . . . . . 153 ARG H . 26347 1 46 . 1 . 1 18 18 ARG N N 15 123.082 0.05 . 1 . . . . . 153 ARG N . 26347 1 47 . 1 . 1 19 19 ARG H H 1 8.244 0.01 . 1 . . . . . 154 ARG H . 26347 1 48 . 1 . 1 19 19 ARG CA C 13 56.283 0.3 . 1 . . . . . 154 ARG CA . 26347 1 49 . 1 . 1 19 19 ARG N N 15 121.845 0.05 . 1 . . . . . 154 ARG N . 26347 1 50 . 1 . 1 20 20 ASN H H 1 8.055 0.01 . 1 . . . . . 155 ASN H . 26347 1 51 . 1 . 1 20 20 ASN N N 15 118.745 0.05 . 1 . . . . . 155 ASN N . 26347 1 52 . 1 . 1 21 21 ALA H H 1 8.171 0.01 . 1 . . . . . 156 ALA H . 26347 1 53 . 1 . 1 21 21 ALA C C 13 177.480 0.01 . 1 . . . . . 156 ALA C . 26347 1 54 . 1 . 1 21 21 ALA CA C 13 53.410 0.3 . 1 . . . . . 156 ALA CA . 26347 1 55 . 1 . 1 21 21 ALA CB C 13 18.784 0.3 . 1 . . . . . 156 ALA CB . 26347 1 56 . 1 . 1 21 21 ALA N N 15 123.872 0.05 . 1 . . . . . 156 ALA N . 26347 1 57 . 1 . 1 22 22 TRP H H 1 7.301 0.01 . 1 . . . . . 157 TRP H . 26347 1 58 . 1 . 1 22 22 TRP C C 13 176.225 0.01 . 1 . . . . . 157 TRP C . 26347 1 59 . 1 . 1 22 22 TRP CA C 13 56.978 0.3 . 1 . . . . . 157 TRP CA . 26347 1 60 . 1 . 1 22 22 TRP CB C 13 28.993 0.3 . 1 . . . . . 157 TRP CB . 26347 1 61 . 1 . 1 22 22 TRP N N 15 115.450 0.05 . 1 . . . . . 157 TRP N . 26347 1 62 . 1 . 1 23 23 GLY H H 1 7.695 0.01 . 1 . . . . . 158 GLY H . 26347 1 63 . 1 . 1 23 23 GLY CA C 13 45.500 0.1 . 1 . . . . . 158 GLY CA . 26347 1 64 . 1 . 1 23 23 GLY N N 15 109.673 0.05 . 1 . . . . . 158 GLY N . 26347 1 65 . 1 . 1 24 24 ASN H H 1 8.358 0.01 . 1 . . . . . 159 ASN H . 26347 1 66 . 1 . 1 24 24 ASN C C 13 174.948 0.01 . 1 . . . . . 159 ASN C . 26347 1 67 . 1 . 1 24 24 ASN CA C 13 53.352 0.3 . 1 . . . . . 159 ASN CA . 26347 1 68 . 1 . 1 24 24 ASN CB C 13 38.447 0.3 . 1 . . . . . 159 ASN CB . 26347 1 69 . 1 . 1 24 24 ASN N N 15 118.630 0.05 . 1 . . . . . 159 ASN N . 26347 1 70 . 1 . 1 25 25 LEU H H 1 7.648 0.01 . 1 . . . . . 160 LEU H . 26347 1 71 . 1 . 1 25 25 LEU C C 13 176.587 0.01 . 1 . . . . . 160 LEU C . 26347 1 72 . 1 . 1 25 25 LEU CA C 13 54.695 0.3 . 1 . . . . . 160 LEU CA . 26347 1 73 . 1 . 1 25 25 LEU CB C 13 42.985 0.3 . 1 . . . . . 160 LEU CB . 26347 1 74 . 1 . 1 25 25 LEU N N 15 120.871 0.05 . 1 . . . . . 160 LEU N . 26347 1 75 . 1 . 1 26 26 SER H H 1 8.961 0.01 . 1 . . . . . 161 SER H . 26347 1 76 . 1 . 1 26 26 SER C C 13 175.774 0.01 . 1 . . . . . 161 SER C . 26347 1 77 . 1 . 1 26 26 SER CA C 13 56.557 0.3 . 1 . . . . . 161 SER CA . 26347 1 78 . 1 . 1 26 26 SER CB C 13 64.780 0.3 . 1 . . . . . 161 SER CB . 26347 1 79 . 1 . 1 26 26 SER N N 15 118.349 0.05 . 1 . . . . . 161 SER N . 26347 1 80 . 1 . 1 27 27 TYR H H 1 8.825 0.01 . 1 . . . . . 162 TYR H . 26347 1 81 . 1 . 1 27 27 TYR C C 13 178.266 0.01 . 1 . . . . . 162 TYR C . 26347 1 82 . 1 . 1 27 27 TYR CA C 13 63.135 0.3 . 1 . . . . . 162 TYR CA . 26347 1 83 . 1 . 1 27 27 TYR CB C 13 38.473 0.3 . 1 . . . . . 162 TYR CB . 26347 1 84 . 1 . 1 27 27 TYR N N 15 121.035 0.05 . 1 . . . . . 162 TYR N . 26347 1 85 . 1 . 1 28 28 ALA H H 1 8.680 0.01 . 1 . . . . . 163 ALA H . 26347 1 86 . 1 . 1 28 28 ALA C C 13 173.339 0.01 . 1 . . . . . 163 ALA C . 26347 1 87 . 1 . 1 28 28 ALA CA C 13 55.987 0.1 . 1 . . . . . 163 ALA CA . 26347 1 88 . 1 . 1 28 28 ALA CB C 13 17.433 0.1 . 1 . . . . . 163 ALA CB . 26347 1 89 . 1 . 1 28 28 ALA N N 15 119.538 0.05 . 1 . . . . . 163 ALA N . 26347 1 90 . 1 . 1 29 29 ASP H H 1 8.064 0.01 . 1 . . . . . 164 ASP H . 26347 1 91 . 1 . 1 29 29 ASP C C 13 178.841 0.01 . 1 . . . . . 164 ASP C . 26347 1 92 . 1 . 1 29 29 ASP N N 15 120.688 0.05 . 1 . . . . . 164 ASP N . 26347 1 93 . 1 . 1 30 30 LEU H H 1 8.104 0.01 . 1 . . . . . 165 LEU H . 26347 1 94 . 1 . 1 30 30 LEU C C 13 177.621 0.01 . 1 . . . . . 165 LEU C . 26347 1 95 . 1 . 1 30 30 LEU CA C 13 58.325 0.3 . 1 . . . . . 165 LEU CA . 26347 1 96 . 1 . 1 30 30 LEU CB C 13 42.522 0.3 . 1 . . . . . 165 LEU CB . 26347 1 97 . 1 . 1 30 30 LEU N N 15 121.647 0.05 . 1 . . . . . 165 LEU N . 26347 1 98 . 1 . 1 31 31 ILE H H 1 8.456 0.01 . 1 . . . . . 166 ILE H . 26347 1 99 . 1 . 1 31 31 ILE C C 13 177.351 0.01 . 1 . . . . . 166 ILE C . 26347 1 100 . 1 . 1 31 31 ILE N N 15 118.471 0.05 . 1 . . . . . 166 ILE N . 26347 1 101 . 1 . 1 32 32 THR H H 1 7.862 0.01 . 1 . . . . . 167 THR H . 26347 1 102 . 1 . 1 32 32 THR C C 13 174.989 0.01 . 1 . . . . . 167 THR C . 26347 1 103 . 1 . 1 32 32 THR CB C 13 68.540 0.3 . 1 . . . . . 167 THR CB . 26347 1 104 . 1 . 1 32 32 THR N N 15 115.166 0.05 . 1 . . . . . 167 THR N . 26347 1 105 . 1 . 1 33 33 ARG H H 1 7.607 0.01 . 1 . . . . . 168 ARG H . 26347 1 106 . 1 . 1 33 33 ARG C C 13 178.507 0.01 . 1 . . . . . 168 ARG C . 26347 1 107 . 1 . 1 33 33 ARG CA C 13 58.935 0.3 . 1 . . . . . 168 ARG CA . 26347 1 108 . 1 . 1 33 33 ARG CB C 13 30.031 0.3 . 1 . . . . . 168 ARG CB . 26347 1 109 . 1 . 1 33 33 ARG N N 15 120.090 0.05 . 1 . . . . . 168 ARG N . 26347 1 110 . 1 . 1 34 34 ALA H H 1 7.452 0.01 . 1 . . . . . 169 ALA H . 26347 1 111 . 1 . 1 34 34 ALA C C 13 172.680 0.01 . 1 . . . . . 169 ALA C . 26347 1 112 . 1 . 1 34 34 ALA CA C 13 54.558 0.3 . 1 . . . . . 169 ALA CA . 26347 1 113 . 1 . 1 34 34 ALA CB C 13 16.889 0.3 . 1 . . . . . 169 ALA CB . 26347 1 114 . 1 . 1 34 34 ALA N N 15 123.269 0.05 . 1 . . . . . 169 ALA N . 26347 1 115 . 1 . 1 35 35 ILE H H 1 7.994 0.01 . 1 . . . . . 170 ILE H . 26347 1 116 . 1 . 1 35 35 ILE C C 13 172.544 0.01 . 1 . . . . . 170 ILE C . 26347 1 117 . 1 . 1 35 35 ILE CA C 13 66.467 0.1 . 1 . . . . . 170 ILE CA . 26347 1 118 . 1 . 1 35 35 ILE CB C 13 38.435 0.1 . 1 . . . . . 170 ILE CB . 26347 1 119 . 1 . 1 35 35 ILE N N 15 118.078 0.05 . 1 . . . . . 170 ILE N . 26347 1 120 . 1 . 1 36 36 GLU H H 1 8.726 0.01 . 1 . . . . . 171 GLU H . 26347 1 121 . 1 . 1 36 36 GLU C C 13 177.405 0.01 . 1 . . . . . 171 GLU C . 26347 1 122 . 1 . 1 36 36 GLU CA C 13 59.123 0.3 . 1 . . . . . 171 GLU CA . 26347 1 123 . 1 . 1 36 36 GLU CB C 13 29.479 0.3 . 1 . . . . . 171 GLU CB . 26347 1 124 . 1 . 1 36 36 GLU N N 15 118.206 0.05 . 1 . . . . . 171 GLU N . 26347 1 125 . 1 . 1 37 37 SER H H 1 7.475 0.01 . 1 . . . . . 172 SER H . 26347 1 126 . 1 . 1 37 37 SER C C 13 174.399 0.01 . 1 . . . . . 172 SER C . 26347 1 127 . 1 . 1 37 37 SER CA C 13 59.462 0.3 . 1 . . . . . 172 SER CA . 26347 1 128 . 1 . 1 37 37 SER CB C 13 63.803 0.3 . 1 . . . . . 172 SER CB . 26347 1 129 . 1 . 1 37 37 SER N N 15 112.344 0.05 . 1 . . . . . 172 SER N . 26347 1 130 . 1 . 1 38 38 SER H H 1 7.520 0.01 . 1 . . . . . 173 SER H . 26347 1 131 . 1 . 1 38 38 SER CA C 13 56.633 0.1 . 1 . . . . . 173 SER CA . 26347 1 132 . 1 . 1 38 38 SER CB C 13 64.137 0.1 . 1 . . . . . 173 SER CB . 26347 1 133 . 1 . 1 38 38 SER N N 15 120.104 0.05 . 1 . . . . . 173 SER N . 26347 1 134 . 1 . 1 39 39 PRO C C 13 177.675 0.01 . 1 . . . . . 174 PRO C . 26347 1 135 . 1 . 1 40 40 ASP H H 1 8.194 0.01 . 1 . . . . . 175 ASP H . 26347 1 136 . 1 . 1 40 40 ASP C C 13 174.898 0.01 . 1 . . . . . 175 ASP C . 26347 1 137 . 1 . 1 40 40 ASP CA C 13 53.415 0.3 . 1 . . . . . 175 ASP CA . 26347 1 138 . 1 . 1 40 40 ASP CB C 13 41.130 0.3 . 1 . . . . . 175 ASP CB . 26347 1 139 . 1 . 1 40 40 ASP N N 15 113.765 0.05 . 1 . . . . . 175 ASP N . 26347 1 140 . 1 . 1 41 41 LYS H H 1 7.907 0.01 . 1 . . . . . 176 LYS H . 26347 1 141 . 1 . 1 41 41 LYS C C 13 174.778 0.01 . 1 . . . . . 176 LYS C . 26347 1 142 . 1 . 1 41 41 LYS N N 15 116.069 0.05 . 1 . . . . . 176 LYS N . 26347 1 143 . 1 . 1 42 42 ARG H H 1 7.312 0.01 . 1 . . . . . 177 ARG H . 26347 1 144 . 1 . 1 42 42 ARG C C 13 173.921 0.01 . 1 . . . . . 177 ARG C . 26347 1 145 . 1 . 1 42 42 ARG CA C 13 54.621 0.1 . 1 . . . . . 177 ARG CA . 26347 1 146 . 1 . 1 42 42 ARG CB C 13 32.252 0.1 . 1 . . . . . 177 ARG CB . 26347 1 147 . 1 . 1 42 42 ARG N N 15 112.648 0.05 . 1 . . . . . 177 ARG N . 26347 1 148 . 1 . 1 43 43 LEU H H 1 8.545 0.01 . 1 . . . . . 178 LEU H . 26347 1 149 . 1 . 1 43 43 LEU CA C 13 54.263 0.1 . 1 . . . . . 178 LEU CA . 26347 1 150 . 1 . 1 43 43 LEU N N 15 119.842 0.05 . 1 . . . . . 178 LEU N . 26347 1 151 . 1 . 1 44 44 THR H H 1 8.893 0.01 . 1 . . . . . 179 THR H . 26347 1 152 . 1 . 1 44 44 THR CA C 13 60.383 0.1 . 1 . . . . . 179 THR CA . 26347 1 153 . 1 . 1 44 44 THR N N 15 112.415 0.05 . 1 . . . . . 179 THR N . 26347 1 154 . 1 . 1 45 45 LEU H H 1 9.367 0.01 . 1 . . . . . 180 LEU H . 26347 1 155 . 1 . 1 45 45 LEU N N 15 122.208 0.05 . 1 . . . . . 180 LEU N . 26347 1 156 . 1 . 1 46 46 SER H H 1 8.363 0.01 . 1 . . . . . 181 SER H . 26347 1 157 . 1 . 1 46 46 SER C C 13 177.486 0.01 . 1 . . . . . 181 SER C . 26347 1 158 . 1 . 1 46 46 SER CA C 13 62.367 0.3 . 1 . . . . . 181 SER CA . 26347 1 159 . 1 . 1 46 46 SER CB C 13 65.837 0.3 . 1 . . . . . 181 SER CB . 26347 1 160 . 1 . 1 46 46 SER N N 15 111.233 0.05 . 1 . . . . . 181 SER N . 26347 1 161 . 1 . 1 47 47 GLN H H 1 7.617 0.01 . 1 . . . . . 182 GLN H . 26347 1 162 . 1 . 1 47 47 GLN CA C 13 58.830 0.1 . 1 . . . . . 182 GLN CA . 26347 1 163 . 1 . 1 47 47 GLN CB C 13 30.244 0.1 . 1 . . . . . 182 GLN CB . 26347 1 164 . 1 . 1 47 47 GLN N N 15 120.283 0.05 . 1 . . . . . 182 GLN N . 26347 1 165 . 1 . 1 48 48 ILE H H 1 8.365 0.01 . 1 . . . . . 183 ILE H . 26347 1 166 . 1 . 1 48 48 ILE C C 13 177.868 0.01 . 1 . . . . . 183 ILE C . 26347 1 167 . 1 . 1 48 48 ILE CA C 13 66.553 0.3 . 1 . . . . . 183 ILE CA . 26347 1 168 . 1 . 1 48 48 ILE N N 15 124.377 0.05 . 1 . . . . . 183 ILE N . 26347 1 169 . 1 . 1 49 49 TYR H H 1 8.144 0.01 . 1 . . . . . 184 TYR H . 26347 1 170 . 1 . 1 49 49 TYR C C 13 178.316 0.01 . 1 . . . . . 184 TYR C . 26347 1 171 . 1 . 1 49 49 TYR CA C 13 59.206 0.1 . 1 . . . . . 184 TYR CA . 26347 1 172 . 1 . 1 49 49 TYR CB C 13 37.363 0.1 . 1 . . . . . 184 TYR CB . 26347 1 173 . 1 . 1 49 49 TYR N N 15 118.251 0.05 . 1 . . . . . 184 TYR N . 26347 1 174 . 1 . 1 50 50 GLU H H 1 8.177 0.01 . 1 . . . . . 185 GLU H . 26347 1 175 . 1 . 1 50 50 GLU C C 13 178.595 0.01 . 1 . . . . . 185 GLU C . 26347 1 176 . 1 . 1 50 50 GLU CA C 13 59.559 0.3 . 1 . . . . . 185 GLU CA . 26347 1 177 . 1 . 1 50 50 GLU N N 15 117.470 0.05 . 1 . . . . . 185 GLU N . 26347 1 178 . 1 . 1 51 51 TRP H H 1 8.178 0.01 . 1 . . . . . 186 TRP H . 26347 1 179 . 1 . 1 51 51 TRP C C 13 178.114 0.01 . 1 . . . . . 186 TRP C . 26347 1 180 . 1 . 1 51 51 TRP CA C 13 62.783 0.1 . 1 . . . . . 186 TRP CA . 26347 1 181 . 1 . 1 51 51 TRP N N 15 120.956 0.05 . 1 . . . . . 186 TRP N . 26347 1 182 . 1 . 1 52 52 MET H H 1 8.232 0.01 . 1 . . . . . 187 MET H . 26347 1 183 . 1 . 1 52 52 MET C C 13 177.500 0.01 . 1 . . . . . 187 MET C . 26347 1 184 . 1 . 1 52 52 MET CA C 13 58.104 0.3 . 1 . . . . . 187 MET CA . 26347 1 185 . 1 . 1 52 52 MET CB C 13 31.424 0.3 . 1 . . . . . 187 MET CB . 26347 1 186 . 1 . 1 52 52 MET N N 15 117.031 0.05 . 1 . . . . . 187 MET N . 26347 1 187 . 1 . 1 53 53 VAL H H 1 7.415 0.01 . 1 . . . . . 188 VAL H . 26347 1 188 . 1 . 1 53 53 VAL C C 13 177.540 0.01 . 1 . . . . . 188 VAL C . 26347 1 189 . 1 . 1 53 53 VAL CA C 13 64.726 0.1 . 1 . . . . . 188 VAL CA . 26347 1 190 . 1 . 1 53 53 VAL CB C 13 31.968 0.1 . 1 . . . . . 188 VAL CB . 26347 1 191 . 1 . 1 53 53 VAL N N 15 114.432 0.05 . 1 . . . . . 188 VAL N . 26347 1 192 . 1 . 1 54 54 ARG H H 1 7.660 0.01 . 1 . . . . . 189 ARG H . 26347 1 193 . 1 . 1 54 54 ARG C C 13 179.168 0.01 . 1 . . . . . 189 ARG C . 26347 1 194 . 1 . 1 54 54 ARG CA C 13 58.532 0.3 . 1 . . . . . 189 ARG CA . 26347 1 195 . 1 . 1 54 54 ARG CB C 13 31.631 0.3 . 1 . . . . . 189 ARG CB . 26347 1 196 . 1 . 1 54 54 ARG N N 15 118.354 0.05 . 1 . . . . . 189 ARG N . 26347 1 197 . 1 . 1 55 55 CYS H H 1 7.991 0.01 . 1 . . . . . 190 CYS H . 26347 1 198 . 1 . 1 55 55 CYS CA C 13 59.927 0.3 . 1 . . . . . 190 CYS CA . 26347 1 199 . 1 . 1 55 55 CYS CB C 13 28.635 0.3 . 1 . . . . . 190 CYS CB . 26347 1 200 . 1 . 1 55 55 CYS N N 15 112.851 0.05 . 1 . . . . . 190 CYS N . 26347 1 201 . 1 . 1 56 56 VAL H H 1 7.797 0.01 . 1 . . . . . 191 VAL H . 26347 1 202 . 1 . 1 56 56 VAL N N 15 121.881 0.05 . 1 . . . . . 191 VAL N . 26347 1 203 . 1 . 1 58 58 TYR H H 1 7.606 0.01 . 1 . . . . . 193 TYR H . 26347 1 204 . 1 . 1 58 58 TYR C C 13 175.583 0.01 . 1 . . . . . 193 TYR C . 26347 1 205 . 1 . 1 58 58 TYR CA C 13 59.998 0.3 . 1 . . . . . 193 TYR CA . 26347 1 206 . 1 . 1 58 58 TYR CB C 13 38.781 0.3 . 1 . . . . . 193 TYR CB . 26347 1 207 . 1 . 1 58 58 TYR N N 15 115.238 0.05 . 1 . . . . . 193 TYR N . 26347 1 208 . 1 . 1 59 59 PHE H H 1 7.419 0.01 . 1 . . . . . 194 PHE H . 26347 1 209 . 1 . 1 59 59 PHE C C 13 175.982 0.01 . 1 . . . . . 194 PHE C . 26347 1 210 . 1 . 1 59 59 PHE CA C 13 57.909 0.3 . 1 . . . . . 194 PHE CA . 26347 1 211 . 1 . 1 59 59 PHE CB C 13 37.990 0.3 . 1 . . . . . 194 PHE CB . 26347 1 212 . 1 . 1 59 59 PHE N N 15 114.376 0.05 . 1 . . . . . 194 PHE N . 26347 1 213 . 1 . 1 60 60 LYS H H 1 7.488 0.01 . 1 . . . . . 195 LYS H . 26347 1 214 . 1 . 1 60 60 LYS C C 13 177.373 0.01 . 1 . . . . . 195 LYS C . 26347 1 215 . 1 . 1 60 60 LYS CA C 13 58.612 0.3 . 1 . . . . . 195 LYS CA . 26347 1 216 . 1 . 1 60 60 LYS CB C 13 32.854 0.3 . 1 . . . . . 195 LYS CB . 26347 1 217 . 1 . 1 60 60 LYS N N 15 120.273 0.05 . 1 . . . . . 195 LYS N . 26347 1 218 . 1 . 1 61 61 ASP H H 1 8.134 0.01 . 1 . . . . . 196 ASP H . 26347 1 219 . 1 . 1 61 61 ASP C C 13 176.699 0.01 . 1 . . . . . 196 ASP C . 26347 1 220 . 1 . 1 61 61 ASP CA C 13 53.931 0.3 . 1 . . . . . 196 ASP CA . 26347 1 221 . 1 . 1 61 61 ASP CB C 13 40.642 0.3 . 1 . . . . . 196 ASP CB . 26347 1 222 . 1 . 1 61 61 ASP N N 15 117.175 0.05 . 1 . . . . . 196 ASP N . 26347 1 223 . 1 . 1 62 62 LYS H H 1 7.810 0.01 . 1 . . . . . 197 LYS H . 26347 1 224 . 1 . 1 62 62 LYS C C 13 177.191 0.01 . 1 . . . . . 197 LYS C . 26347 1 225 . 1 . 1 62 62 LYS CA C 13 55.459 0.3 . 1 . . . . . 197 LYS CA . 26347 1 226 . 1 . 1 62 62 LYS CB C 13 32.701 0.3 . 1 . . . . . 197 LYS CB . 26347 1 227 . 1 . 1 62 62 LYS N N 15 119.694 0.05 . 1 . . . . . 197 LYS N . 26347 1 228 . 1 . 1 63 63 GLY H H 1 8.516 0.01 . 1 . . . . . 198 GLY H . 26347 1 229 . 1 . 1 63 63 GLY C C 13 174.442 0.01 . 1 . . . . . 198 GLY C . 26347 1 230 . 1 . 1 63 63 GLY CA C 13 46.210 0.3 . 1 . . . . . 198 GLY CA . 26347 1 231 . 1 . 1 63 63 GLY N N 15 108.202 0.05 . 1 . . . . . 198 GLY N . 26347 1 232 . 1 . 1 64 64 ASP H H 1 8.162 0.01 . 1 . . . . . 199 ASP H . 26347 1 233 . 1 . 1 64 64 ASP CA C 13 53.858 0.1 . 1 . . . . . 199 ASP CA . 26347 1 234 . 1 . 1 64 64 ASP CB C 13 41.327 0.1 . 1 . . . . . 199 ASP CB . 26347 1 235 . 1 . 1 64 64 ASP N N 15 119.516 0.05 . 1 . . . . . 199 ASP N . 26347 1 236 . 1 . 1 66 66 ASN H H 1 8.502 0.01 . 1 . . . . . 201 ASN H . 26347 1 237 . 1 . 1 66 66 ASN N N 15 119.858 0.05 . 1 . . . . . 201 ASN N . 26347 1 238 . 1 . 1 67 67 SER H H 1 8.287 0.01 . 1 . . . . . 202 SER H . 26347 1 239 . 1 . 1 67 67 SER N N 15 115.767 0.05 . 1 . . . . . 202 SER N . 26347 1 240 . 1 . 1 68 68 SER C C 13 174.400 0.01 . 1 . . . . . 203 SER C . 26347 1 241 . 1 . 1 68 68 SER CA C 13 59.193 0.3 . 1 . . . . . 203 SER CA . 26347 1 242 . 1 . 1 68 68 SER CB C 13 63.998 0.3 . 1 . . . . . 203 SER CB . 26347 1 243 . 1 . 1 69 69 ALA H H 1 7.583 0.01 . 1 . . . . . 204 ALA H . 26347 1 244 . 1 . 1 69 69 ALA CA C 13 54.246 0.1 . 1 . . . . . 204 ALA CA . 26347 1 245 . 1 . 1 69 69 ALA CB C 13 18.712 0.1 . 1 . . . . . 204 ALA CB . 26347 1 246 . 1 . 1 69 69 ALA N N 15 123.968 0.05 . 1 . . . . . 204 ALA N . 26347 1 247 . 1 . 1 70 70 GLY H H 1 8.236 0.01 . 1 . . . . . 205 GLY H . 26347 1 248 . 1 . 1 70 70 GLY C C 13 176.687 0.01 . 1 . . . . . 205 GLY C . 26347 1 249 . 1 . 1 70 70 GLY CA C 13 46.951 0.3 . 1 . . . . . 205 GLY CA . 26347 1 250 . 1 . 1 70 70 GLY N N 15 106.825 0.05 . 1 . . . . . 205 GLY N . 26347 1 251 . 1 . 1 71 71 TRP H H 1 8.107 0.01 . 1 . . . . . 206 TRP H . 26347 1 252 . 1 . 1 71 71 TRP N N 15 122.604 0.05 . 1 . . . . . 206 TRP N . 26347 1 253 . 1 . 1 72 72 LYS H H 1 7.385 0.01 . 1 . . . . . 207 LYS H . 26347 1 254 . 1 . 1 72 72 LYS C C 13 172.745 0.01 . 1 . . . . . 207 LYS C . 26347 1 255 . 1 . 1 72 72 LYS CA C 13 60.773 0.3 . 1 . . . . . 207 LYS CA . 26347 1 256 . 1 . 1 72 72 LYS N N 15 122.316 0.05 . 1 . . . . . 207 LYS N . 26347 1 257 . 1 . 1 73 73 ASN H H 1 7.775 0.01 . 1 . . . . . 208 ASN H . 26347 1 258 . 1 . 1 73 73 ASN C C 13 177.887 0.01 . 1 . . . . . 208 ASN C . 26347 1 259 . 1 . 1 73 73 ASN CA C 13 56.227 0.3 . 1 . . . . . 208 ASN CA . 26347 1 260 . 1 . 1 73 73 ASN CB C 13 37.992 0.3 . 1 . . . . . 208 ASN CB . 26347 1 261 . 1 . 1 73 73 ASN N N 15 118.940 0.05 . 1 . . . . . 208 ASN N . 26347 1 262 . 1 . 1 74 74 SER H H 1 8.083 0.01 . 1 . . . . . 209 SER H . 26347 1 263 . 1 . 1 74 74 SER CA C 13 62.754 0.3 . 1 . . . . . 209 SER CA . 26347 1 264 . 1 . 1 74 74 SER CB C 13 66.809 0.3 . 1 . . . . . 209 SER CB . 26347 1 265 . 1 . 1 74 74 SER N N 15 117.419 0.05 . 1 . . . . . 209 SER N . 26347 1 266 . 1 . 1 75 75 ILE H H 1 8.231 0.01 . 1 . . . . . 210 ILE H . 26347 1 267 . 1 . 1 75 75 ILE C C 13 176.488 0.01 . 1 . . . . . 210 ILE C . 26347 1 268 . 1 . 1 75 75 ILE CA C 13 64.653 0.3 . 1 . . . . . 210 ILE CA . 26347 1 269 . 1 . 1 75 75 ILE N N 15 124.719 0.05 . 1 . . . . . 210 ILE N . 26347 1 270 . 1 . 1 76 76 ARG H H 1 7.821 0.01 . 1 . . . . . 211 ARG H . 26347 1 271 . 1 . 1 76 76 ARG C C 13 178.939 0.01 . 1 . . . . . 211 ARG C . 26347 1 272 . 1 . 1 76 76 ARG CA C 13 60.097 0.3 . 1 . . . . . 211 ARG CA . 26347 1 273 . 1 . 1 76 76 ARG CB C 13 29.387 0.3 . 1 . . . . . 211 ARG CB . 26347 1 274 . 1 . 1 76 76 ARG N N 15 118.753 0.05 . 1 . . . . . 211 ARG N . 26347 1 275 . 1 . 1 77 77 HIS H H 1 8.397 0.01 . 1 . . . . . 212 HIS H . 26347 1 276 . 1 . 1 77 77 HIS C C 13 177.756 0.01 . 1 . . . . . 212 HIS C . 26347 1 277 . 1 . 1 77 77 HIS CA C 13 59.112 0.3 . 1 . . . . . 212 HIS CA . 26347 1 278 . 1 . 1 77 77 HIS CB C 13 30.328 0.3 . 1 . . . . . 212 HIS CB . 26347 1 279 . 1 . 1 77 77 HIS N N 15 117.584 0.05 . 1 . . . . . 212 HIS N . 26347 1 280 . 1 . 1 78 78 ASN H H 1 7.923 0.01 . 1 . . . . . 213 ASN H . 26347 1 281 . 1 . 1 78 78 ASN CA C 13 57.635 0.1 . 1 . . . . . 213 ASN CA . 26347 1 282 . 1 . 1 78 78 ASN CB C 13 40.993 0.1 . 1 . . . . . 213 ASN CB . 26347 1 283 . 1 . 1 78 78 ASN N N 15 117.414 0.05 . 1 . . . . . 213 ASN N . 26347 1 284 . 1 . 1 79 79 LEU H H 1 7.822 0.01 . 1 . . . . . 214 LEU H . 26347 1 285 . 1 . 1 79 79 LEU CA C 13 57.798 0.1 . 1 . . . . . 214 LEU CA . 26347 1 286 . 1 . 1 79 79 LEU CB C 13 40.591 0.1 . 1 . . . . . 214 LEU CB . 26347 1 287 . 1 . 1 79 79 LEU N N 15 119.710 0.05 . 1 . . . . . 214 LEU N . 26347 1 288 . 1 . 1 80 80 SER H H 1 7.131 0.01 . 1 . . . . . 215 SER H . 26347 1 289 . 1 . 1 80 80 SER C C 13 175.062 0.01 . 1 . . . . . 215 SER C . 26347 1 290 . 1 . 1 80 80 SER CA C 13 59.914 0.3 . 1 . . . . . 215 SER CA . 26347 1 291 . 1 . 1 80 80 SER CB C 13 64.050 0.3 . 1 . . . . . 215 SER CB . 26347 1 292 . 1 . 1 80 80 SER N N 15 109.522 0.05 . 1 . . . . . 215 SER N . 26347 1 293 . 1 . 1 81 81 LEU H H 1 7.422 0.01 . 1 . . . . . 216 LEU H . 26347 1 294 . 1 . 1 81 81 LEU CA C 13 55.712 0.1 . 1 . . . . . 216 LEU CA . 26347 1 295 . 1 . 1 81 81 LEU CB C 13 43.139 0.1 . 1 . . . . . 216 LEU CB . 26347 1 296 . 1 . 1 81 81 LEU N N 15 121.044 0.05 . 1 . . . . . 216 LEU N . 26347 1 297 . 1 . 1 83 83 SER CB C 13 62.929 0.3 . 1 . . . . . 218 SER CB . 26347 1 298 . 1 . 1 84 84 ARG H H 1 7.980 0.01 . 1 . . . . . 219 ARG H . 26347 1 299 . 1 . 1 84 84 ARG C C 13 175.614 0.01 . 1 . . . . . 219 ARG C . 26347 1 300 . 1 . 1 84 84 ARG N N 15 119.332 0.05 . 1 . . . . . 219 ARG N . 26347 1 301 . 1 . 1 85 85 PHE H H 1 8.024 0.01 . 1 . . . . . 220 PHE H . 26347 1 302 . 1 . 1 85 85 PHE C C 13 174.877 0.01 . 1 . . . . . 220 PHE C . 26347 1 303 . 1 . 1 85 85 PHE CB C 13 41.657 0.3 . 1 . . . . . 220 PHE CB . 26347 1 304 . 1 . 1 85 85 PHE N N 15 118.115 0.05 . 1 . . . . . 220 PHE N . 26347 1 305 . 1 . 1 86 86 MET H H 1 9.239 0.01 . 1 . . . . . 221 MET H . 26347 1 306 . 1 . 1 86 86 MET C C 13 175.375 0.01 . 1 . . . . . 221 MET C . 26347 1 307 . 1 . 1 86 86 MET CA C 13 54.619 0.3 . 1 . . . . . 221 MET CA . 26347 1 308 . 1 . 1 86 86 MET CB C 13 37.273 0.1 . 1 . . . . . 221 MET CB . 26347 1 309 . 1 . 1 86 86 MET N N 15 120.446 0.05 . 1 . . . . . 221 MET N . 26347 1 310 . 1 . 1 87 87 ARG H H 1 8.177 0.01 . 1 . . . . . 222 ARG H . 26347 1 311 . 1 . 1 87 87 ARG N N 15 124.959 0.05 . 1 . . . . . 222 ARG N . 26347 1 312 . 1 . 1 88 88 VAL H H 1 9.008 0.01 . 1 . . . . . 223 VAL H . 26347 1 313 . 1 . 1 88 88 VAL C C 13 174.893 0.01 . 1 . . . . . 223 VAL C . 26347 1 314 . 1 . 1 88 88 VAL N N 15 125.639 0.05 . 1 . . . . . 223 VAL N . 26347 1 315 . 1 . 1 89 89 GLN H H 1 8.429 0.01 . 1 . . . . . 224 GLN H . 26347 1 316 . 1 . 1 89 89 GLN C C 13 175.236 0.01 . 1 . . . . . 224 GLN C . 26347 1 317 . 1 . 1 89 89 GLN CA C 13 55.646 0.3 . 1 . . . . . 224 GLN CA . 26347 1 318 . 1 . 1 89 89 GLN CB C 13 30.105 0.3 . 1 . . . . . 224 GLN CB . 26347 1 319 . 1 . 1 89 89 GLN N N 15 124.065 0.05 . 1 . . . . . 224 GLN N . 26347 1 320 . 1 . 1 90 90 ASN H H 1 8.461 0.01 . 1 . . . . . 225 ASN H . 26347 1 321 . 1 . 1 90 90 ASN C C 13 175.036 0.01 . 1 . . . . . 225 ASN C . 26347 1 322 . 1 . 1 90 90 ASN CA C 13 52.730 0.3 . 1 . . . . . 225 ASN CA . 26347 1 323 . 1 . 1 90 90 ASN CB C 13 39.102 0.3 . 1 . . . . . 225 ASN CB . 26347 1 324 . 1 . 1 90 90 ASN N N 15 121.853 0.05 . 1 . . . . . 225 ASN N . 26347 1 325 . 1 . 1 91 91 GLU H H 1 8.635 0.01 . 1 . . . . . 226 GLU H . 26347 1 326 . 1 . 1 91 91 GLU C C 13 177.057 0.01 . 1 . . . . . 226 GLU C . 26347 1 327 . 1 . 1 91 91 GLU CA C 13 57.298 0.3 . 1 . . . . . 226 GLU CA . 26347 1 328 . 1 . 1 91 91 GLU CB C 13 29.986 0.3 . 1 . . . . . 226 GLU CB . 26347 1 329 . 1 . 1 91 91 GLU N N 15 122.360 0.05 . 1 . . . . . 226 GLU N . 26347 1 330 . 1 . 1 92 92 GLY H H 1 8.485 0.01 . 1 . . . . . 227 GLY H . 26347 1 331 . 1 . 1 92 92 GLY CA C 13 45.222 0.3 . 1 . . . . . 227 GLY CA . 26347 1 332 . 1 . 1 92 92 GLY N N 15 109.459 0.05 . 1 . . . . . 227 GLY N . 26347 1 333 . 1 . 1 93 93 THR H H 1 8.084 0.01 . 1 . . . . . 228 THR H . 26347 1 334 . 1 . 1 93 93 THR CA C 13 62.413 0.3 . 1 . . . . . 228 THR CA . 26347 1 335 . 1 . 1 93 93 THR CB C 13 69.554 0.3 . 1 . . . . . 228 THR CB . 26347 1 336 . 1 . 1 93 93 THR N N 15 113.750 0.05 . 1 . . . . . 228 THR N . 26347 1 337 . 1 . 1 94 94 GLY H H 1 8.527 0.01 . 1 . . . . . 229 GLY H . 26347 1 338 . 1 . 1 94 94 GLY C C 13 174.399 0.01 . 1 . . . . . 229 GLY C . 26347 1 339 . 1 . 1 94 94 GLY CA C 13 45.714 0.3 . 1 . . . . . 229 GLY CA . 26347 1 340 . 1 . 1 94 94 GLY N N 15 112.159 0.05 . 1 . . . . . 229 GLY N . 26347 1 341 . 1 . 1 95 95 LYS H H 1 7.969 0.01 . 1 . . . . . 230 LYS H . 26347 1 342 . 1 . 1 95 95 LYS C C 13 176.674 0.01 . 1 . . . . . 230 LYS C . 26347 1 343 . 1 . 1 95 95 LYS CA C 13 55.755 0.3 . 1 . . . . . 230 LYS CA . 26347 1 344 . 1 . 1 95 95 LYS CB C 13 33.129 0.3 . 1 . . . . . 230 LYS CB . 26347 1 345 . 1 . 1 95 95 LYS N N 15 119.707 0.05 . 1 . . . . . 230 LYS N . 26347 1 346 . 1 . 1 96 96 SER H H 1 8.119 0.01 . 1 . . . . . 231 SER H . 26347 1 347 . 1 . 1 96 96 SER CA C 13 58.468 0.1 . 1 . . . . . 231 SER CA . 26347 1 348 . 1 . 1 96 96 SER CB C 13 64.189 0.1 . 1 . . . . . 231 SER CB . 26347 1 349 . 1 . 1 96 96 SER N N 15 116.677 0.05 . 1 . . . . . 231 SER N . 26347 1 350 . 1 . 1 97 97 SER H H 1 8.099 0.01 . 1 . . . . . 232 SER H . 26347 1 351 . 1 . 1 97 97 SER N N 15 116.783 0.05 . 1 . . . . . 232 SER N . 26347 1 352 . 1 . 1 98 98 TRP H H 1 8.362 0.01 . 1 . . . . . 233 TRP H . 26347 1 353 . 1 . 1 98 98 TRP CA C 13 56.580 0.3 . 1 . . . . . 233 TRP CA . 26347 1 354 . 1 . 1 98 98 TRP CB C 13 32.203 0.3 . 1 . . . . . 233 TRP CB . 26347 1 355 . 1 . 1 98 98 TRP N N 15 120.898 0.05 . 1 . . . . . 233 TRP N . 26347 1 356 . 1 . 1 99 99 TRP H H 1 9.126 0.01 . 1 . . . . . 234 TRP H . 26347 1 357 . 1 . 1 99 99 TRP CA C 13 57.006 0.3 . 1 . . . . . 234 TRP CA . 26347 1 358 . 1 . 1 99 99 TRP CB C 13 30.435 0.3 . 1 . . . . . 234 TRP CB . 26347 1 359 . 1 . 1 99 99 TRP N N 15 122.006 0.05 . 1 . . . . . 234 TRP N . 26347 1 360 . 1 . 1 100 100 ILE H H 1 8.933 0.01 . 1 . . . . . 235 ILE H . 26347 1 361 . 1 . 1 100 100 ILE C C 13 176.021 0.01 . 1 . . . . . 235 ILE C . 26347 1 362 . 1 . 1 100 100 ILE CA C 13 58.859 0.3 . 1 . . . . . 235 ILE CA . 26347 1 363 . 1 . 1 100 100 ILE N N 15 112.773 0.05 . 1 . . . . . 235 ILE N . 26347 1 364 . 1 . 1 101 101 ILE H H 1 8.878 0.01 . 1 . . . . . 236 ILE H . 26347 1 365 . 1 . 1 101 101 ILE CA C 13 60.550 0.1 . 1 . . . . . 236 ILE CA . 26347 1 366 . 1 . 1 101 101 ILE N N 15 121.080 0.05 . 1 . . . . . 236 ILE N . 26347 1 367 . 1 . 1 102 102 ASN H H 1 8.629 0.01 . 1 . . . . . 237 ASN H . 26347 1 368 . 1 . 1 102 102 ASN N N 15 126.619 0.05 . 1 . . . . . 237 ASN N . 26347 1 369 . 1 . 1 103 103 PRO C C 13 177.035 0.01 . 1 . . . . . 238 PRO C . 26347 1 370 . 1 . 1 103 103 PRO CA C 13 63.852 0.3 . 1 . . . . . 238 PRO CA . 26347 1 371 . 1 . 1 103 103 PRO CB C 13 32.134 0.3 . 1 . . . . . 238 PRO CB . 26347 1 372 . 1 . 1 104 104 ASP H H 1 7.956 0.01 . 1 . . . . . 239 ASP H . 26347 1 373 . 1 . 1 104 104 ASP C C 13 176.990 0.01 . 1 . . . . . 239 ASP C . 26347 1 374 . 1 . 1 104 104 ASP CA C 13 54.309 0.3 . 1 . . . . . 239 ASP CA . 26347 1 375 . 1 . 1 104 104 ASP CB C 13 41.177 0.3 . 1 . . . . . 239 ASP CB . 26347 1 376 . 1 . 1 104 104 ASP N N 15 118.586 0.05 . 1 . . . . . 239 ASP N . 26347 1 377 . 1 . 1 105 105 GLY H H 1 7.972 0.01 . 1 . . . . . 240 GLY H . 26347 1 378 . 1 . 1 105 105 GLY C C 13 174.944 0.01 . 1 . . . . . 240 GLY C . 26347 1 379 . 1 . 1 105 105 GLY CA C 13 45.953 0.3 . 1 . . . . . 240 GLY CA . 26347 1 380 . 1 . 1 105 105 GLY N N 15 108.750 0.05 . 1 . . . . . 240 GLY N . 26347 1 381 . 1 . 1 106 106 GLY H H 1 8.266 0.01 . 1 . . . . . 241 GLY H . 26347 1 382 . 1 . 1 106 106 GLY C C 13 174.669 0.01 . 1 . . . . . 241 GLY C . 26347 1 383 . 1 . 1 106 106 GLY CA C 13 45.349 0.3 . 1 . . . . . 241 GLY CA . 26347 1 384 . 1 . 1 106 106 GLY N N 15 108.533 0.05 . 1 . . . . . 241 GLY N . 26347 1 385 . 1 . 1 107 107 LYS H H 1 8.042 0.01 . 1 . . . . . 242 LYS H . 26347 1 386 . 1 . 1 107 107 LYS C C 13 177.021 0.01 . 1 . . . . . 242 LYS C . 26347 1 387 . 1 . 1 107 107 LYS CA C 13 56.620 0.3 . 1 . . . . . 242 LYS CA . 26347 1 388 . 1 . 1 107 107 LYS CB C 13 32.871 0.3 . 1 . . . . . 242 LYS CB . 26347 1 389 . 1 . 1 107 107 LYS N N 15 120.471 0.05 . 1 . . . . . 242 LYS N . 26347 1 390 . 1 . 1 108 108 SER H H 1 8.322 0.01 . 1 . . . . . 243 SER H . 26347 1 391 . 1 . 1 108 108 SER C C 13 175.167 0.01 . 1 . . . . . 243 SER C . 26347 1 392 . 1 . 1 108 108 SER CA C 13 58.616 0.3 . 1 . . . . . 243 SER CA . 26347 1 393 . 1 . 1 108 108 SER CB C 13 63.733 0.3 . 1 . . . . . 243 SER CB . 26347 1 394 . 1 . 1 108 108 SER N N 15 116.118 0.05 . 1 . . . . . 243 SER N . 26347 1 395 . 1 . 1 109 109 GLY H H 1 8.324 0.01 . 1 . . . . . 244 GLY H . 26347 1 396 . 1 . 1 109 109 GLY C C 13 173.985 0.01 . 1 . . . . . 244 GLY C . 26347 1 397 . 1 . 1 109 109 GLY CA C 13 45.424 0.1 . 1 . . . . . 244 GLY CA . 26347 1 398 . 1 . 1 109 109 GLY N N 15 110.713 0.05 . 1 . . . . . 244 GLY N . 26347 1 399 . 1 . 1 110 110 LYS H H 1 8.067 0.01 . 1 . . . . . 245 LYS H . 26347 1 400 . 1 . 1 110 110 LYS C C 13 176.072 0.01 . 1 . . . . . 245 LYS C . 26347 1 401 . 1 . 1 110 110 LYS CA C 13 55.760 0.3 . 1 . . . . . 245 LYS CA . 26347 1 402 . 1 . 1 110 110 LYS CB C 13 33.213 0.3 . 1 . . . . . 245 LYS CB . 26347 1 403 . 1 . 1 110 110 LYS N N 15 120.544 0.05 . 1 . . . . . 245 LYS N . 26347 1 404 . 1 . 1 111 111 ALA H H 1 8.251 0.01 . 1 . . . . . 246 ALA H . 26347 1 405 . 1 . 1 111 111 ALA CA C 13 50.583 0.1 . 1 . . . . . 246 ALA CA . 26347 1 406 . 1 . 1 111 111 ALA CB C 13 18.294 0.1 . 1 . . . . . 246 ALA CB . 26347 1 407 . 1 . 1 111 111 ALA N N 15 126.514 0.05 . 1 . . . . . 246 ALA N . 26347 1 408 . 1 . 1 112 112 PRO C C 13 176.852 0.01 . 1 . . . . . 247 PRO C . 26347 1 409 . 1 . 1 112 112 PRO CA C 13 63.108 0.3 . 1 . . . . . 247 PRO CA . 26347 1 410 . 1 . 1 112 112 PRO CB C 13 32.071 0.3 . 1 . . . . . 247 PRO CB . 26347 1 411 . 1 . 1 113 113 ARG H H 1 8.415 0.01 . 1 . . . . . 248 ARG H . 26347 1 412 . 1 . 1 113 113 ARG C C 13 176.301 0.01 . 1 . . . . . 248 ARG C . 26347 1 413 . 1 . 1 113 113 ARG CA C 13 55.910 0.3 . 1 . . . . . 248 ARG CA . 26347 1 414 . 1 . 1 113 113 ARG CB C 13 30.937 0.3 . 1 . . . . . 248 ARG CB . 26347 1 415 . 1 . 1 113 113 ARG N N 15 121.608 0.05 . 1 . . . . . 248 ARG N . 26347 1 416 . 1 . 1 114 114 ARG H H 1 8.372 0.01 . 1 . . . . . 249 ARG H . 26347 1 417 . 1 . 1 114 114 ARG C C 13 176.092 0.01 . 1 . . . . . 249 ARG C . 26347 1 418 . 1 . 1 114 114 ARG CA C 13 55.759 0.3 . 1 . . . . . 249 ARG CA . 26347 1 419 . 1 . 1 114 114 ARG CB C 13 31.041 0.3 . 1 . . . . . 249 ARG CB . 26347 1 420 . 1 . 1 114 114 ARG N N 15 122.925 0.05 . 1 . . . . . 249 ARG N . 26347 1 421 . 1 . 1 115 115 ARG H H 1 8.524 0.01 . 1 . . . . . 250 ARG H . 26347 1 422 . 1 . 1 115 115 ARG C C 13 176.026 0.01 . 1 . . . . . 250 ARG C . 26347 1 423 . 1 . 1 115 115 ARG CA C 13 55.939 0.3 . 1 . . . . . 250 ARG CA . 26347 1 424 . 1 . 1 115 115 ARG CB C 13 31.222 0.3 . 1 . . . . . 250 ARG CB . 26347 1 425 . 1 . 1 115 115 ARG N N 15 123.102 0.05 . 1 . . . . . 250 ARG N . 26347 1 426 . 1 . 1 116 116 ALA H H 1 8.428 0.01 . 1 . . . . . 251 ALA H . 26347 1 427 . 1 . 1 116 116 ALA C C 13 177.911 0.01 . 1 . . . . . 251 ALA C . 26347 1 428 . 1 . 1 116 116 ALA CA C 13 52.713 0.3 . 1 . . . . . 251 ALA CA . 26347 1 429 . 1 . 1 116 116 ALA CB C 13 19.096 0.3 . 1 . . . . . 251 ALA CB . 26347 1 430 . 1 . 1 116 116 ALA N N 15 126.237 0.05 . 1 . . . . . 251 ALA N . 26347 1 431 . 1 . 1 117 117 VAL H H 1 8.029 0.01 . 1 . . . . . 252 VAL H . 26347 1 432 . 1 . 1 117 117 VAL C C 13 176.414 0.01 . 1 . . . . . 252 VAL C . 26347 1 433 . 1 . 1 117 117 VAL CA C 13 62.371 0.3 . 1 . . . . . 252 VAL CA . 26347 1 434 . 1 . 1 117 117 VAL CB C 13 32.706 0.3 . 1 . . . . . 252 VAL CB . 26347 1 435 . 1 . 1 117 117 VAL N N 15 118.114 0.05 . 1 . . . . . 252 VAL N . 26347 1 436 . 1 . 1 118 118 SEP H H 1 8.723 0.01 . 1 . . . . . 253 SEP H . 26347 1 437 . 1 . 1 118 118 SEP CA C 13 58.030 0.3 . 1 . . . . . 253 SEP CA . 26347 1 438 . 1 . 1 118 118 SEP CB C 13 65.565 0.3 . 1 . . . . . 253 SEP CB . 26347 1 439 . 1 . 1 118 118 SEP N N 15 120.319 0.05 . 1 . . . . . 253 SEP N . 26347 1 440 . 1 . 1 119 119 MET H H 1 8.291 0.01 . 1 . . . . . 254 MET H . 26347 1 441 . 1 . 1 119 119 MET C C 13 175.830 0.01 . 1 . . . . . 254 MET C . 26347 1 442 . 1 . 1 119 119 MET CA C 13 55.718 0.3 . 1 . . . . . 254 MET CA . 26347 1 443 . 1 . 1 119 119 MET CB C 13 33.117 0.3 . 1 . . . . . 254 MET CB . 26347 1 444 . 1 . 1 119 119 MET N N 15 121.754 0.05 . 1 . . . . . 254 MET N . 26347 1 445 . 1 . 1 120 120 ASP H H 1 8.279 0.01 . 1 . . . . . 255 ASP H . 26347 1 446 . 1 . 1 120 120 ASP C C 13 176.237 0.01 . 1 . . . . . 255 ASP C . 26347 1 447 . 1 . 1 120 120 ASP CA C 13 54.255 0.3 . 1 . . . . . 255 ASP CA . 26347 1 448 . 1 . 1 120 120 ASP CB C 13 41.159 0.3 . 1 . . . . . 255 ASP CB . 26347 1 449 . 1 . 1 120 120 ASP N N 15 121.202 0.05 . 1 . . . . . 255 ASP N . 26347 1 450 . 1 . 1 121 121 ASN H H 1 8.394 0.01 . 1 . . . . . 256 ASN H . 26347 1 451 . 1 . 1 121 121 ASN C C 13 175.874 0.01 . 1 . . . . . 256 ASN C . 26347 1 452 . 1 . 1 121 121 ASN CA C 13 53.272 0.3 . 1 . . . . . 256 ASN CA . 26347 1 453 . 1 . 1 121 121 ASN CB C 13 38.831 0.3 . 1 . . . . . 256 ASN CB . 26347 1 454 . 1 . 1 121 121 ASN N N 15 120.185 0.05 . 1 . . . . . 256 ASN N . 26347 1 455 . 1 . 1 122 122 SER H H 1 8.387 0.01 . 1 . . . . . 257 SER H . 26347 1 456 . 1 . 1 122 122 SER C C 13 174.853 0.01 . 1 . . . . . 257 SER C . 26347 1 457 . 1 . 1 122 122 SER CA C 13 59.454 0.3 . 1 . . . . . 257 SER CA . 26347 1 458 . 1 . 1 122 122 SER CB C 13 63.529 0.3 . 1 . . . . . 257 SER CB . 26347 1 459 . 1 . 1 122 122 SER N N 15 116.095 0.05 . 1 . . . . . 257 SER N . 26347 1 460 . 1 . 1 123 123 ASN H H 1 8.357 0.01 . 1 . . . . . 258 ASN H . 26347 1 461 . 1 . 1 123 123 ASN C C 13 175.500 0.01 . 1 . . . . . 258 ASN C . 26347 1 462 . 1 . 1 123 123 ASN CA C 13 53.613 0.3 . 1 . . . . . 258 ASN CA . 26347 1 463 . 1 . 1 123 123 ASN CB C 13 38.686 0.3 . 1 . . . . . 258 ASN CB . 26347 1 464 . 1 . 1 123 123 ASN N N 15 120.143 0.05 . 1 . . . . . 258 ASN N . 26347 1 465 . 1 . 1 124 124 LYS H H 1 8.019 0.01 . 1 . . . . . 259 LYS H . 26347 1 466 . 1 . 1 124 124 LYS C C 13 176.655 0.01 . 1 . . . . . 259 LYS C . 26347 1 467 . 1 . 1 124 124 LYS CA C 13 57.213 0.3 . 1 . . . . . 259 LYS CA . 26347 1 468 . 1 . 1 124 124 LYS CB C 13 32.728 0.3 . 1 . . . . . 259 LYS CB . 26347 1 469 . 1 . 1 124 124 LYS N N 15 120.515 0.05 . 1 . . . . . 259 LYS N . 26347 1 470 . 1 . 1 125 125 TYR H H 1 8.085 0.01 . 1 . . . . . 260 TYR H . 26347 1 471 . 1 . 1 125 125 TYR C C 13 176.273 0.01 . 1 . . . . . 260 TYR C . 26347 1 472 . 1 . 1 125 125 TYR CA C 13 57.854 0.3 . 1 . . . . . 260 TYR CA . 26347 1 473 . 1 . 1 125 125 TYR CB C 13 38.485 0.3 . 1 . . . . . 260 TYR CB . 26347 1 474 . 1 . 1 125 125 TYR N N 15 119.473 0.05 . 1 . . . . . 260 TYR N . 26347 1 475 . 1 . 1 126 126 THR H H 1 7.900 0.01 . 1 . . . . . 261 THR H . 26347 1 476 . 1 . 1 126 126 THR C C 13 174.691 0.01 . 1 . . . . . 261 THR C . 26347 1 477 . 1 . 1 126 126 THR CA C 13 62.170 0.3 . 1 . . . . . 261 THR CA . 26347 1 478 . 1 . 1 126 126 THR CB C 13 69.623 0.3 . 1 . . . . . 261 THR CB . 26347 1 479 . 1 . 1 126 126 THR N N 15 115.322 0.05 . 1 . . . . . 261 THR N . 26347 1 480 . 1 . 1 127 127 LYS H H 1 8.217 0.01 . 1 . . . . . 262 LYS H . 26347 1 481 . 1 . 1 127 127 LYS C C 13 176.794 0.01 . 1 . . . . . 262 LYS C . 26347 1 482 . 1 . 1 127 127 LYS CA C 13 56.745 0.3 . 1 . . . . . 262 LYS CA . 26347 1 483 . 1 . 1 127 127 LYS CB C 13 32.749 0.3 . 1 . . . . . 262 LYS CB . 26347 1 484 . 1 . 1 127 127 LYS N N 15 123.221 0.05 . 1 . . . . . 262 LYS N . 26347 1 485 . 1 . 1 128 128 SER H H 1 8.218 0.01 . 1 . . . . . 263 SER H . 26347 1 486 . 1 . 1 128 128 SER C C 13 174.777 0.01 . 1 . . . . . 263 SER C . 26347 1 487 . 1 . 1 128 128 SER CA C 13 58.224 0.3 . 1 . . . . . 263 SER CA . 26347 1 488 . 1 . 1 128 128 SER CB C 13 63.706 0.3 . 1 . . . . . 263 SER CB . 26347 1 489 . 1 . 1 128 128 SER N N 15 116.361 0.05 . 1 . . . . . 263 SER N . 26347 1 490 . 1 . 1 129 129 ARG H H 1 8.330 0.01 . 1 . . . . . 264 ARG H . 26347 1 491 . 1 . 1 129 129 ARG C C 13 176.924 0.01 . 1 . . . . . 264 ARG C . 26347 1 492 . 1 . 1 129 129 ARG CA C 13 56.267 0.3 . 1 . . . . . 264 ARG CA . 26347 1 493 . 1 . 1 129 129 ARG CB C 13 30.651 0.3 . 1 . . . . . 264 ARG CB . 26347 1 494 . 1 . 1 129 129 ARG N N 15 122.985 0.05 . 1 . . . . . 264 ARG N . 26347 1 495 . 1 . 1 130 130 GLY H H 1 8.364 0.01 . 1 . . . . . 265 GLY H . 26347 1 496 . 1 . 1 130 130 GLY C C 13 174.255 0.01 . 1 . . . . . 265 GLY C . 26347 1 497 . 1 . 1 130 130 GLY CA C 13 45.365 0.3 . 1 . . . . . 265 GLY CA . 26347 1 498 . 1 . 1 130 130 GLY N N 15 109.541 0.05 . 1 . . . . . 265 GLY N . 26347 1 499 . 1 . 1 131 131 ARG H H 1 8.194 0.01 . 1 . . . . . 266 ARG H . 26347 1 500 . 1 . 1 131 131 ARG C C 13 176.351 0.01 . 1 . . . . . 266 ARG C . 26347 1 501 . 1 . 1 131 131 ARG CA C 13 56.167 0.3 . 1 . . . . . 266 ARG CA . 26347 1 502 . 1 . 1 131 131 ARG CB C 13 30.962 0.3 . 1 . . . . . 266 ARG CB . 26347 1 503 . 1 . 1 131 131 ARG N N 15 120.874 0.05 . 1 . . . . . 266 ARG N . 26347 1 504 . 1 . 1 132 132 ALA H H 1 8.298 0.01 . 1 . . . . . 267 ALA H . 26347 1 505 . 1 . 1 132 132 ALA C C 13 177.553 0.01 . 1 . . . . . 267 ALA C . 26347 1 506 . 1 . 1 132 132 ALA CA C 13 52.449 0.3 . 1 . . . . . 267 ALA CA . 26347 1 507 . 1 . 1 132 132 ALA CB C 13 19.162 0.3 . 1 . . . . . 267 ALA CB . 26347 1 508 . 1 . 1 132 132 ALA N N 15 124.999 0.05 . 1 . . . . . 267 ALA N . 26347 1 509 . 1 . 1 133 133 ALA H H 1 8.158 0.01 . 1 . . . . . 268 ALA H . 26347 1 510 . 1 . 1 133 133 ALA C C 13 177.847 0.01 . 1 . . . . . 268 ALA C . 26347 1 511 . 1 . 1 133 133 ALA CA C 13 52.391 0.3 . 1 . . . . . 268 ALA CA . 26347 1 512 . 1 . 1 133 133 ALA CB C 13 19.222 0.3 . 1 . . . . . 268 ALA CB . 26347 1 513 . 1 . 1 133 133 ALA N N 15 123.393 0.05 . 1 . . . . . 268 ALA N . 26347 1 514 . 1 . 1 134 134 LYS H H 1 8.183 0.01 . 1 . . . . . 269 LYS H . 26347 1 515 . 1 . 1 134 134 LYS C C 13 176.708 0.01 . 1 . . . . . 269 LYS C . 26347 1 516 . 1 . 1 134 134 LYS CA C 13 56.337 0.3 . 1 . . . . . 269 LYS CA . 26347 1 517 . 1 . 1 134 134 LYS CB C 13 33.059 0.3 . 1 . . . . . 269 LYS CB . 26347 1 518 . 1 . 1 134 134 LYS N N 15 120.761 0.05 . 1 . . . . . 269 LYS N . 26347 1 519 . 1 . 1 135 135 LYS H H 1 8.250 0.01 . 1 . . . . . 270 LYS H . 26347 1 520 . 1 . 1 135 135 LYS C C 13 176.589 0.01 . 1 . . . . . 270 LYS C . 26347 1 521 . 1 . 1 135 135 LYS CA C 13 56.435 0.3 . 1 . . . . . 270 LYS CA . 26347 1 522 . 1 . 1 135 135 LYS CB C 13 33.174 0.3 . 1 . . . . . 270 LYS CB . 26347 1 523 . 1 . 1 135 135 LYS N N 15 122.764 0.05 . 1 . . . . . 270 LYS N . 26347 1 524 . 1 . 1 136 136 LYS H H 1 8.300 0.01 . 1 . . . . . 271 LYS H . 26347 1 525 . 1 . 1 136 136 LYS C C 13 176.349 0.01 . 1 . . . . . 271 LYS C . 26347 1 526 . 1 . 1 136 136 LYS CA C 13 56.446 0.3 . 1 . . . . . 271 LYS CA . 26347 1 527 . 1 . 1 136 136 LYS CB C 13 33.067 0.3 . 1 . . . . . 271 LYS CB . 26347 1 528 . 1 . 1 136 136 LYS N N 15 123.032 0.05 . 1 . . . . . 271 LYS N . 26347 1 529 . 1 . 1 137 137 ALA H H 1 8.265 0.01 . 1 . . . . . 272 ALA H . 26347 1 530 . 1 . 1 137 137 ALA C C 13 177.401 0.01 . 1 . . . . . 272 ALA C . 26347 1 531 . 1 . 1 137 137 ALA CA C 13 52.426 0.3 . 1 . . . . . 272 ALA CA . 26347 1 532 . 1 . 1 137 137 ALA CB C 13 19.220 0.3 . 1 . . . . . 272 ALA CB . 26347 1 533 . 1 . 1 137 137 ALA N N 15 125.461 0.05 . 1 . . . . . 272 ALA N . 26347 1 534 . 1 . 1 138 138 ALA H H 1 8.184 0.01 . 1 . . . . . 273 ALA H . 26347 1 535 . 1 . 1 138 138 ALA C C 13 177.646 0.01 . 1 . . . . . 273 ALA C . 26347 1 536 . 1 . 1 138 138 ALA CA C 13 52.374 0.3 . 1 . . . . . 273 ALA CA . 26347 1 537 . 1 . 1 138 138 ALA CB C 13 19.170 0.3 . 1 . . . . . 273 ALA CB . 26347 1 538 . 1 . 1 138 138 ALA N N 15 123.138 0.05 . 1 . . . . . 273 ALA N . 26347 1 539 . 1 . 1 139 139 LEU H H 1 8.090 0.01 . 1 . . . . . 274 LEU H . 26347 1 540 . 1 . 1 139 139 LEU C C 13 177.352 0.01 . 1 . . . . . 274 LEU C . 26347 1 541 . 1 . 1 139 139 LEU CA C 13 55.184 0.3 . 1 . . . . . 274 LEU CA . 26347 1 542 . 1 . 1 139 139 LEU CB C 13 42.332 0.3 . 1 . . . . . 274 LEU CB . 26347 1 543 . 1 . 1 139 139 LEU N N 15 120.701 0.05 . 1 . . . . . 274 LEU N . 26347 1 544 . 1 . 1 140 140 GLN H H 1 8.318 0.01 . 1 . . . . . 275 GLN H . 26347 1 545 . 1 . 1 140 140 GLN C C 13 175.972 0.01 . 1 . . . . . 275 GLN C . 26347 1 546 . 1 . 1 140 140 GLN CA C 13 55.830 0.3 . 1 . . . . . 275 GLN CA . 26347 1 547 . 1 . 1 140 140 GLN CB C 13 29.491 0.3 . 1 . . . . . 275 GLN CB . 26347 1 548 . 1 . 1 140 140 GLN N N 15 120.857 0.05 . 1 . . . . . 275 GLN N . 26347 1 549 . 1 . 1 141 141 THR H H 1 8.055 0.01 . 1 . . . . . 276 THR H . 26347 1 550 . 1 . 1 141 141 THR C C 13 173.894 0.01 . 1 . . . . . 276 THR C . 26347 1 551 . 1 . 1 141 141 THR CA C 13 61.569 0.3 . 1 . . . . . 276 THR CA . 26347 1 552 . 1 . 1 141 141 THR CB C 13 69.785 0.3 . 1 . . . . . 276 THR CB . 26347 1 553 . 1 . 1 141 141 THR N N 15 114.896 0.05 . 1 . . . . . 276 THR N . 26347 1 554 . 1 . 1 142 142 ALA H H 1 8.233 0.01 . 1 . . . . . 277 ALA H . 26347 1 555 . 1 . 1 142 142 ALA CA C 13 50.610 0.1 . 1 . . . . . 277 ALA CA . 26347 1 556 . 1 . 1 142 142 ALA CB C 13 18.411 0.1 . 1 . . . . . 277 ALA CB . 26347 1 557 . 1 . 1 142 142 ALA N N 15 127.399 0.05 . 1 . . . . . 277 ALA N . 26347 1 558 . 1 . 1 143 143 PRO C C 13 177.131 0.01 . 1 . . . . . 278 PRO C . 26347 1 559 . 1 . 1 143 143 PRO CA C 13 63.195 0.3 . 1 . . . . . 278 PRO CA . 26347 1 560 . 1 . 1 143 143 PRO CB C 13 32.008 0.3 . 1 . . . . . 278 PRO CB . 26347 1 561 . 1 . 1 144 144 GLU H H 1 8.575 0.01 . 1 . . . . . 279 GLU H . 26347 1 562 . 1 . 1 144 144 GLU C C 13 176.566 0.01 . 1 . . . . . 279 GLU C . 26347 1 563 . 1 . 1 144 144 GLU CA C 13 56.841 0.3 . 1 . . . . . 279 GLU CA . 26347 1 564 . 1 . 1 144 144 GLU CB C 13 30.121 0.3 . 1 . . . . . 279 GLU CB . 26347 1 565 . 1 . 1 144 144 GLU N N 15 120.564 0.05 . 1 . . . . . 279 GLU N . 26347 1 566 . 1 . 1 145 145 SER H H 1 8.243 0.01 . 1 . . . . . 280 SER H . 26347 1 567 . 1 . 1 145 145 SER C C 13 174.251 0.01 . 1 . . . . . 280 SER C . 26347 1 568 . 1 . 1 145 145 SER CA C 13 57.953 0.3 . 1 . . . . . 280 SER CA . 26347 1 569 . 1 . 1 145 145 SER CB C 13 63.999 0.3 . 1 . . . . . 280 SER CB . 26347 1 570 . 1 . 1 145 145 SER N N 15 116.352 0.05 . 1 . . . . . 280 SER N . 26347 1 571 . 1 . 1 146 146 ALA H H 1 8.343 0.01 . 1 . . . . . 281 ALA H . 26347 1 572 . 1 . 1 146 146 ALA C C 13 177.399 0.01 . 1 . . . . . 281 ALA C . 26347 1 573 . 1 . 1 146 146 ALA CA C 13 52.523 0.3 . 1 . . . . . 281 ALA CA . 26347 1 574 . 1 . 1 146 146 ALA CB C 13 19.331 0.3 . 1 . . . . . 281 ALA CB . 26347 1 575 . 1 . 1 146 146 ALA N N 15 126.219 0.05 . 1 . . . . . 281 ALA N . 26347 1 576 . 1 . 1 147 147 ASP H H 1 8.229 0.01 . 1 . . . . . 282 ASP H . 26347 1 577 . 1 . 1 147 147 ASP C C 13 175.923 0.01 . 1 . . . . . 282 ASP C . 26347 1 578 . 1 . 1 147 147 ASP CA C 13 54.385 0.3 . 1 . . . . . 282 ASP CA . 26347 1 579 . 1 . 1 147 147 ASP CB C 13 41.218 0.3 . 1 . . . . . 282 ASP CB . 26347 1 580 . 1 . 1 147 147 ASP N N 15 119.400 0.05 . 1 . . . . . 282 ASP N . 26347 1 581 . 1 . 1 148 148 ASP H H 1 8.202 0.01 . 1 . . . . . 283 ASP H . 26347 1 582 . 1 . 1 148 148 ASP C C 13 175.460 0.01 . 1 . . . . . 283 ASP C . 26347 1 583 . 1 . 1 148 148 ASP CA C 13 54.130 0.3 . 1 . . . . . 283 ASP CA . 26347 1 584 . 1 . 1 148 148 ASP CB C 13 41.128 0.3 . 1 . . . . . 283 ASP CB . 26347 1 585 . 1 . 1 148 148 ASP N N 15 121.086 0.05 . 1 . . . . . 283 ASP N . 26347 1 586 . 1 . 1 149 149 SER H H 1 7.858 0.01 . 1 . . . . . 284 SER H . 26347 1 587 . 1 . 1 149 149 SER CA C 13 60.448 0.1 . 1 . . . . . 284 SER CA . 26347 1 588 . 1 . 1 149 149 SER CB C 13 64.956 0.1 . 1 . . . . . 284 SER CB . 26347 1 589 . 1 . 1 149 149 SER N N 15 121.191 0.05 . 1 . . . . . 284 SER N . 26347 1 stop_ save_