data_50229 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50229 _Entry.Title ; 1H, 13C and 15N resonance assignments for the microtubule-binding region of the kinetoplastid kinetochore protein KKT4 115-343 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-04-09 _Entry.Accession_date 2020-04-09 _Entry.Last_release_date 2020-04-09 _Entry.Original_release_date 2020-04-09 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details '1H, 13C and 15N resonance assignments for the microtubule-binding region of the kinetoplastid kinetochore protein KKT4 115-343' _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 Patryk Ludzia . . . 0000-0002-1678-6875 50229 2 Bungo Akiyoshi . . . 0000-0001-6010-394X 50229 3 Christina Redfield . . . 0000-0001-7297-7708 50229 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Oxford, Department of Biochemistry' . 50229 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50229 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 393 50229 '15N chemical shifts' 134 50229 '1H chemical shifts' 523 50229 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 . . 2020-11-18 2020-04-09 update BMRB 'update entry citation' 50229 1 . . 2020-07-24 2020-04-09 original author 'original release' 50229 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50215 'kinetoplastid kinetochore protein KKT4 115-174' 50229 BMRB 50228 'kinetoplastid kinetochore protein KKT4 145-232' 50229 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50229 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32696260 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1 H, 13 C and 15 N resonance assignments for the microtubule-binding domain of the kinetoplastid kinetochore protein KKT4 from Trypanosoma brucei ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 309 _Citation.Page_last 315 _Citation.Year 2020 _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 Patryk Ludzia . . . . 50229 1 2 Bungo Akiyoshi . . . . 50229 1 3 Christina Redfield . . . . 50229 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID KKT4 50229 1 'NMR resonance assignments' 50229 1 Trypanosome 50229 1 kinetochore 50229 1 kinetoplastid 50229 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50229 _Assembly.ID 1 _Assembly.Name KKT4_115_343 _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 51403.14 _Assembly.Enzyme_commission_number . _Assembly.Details '51403.14 is molecular mass of a dimer' _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 'KKT4 115-343' 1 $entity_1 . . yes native no no . . . 50229 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'kinetochore protein' 50229 1 microtubule-binding 50229 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50229 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; SMKYGVVSVERYERLMARYK ELEKQSHRRQGKRSEPVVDT QRVLDLEEEVARLKRTIGHL QGVVEEKESALEKHATQHNL EVHEMKKNYELKIKSLTQTH EAAVRKLVSAQELVTAARNY QTAVCANNVGGGNSVSTTSG QPLSNTVNHTRGLTTTSSGS GPNQPYTLPHPDGNAWMSAT TSDDRSAPVTTKNSHSVKRE REGTVSTTPTRPLKKRNPRT PSYTVADRISE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 115K 116Y 117G ; _Entity.Polymer_author_seq_details 'Residues 1-2 (113S, 114M) represent part of a linker that remained after TEV protease cleavage.' _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 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 25701.57 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UniProt A0A3L6L4L8 . KKT4 . . . . . . . . . . . . . . 50229 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'kinetoplastid kinetochore protein' 50229 1 microtubule-binding 50229 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 113 SER . 50229 1 2 114 MET . 50229 1 3 115 LYS . 50229 1 4 116 TYR . 50229 1 5 117 GLY . 50229 1 6 118 VAL . 50229 1 7 119 VAL . 50229 1 8 120 SER . 50229 1 9 121 VAL . 50229 1 10 122 GLU . 50229 1 11 123 ARG . 50229 1 12 124 TYR . 50229 1 13 125 GLU . 50229 1 14 126 ARG . 50229 1 15 127 LEU . 50229 1 16 128 MET . 50229 1 17 129 ALA . 50229 1 18 130 ARG . 50229 1 19 131 TYR . 50229 1 20 132 LYS . 50229 1 21 133 GLU . 50229 1 22 134 LEU . 50229 1 23 135 GLU . 50229 1 24 136 LYS . 50229 1 25 137 GLN . 50229 1 26 138 SER . 50229 1 27 139 HIS . 50229 1 28 140 ARG . 50229 1 29 141 ARG . 50229 1 30 142 GLN . 50229 1 31 143 GLY . 50229 1 32 144 LYS . 50229 1 33 145 ARG . 50229 1 34 146 SER . 50229 1 35 147 GLU . 50229 1 36 148 PRO . 50229 1 37 149 VAL . 50229 1 38 150 VAL . 50229 1 39 151 ASP . 50229 1 40 152 THR . 50229 1 41 153 GLN . 50229 1 42 154 ARG . 50229 1 43 155 VAL . 50229 1 44 156 LEU . 50229 1 45 157 ASP . 50229 1 46 158 LEU . 50229 1 47 159 GLU . 50229 1 48 160 GLU . 50229 1 49 161 GLU . 50229 1 50 162 VAL . 50229 1 51 163 ALA . 50229 1 52 164 ARG . 50229 1 53 165 LEU . 50229 1 54 166 LYS . 50229 1 55 167 ARG . 50229 1 56 168 THR . 50229 1 57 169 ILE . 50229 1 58 170 GLY . 50229 1 59 171 HIS . 50229 1 60 172 LEU . 50229 1 61 173 GLN . 50229 1 62 174 GLY . 50229 1 63 175 VAL . 50229 1 64 176 VAL . 50229 1 65 177 GLU . 50229 1 66 178 GLU . 50229 1 67 179 LYS . 50229 1 68 180 GLU . 50229 1 69 181 SER . 50229 1 70 182 ALA . 50229 1 71 183 LEU . 50229 1 72 184 GLU . 50229 1 73 185 LYS . 50229 1 74 186 HIS . 50229 1 75 187 ALA . 50229 1 76 188 THR . 50229 1 77 189 GLN . 50229 1 78 190 HIS . 50229 1 79 191 ASN . 50229 1 80 192 LEU . 50229 1 81 193 GLU . 50229 1 82 194 VAL . 50229 1 83 195 HIS . 50229 1 84 196 GLU . 50229 1 85 197 MET . 50229 1 86 198 LYS . 50229 1 87 199 LYS . 50229 1 88 200 ASN . 50229 1 89 201 TYR . 50229 1 90 202 GLU . 50229 1 91 203 LEU . 50229 1 92 204 LYS . 50229 1 93 205 ILE . 50229 1 94 206 LYS . 50229 1 95 207 SER . 50229 1 96 208 LEU . 50229 1 97 209 THR . 50229 1 98 210 GLN . 50229 1 99 211 THR . 50229 1 100 212 HIS . 50229 1 101 213 GLU . 50229 1 102 214 ALA . 50229 1 103 215 ALA . 50229 1 104 216 VAL . 50229 1 105 217 ARG . 50229 1 106 218 LYS . 50229 1 107 219 LEU . 50229 1 108 220 VAL . 50229 1 109 221 SER . 50229 1 110 222 ALA . 50229 1 111 223 GLN . 50229 1 112 224 GLU . 50229 1 113 225 LEU . 50229 1 114 226 VAL . 50229 1 115 227 THR . 50229 1 116 228 ALA . 50229 1 117 229 ALA . 50229 1 118 230 ARG . 50229 1 119 231 ASN . 50229 1 120 232 TYR . 50229 1 121 233 GLN . 50229 1 122 234 THR . 50229 1 123 235 ALA . 50229 1 124 236 VAL . 50229 1 125 237 CYS . 50229 1 126 238 ALA . 50229 1 127 239 ASN . 50229 1 128 240 ASN . 50229 1 129 241 VAL . 50229 1 130 242 GLY . 50229 1 131 243 GLY . 50229 1 132 244 GLY . 50229 1 133 245 ASN . 50229 1 134 246 SER . 50229 1 135 247 VAL . 50229 1 136 248 SER . 50229 1 137 249 THR . 50229 1 138 250 THR . 50229 1 139 251 SER . 50229 1 140 252 GLY . 50229 1 141 253 GLN . 50229 1 142 254 PRO . 50229 1 143 255 LEU . 50229 1 144 256 SER . 50229 1 145 257 ASN . 50229 1 146 258 THR . 50229 1 147 259 VAL . 50229 1 148 260 ASN . 50229 1 149 261 HIS . 50229 1 150 262 THR . 50229 1 151 263 ARG . 50229 1 152 264 GLY . 50229 1 153 265 LEU . 50229 1 154 266 THR . 50229 1 155 267 THR . 50229 1 156 268 THR . 50229 1 157 269 SER . 50229 1 158 270 SER . 50229 1 159 271 GLY . 50229 1 160 272 SER . 50229 1 161 273 GLY . 50229 1 162 274 PRO . 50229 1 163 275 ASN . 50229 1 164 276 GLN . 50229 1 165 277 PRO . 50229 1 166 278 TYR . 50229 1 167 279 THR . 50229 1 168 280 LEU . 50229 1 169 281 PRO . 50229 1 170 282 HIS . 50229 1 171 283 PRO . 50229 1 172 284 ASP . 50229 1 173 285 GLY . 50229 1 174 286 ASN . 50229 1 175 287 ALA . 50229 1 176 288 TRP . 50229 1 177 289 MET . 50229 1 178 290 SER . 50229 1 179 291 ALA . 50229 1 180 292 THR . 50229 1 181 293 THR . 50229 1 182 294 SER . 50229 1 183 295 ASP . 50229 1 184 296 ASP . 50229 1 185 297 ARG . 50229 1 186 298 SER . 50229 1 187 299 ALA . 50229 1 188 300 PRO . 50229 1 189 301 VAL . 50229 1 190 302 THR . 50229 1 191 303 THR . 50229 1 192 304 LYS . 50229 1 193 305 ASN . 50229 1 194 306 SER . 50229 1 195 307 HIS . 50229 1 196 308 SER . 50229 1 197 309 VAL . 50229 1 198 310 LYS . 50229 1 199 311 ARG . 50229 1 200 312 GLU . 50229 1 201 313 ARG . 50229 1 202 314 GLU . 50229 1 203 315 GLY . 50229 1 204 316 THR . 50229 1 205 317 VAL . 50229 1 206 318 SER . 50229 1 207 319 THR . 50229 1 208 320 THR . 50229 1 209 321 PRO . 50229 1 210 322 THR . 50229 1 211 323 ARG . 50229 1 212 324 PRO . 50229 1 213 325 LEU . 50229 1 214 326 LYS . 50229 1 215 327 LYS . 50229 1 216 328 ARG . 50229 1 217 329 ASN . 50229 1 218 330 PRO . 50229 1 219 331 ARG . 50229 1 220 332 THR . 50229 1 221 333 PRO . 50229 1 222 334 SER . 50229 1 223 335 TYR . 50229 1 224 336 THR . 50229 1 225 337 VAL . 50229 1 226 338 ALA . 50229 1 227 339 ASP . 50229 1 228 340 ARG . 50229 1 229 341 ILE . 50229 1 230 342 SER . 50229 1 231 343 GLU . 50229 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 . SER 1 1 50229 1 . MET 2 2 50229 1 . LYS 3 3 50229 1 . TYR 4 4 50229 1 . GLY 5 5 50229 1 . VAL 6 6 50229 1 . VAL 7 7 50229 1 . SER 8 8 50229 1 . VAL 9 9 50229 1 . GLU 10 10 50229 1 . ARG 11 11 50229 1 . TYR 12 12 50229 1 . GLU 13 13 50229 1 . ARG 14 14 50229 1 . LEU 15 15 50229 1 . MET 16 16 50229 1 . ALA 17 17 50229 1 . ARG 18 18 50229 1 . TYR 19 19 50229 1 . LYS 20 20 50229 1 . GLU 21 21 50229 1 . LEU 22 22 50229 1 . GLU 23 23 50229 1 . LYS 24 24 50229 1 . GLN 25 25 50229 1 . SER 26 26 50229 1 . HIS 27 27 50229 1 . ARG 28 28 50229 1 . ARG 29 29 50229 1 . GLN 30 30 50229 1 . GLY 31 31 50229 1 . LYS 32 32 50229 1 . ARG 33 33 50229 1 . SER 34 34 50229 1 . GLU 35 35 50229 1 . PRO 36 36 50229 1 . VAL 37 37 50229 1 . VAL 38 38 50229 1 . ASP 39 39 50229 1 . THR 40 40 50229 1 . GLN 41 41 50229 1 . ARG 42 42 50229 1 . VAL 43 43 50229 1 . LEU 44 44 50229 1 . ASP 45 45 50229 1 . LEU 46 46 50229 1 . GLU 47 47 50229 1 . GLU 48 48 50229 1 . GLU 49 49 50229 1 . VAL 50 50 50229 1 . ALA 51 51 50229 1 . ARG 52 52 50229 1 . LEU 53 53 50229 1 . LYS 54 54 50229 1 . ARG 55 55 50229 1 . THR 56 56 50229 1 . ILE 57 57 50229 1 . GLY 58 58 50229 1 . HIS 59 59 50229 1 . LEU 60 60 50229 1 . GLN 61 61 50229 1 . GLY 62 62 50229 1 . VAL 63 63 50229 1 . VAL 64 64 50229 1 . GLU 65 65 50229 1 . GLU 66 66 50229 1 . LYS 67 67 50229 1 . GLU 68 68 50229 1 . SER 69 69 50229 1 . ALA 70 70 50229 1 . LEU 71 71 50229 1 . GLU 72 72 50229 1 . LYS 73 73 50229 1 . HIS 74 74 50229 1 . ALA 75 75 50229 1 . THR 76 76 50229 1 . GLN 77 77 50229 1 . HIS 78 78 50229 1 . ASN 79 79 50229 1 . LEU 80 80 50229 1 . GLU 81 81 50229 1 . VAL 82 82 50229 1 . HIS 83 83 50229 1 . GLU 84 84 50229 1 . MET 85 85 50229 1 . LYS 86 86 50229 1 . LYS 87 87 50229 1 . ASN 88 88 50229 1 . TYR 89 89 50229 1 . GLU 90 90 50229 1 . LEU 91 91 50229 1 . LYS 92 92 50229 1 . ILE 93 93 50229 1 . LYS 94 94 50229 1 . SER 95 95 50229 1 . LEU 96 96 50229 1 . THR 97 97 50229 1 . GLN 98 98 50229 1 . THR 99 99 50229 1 . HIS 100 100 50229 1 . GLU 101 101 50229 1 . ALA 102 102 50229 1 . ALA 103 103 50229 1 . VAL 104 104 50229 1 . ARG 105 105 50229 1 . LYS 106 106 50229 1 . LEU 107 107 50229 1 . VAL 108 108 50229 1 . SER 109 109 50229 1 . ALA 110 110 50229 1 . GLN 111 111 50229 1 . GLU 112 112 50229 1 . LEU 113 113 50229 1 . VAL 114 114 50229 1 . THR 115 115 50229 1 . ALA 116 116 50229 1 . ALA 117 117 50229 1 . ARG 118 118 50229 1 . ASN 119 119 50229 1 . TYR 120 120 50229 1 . GLN 121 121 50229 1 . THR 122 122 50229 1 . ALA 123 123 50229 1 . VAL 124 124 50229 1 . CYS 125 125 50229 1 . ALA 126 126 50229 1 . ASN 127 127 50229 1 . ASN 128 128 50229 1 . VAL 129 129 50229 1 . GLY 130 130 50229 1 . GLY 131 131 50229 1 . GLY 132 132 50229 1 . ASN 133 133 50229 1 . SER 134 134 50229 1 . VAL 135 135 50229 1 . SER 136 136 50229 1 . THR 137 137 50229 1 . THR 138 138 50229 1 . SER 139 139 50229 1 . GLY 140 140 50229 1 . GLN 141 141 50229 1 . PRO 142 142 50229 1 . LEU 143 143 50229 1 . SER 144 144 50229 1 . ASN 145 145 50229 1 . THR 146 146 50229 1 . VAL 147 147 50229 1 . ASN 148 148 50229 1 . HIS 149 149 50229 1 . THR 150 150 50229 1 . ARG 151 151 50229 1 . GLY 152 152 50229 1 . LEU 153 153 50229 1 . THR 154 154 50229 1 . THR 155 155 50229 1 . THR 156 156 50229 1 . SER 157 157 50229 1 . SER 158 158 50229 1 . GLY 159 159 50229 1 . SER 160 160 50229 1 . GLY 161 161 50229 1 . PRO 162 162 50229 1 . ASN 163 163 50229 1 . GLN 164 164 50229 1 . PRO 165 165 50229 1 . TYR 166 166 50229 1 . THR 167 167 50229 1 . LEU 168 168 50229 1 . PRO 169 169 50229 1 . HIS 170 170 50229 1 . PRO 171 171 50229 1 . ASP 172 172 50229 1 . GLY 173 173 50229 1 . ASN 174 174 50229 1 . ALA 175 175 50229 1 . TRP 176 176 50229 1 . MET 177 177 50229 1 . SER 178 178 50229 1 . ALA 179 179 50229 1 . THR 180 180 50229 1 . THR 181 181 50229 1 . SER 182 182 50229 1 . ASP 183 183 50229 1 . ASP 184 184 50229 1 . ARG 185 185 50229 1 . SER 186 186 50229 1 . ALA 187 187 50229 1 . PRO 188 188 50229 1 . VAL 189 189 50229 1 . THR 190 190 50229 1 . THR 191 191 50229 1 . LYS 192 192 50229 1 . ASN 193 193 50229 1 . SER 194 194 50229 1 . HIS 195 195 50229 1 . SER 196 196 50229 1 . VAL 197 197 50229 1 . LYS 198 198 50229 1 . ARG 199 199 50229 1 . GLU 200 200 50229 1 . ARG 201 201 50229 1 . GLU 202 202 50229 1 . GLY 203 203 50229 1 . THR 204 204 50229 1 . VAL 205 205 50229 1 . SER 206 206 50229 1 . THR 207 207 50229 1 . THR 208 208 50229 1 . PRO 209 209 50229 1 . THR 210 210 50229 1 . ARG 211 211 50229 1 . PRO 212 212 50229 1 . LEU 213 213 50229 1 . LYS 214 214 50229 1 . LYS 215 215 50229 1 . ARG 216 216 50229 1 . ASN 217 217 50229 1 . PRO 218 218 50229 1 . ARG 219 219 50229 1 . THR 220 220 50229 1 . PRO 221 221 50229 1 . SER 222 222 50229 1 . TYR 223 223 50229 1 . THR 224 224 50229 1 . VAL 225 225 50229 1 . ALA 226 226 50229 1 . ASP 227 227 50229 1 . ARG 228 228 50229 1 . ILE 229 229 50229 1 . SER 230 230 50229 1 . GLU 231 231 50229 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 50229 _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 . 5691 organism . 'Trypanosoma brucei brucei' 'Trypanosoma brucei brucei' . . Eukaryota . Trypanosoma brucei TREU927 . . . . . . . . . . Tb927.8.3680 . 50229 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 50229 _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' . . . Escherichia coli BL21(DE3) . . plasmid . . pRSF_Duet-1 . . . 50229 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50229 _Sample.ID 1 _Sample.Name 13C/15N-KKT4_115_343 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 KKT4_115_343 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.35 . . mM 0.02 . . . 50229 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM 0 . . . 50229 1 3 HEPES 'natural abundance' . . . . . . 25 . . mM 0 . . . 50229 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM 0 . . . 50229 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 50229 _Sample.ID 2 _Sample.Name 15N-KKT4_115_343 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '95% H2O/5% 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 KKT4_115_343 [U-15N] . . 1 $entity_1 . . 0.35 . . mM 0.02 . . . 50229 2 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM 0 . . . 50229 2 3 HEPES 'natural abundance' . . . . . . 25 . . mM 0 . . . 50229 2 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM 0 . . . 50229 2 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 50229 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_conditions_set1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 50229 1 pH 7.2 0.1 pH 50229 1 pressure 1 . atm 50229 1 temperature 293.15 0.5 K 50229 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50229 _Software.ID 1 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 50229 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50229 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version 9.7 _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 50229 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50229 _Software.ID 3 _Software.Type . _Software.Name hmsIST _Software.Version v211_64b _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 50229 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 50229 _Software.ID 4 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 50229 4 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 50229 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 750 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 50229 _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 '3D BT HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 4 '3D CBCANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 7 '3D (H)CC(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 8 '3D (H)N(CA)NNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 9 '3D (H)N(COCA)NNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 10 '2D BEST TROSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 11 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 12 '2D BEST TROSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 13 HCA(CO)N no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 14 HCAN no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 1 15 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50229 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 50229 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _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 carbons' . . . . ppm 0.0 internal direct 1 . . . . . 50229 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 50229 1 N 15 na 'methyl protons' . . . . ppm 0.0 na indirect 0.101329118 . . . . . 50229 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 50229 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name assigned_chem_shift_list_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 $chem_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 '3D BT HNCA' . . . 50229 1 2 '3D 1H-15N TOCSY' . . . 50229 1 3 '3D CBCA(CO)NH' . . . 50229 1 4 '3D CBCANH' . . . 50229 1 5 '3D HNCO' . . . 50229 1 6 '3D HN(CA)CO' . . . 50229 1 7 '3D (H)CC(CO)NH' . . . 50229 1 8 '3D (H)N(CA)NNH' . . . 50229 1 9 '3D (H)N(COCA)NNH' . . . 50229 1 10 '2D BEST TROSY' . . . 50229 1 11 '3D HBHA(CO)NH' . . . 50229 1 12 '2D BEST TROSY' . . . 50229 1 13 HCA(CO)N . . . 50229 1 14 HCAN . . . 50229 1 15 '2D 1H-13C HSQC' . . . 50229 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 . . 50229 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 MET CA C 13 55.476 0.000 . 1 . . . . . 114 MET CA . 50229 1 2 . 1 . 1 2 2 MET CB C 13 32.893 0.000 . 1 . . . . . 114 MET CB . 50229 1 3 . 1 . 1 3 3 LYS H H 1 8.341 0.003 . 1 . . . . . 115 LYS H . 50229 1 4 . 1 . 1 3 3 LYS HA H 1 4.207 0.001 . 1 . . . . . 115 LYS HA . 50229 1 5 . 1 . 1 3 3 LYS HB2 H 1 1.608 0.007 . 1 . . . . . 115 LYS HB2 . 50229 1 6 . 1 . 1 3 3 LYS C C 13 175.969 0.000 . 1 . . . . . 115 LYS C . 50229 1 7 . 1 . 1 3 3 LYS CA C 13 56.551 0.027 . 1 . . . . . 115 LYS CA . 50229 1 8 . 1 . 1 3 3 LYS CB C 13 33.193 0.039 . 1 . . . . . 115 LYS CB . 50229 1 9 . 1 . 1 3 3 LYS CG C 13 24.617 0.000 . 1 . . . . . 115 LYS CG . 50229 1 10 . 1 . 1 3 3 LYS N N 15 122.937 0.049 . 1 . . . . . 115 LYS N . 50229 1 11 . 1 . 1 4 4 TYR H H 1 8.174 0.008 . 1 . . . . . 116 TYR H . 50229 1 12 . 1 . 1 4 4 TYR C C 13 176.089 0.000 . 1 . . . . . 116 TYR C . 50229 1 13 . 1 . 1 4 4 TYR CA C 13 57.752 0.000 . 1 . . . . . 116 TYR CA . 50229 1 14 . 1 . 1 4 4 TYR CB C 13 38.935 0.000 . 1 . . . . . 116 TYR CB . 50229 1 15 . 1 . 1 4 4 TYR N N 15 120.255 0.035 . 1 . . . . . 116 TYR N . 50229 1 16 . 1 . 1 5 5 GLY H H 1 8.373 0.002 . 1 . . . . . 117 GLY H . 50229 1 17 . 1 . 1 5 5 GLY C C 13 174.177 0.000 . 1 . . . . . 117 GLY C . 50229 1 18 . 1 . 1 5 5 GLY N N 15 109.762 0.018 . 1 . . . . . 117 GLY N . 50229 1 19 . 1 . 1 6 6 VAL H H 1 8.012 0.005 . 1 . . . . . 118 VAL H . 50229 1 20 . 1 . 1 6 6 VAL HG11 H 1 0.737 0.000 . 2 . . . . . 118 VAL HG11 . 50229 1 21 . 1 . 1 6 6 VAL HG12 H 1 0.737 0.000 . 2 . . . . . 118 VAL HG12 . 50229 1 22 . 1 . 1 6 6 VAL HG13 H 1 0.737 0.000 . 2 . . . . . 118 VAL HG13 . 50229 1 23 . 1 . 1 6 6 VAL HG21 H 1 0.812 0.000 . 2 . . . . . 118 VAL HG21 . 50229 1 24 . 1 . 1 6 6 VAL HG22 H 1 0.812 0.000 . 2 . . . . . 118 VAL HG22 . 50229 1 25 . 1 . 1 6 6 VAL HG23 H 1 0.812 0.000 . 2 . . . . . 118 VAL HG23 . 50229 1 26 . 1 . 1 6 6 VAL C C 13 174.966 0.000 . 1 . . . . . 118 VAL C . 50229 1 27 . 1 . 1 6 6 VAL CA C 13 59.640 0.000 . 1 . . . . . 118 VAL CA . 50229 1 28 . 1 . 1 6 6 VAL CG1 C 13 18.061 0.000 . 2 . . . . . 118 VAL CG1 . 50229 1 29 . 1 . 1 6 6 VAL CG2 C 13 21.842 0.000 . 2 . . . . . 118 VAL CG2 . 50229 1 30 . 1 . 1 6 6 VAL N N 15 114.391 0.011 . 1 . . . . . 118 VAL N . 50229 1 31 . 1 . 1 7 7 VAL H H 1 8.992 0.004 . 1 . . . . . 119 VAL H . 50229 1 32 . 1 . 1 7 7 VAL HG11 H 1 0.542 0.000 . 2 . . . . . 119 VAL HG11 . 50229 1 33 . 1 . 1 7 7 VAL HG12 H 1 0.542 0.000 . 2 . . . . . 119 VAL HG12 . 50229 1 34 . 1 . 1 7 7 VAL HG13 H 1 0.542 0.000 . 2 . . . . . 119 VAL HG13 . 50229 1 35 . 1 . 1 7 7 VAL HG21 H 1 0.574 0.000 . 2 . . . . . 119 VAL HG21 . 50229 1 36 . 1 . 1 7 7 VAL HG22 H 1 0.574 0.000 . 2 . . . . . 119 VAL HG22 . 50229 1 37 . 1 . 1 7 7 VAL HG23 H 1 0.574 0.000 . 2 . . . . . 119 VAL HG23 . 50229 1 38 . 1 . 1 7 7 VAL CG1 C 13 20.996 0.000 . 2 . . . . . 119 VAL CG1 . 50229 1 39 . 1 . 1 7 7 VAL CG2 C 13 19.849 0.000 . 2 . . . . . 119 VAL CG2 . 50229 1 40 . 1 . 1 7 7 VAL N N 15 118.136 0.035 . 1 . . . . . 119 VAL N . 50229 1 41 . 1 . 1 8 8 SER H H 1 8.524 0.004 . 1 . . . . . 120 SER H . 50229 1 42 . 1 . 1 8 8 SER CA C 13 58.247 0.000 . 1 . . . . . 120 SER CA . 50229 1 43 . 1 . 1 8 8 SER N N 15 119.119 0.032 . 1 . . . . . 120 SER N . 50229 1 44 . 1 . 1 9 9 VAL H H 1 8.407 0.006 . 1 . . . . . 121 VAL H . 50229 1 45 . 1 . 1 9 9 VAL N N 15 123.282 0.059 . 1 . . . . . 121 VAL N . 50229 1 46 . 1 . 1 10 10 GLU H H 1 8.595 0.004 . 1 . . . . . 122 GLU H . 50229 1 47 . 1 . 1 10 10 GLU N N 15 120.324 0.019 . 1 . . . . . 122 GLU N . 50229 1 48 . 1 . 1 11 11 ARG H H 1 7.794 0.004 . 1 . . . . . 123 ARG H . 50229 1 49 . 1 . 1 11 11 ARG N N 15 120.017 0.022 . 1 . . . . . 123 ARG N . 50229 1 50 . 1 . 1 12 12 TYR H H 1 7.950 0.003 . 1 . . . . . 124 TYR H . 50229 1 51 . 1 . 1 12 12 TYR N N 15 121.760 0.019 . 1 . . . . . 124 TYR N . 50229 1 52 . 1 . 1 13 13 GLU H H 1 9.381 0.002 . 1 . . . . . 125 GLU H . 50229 1 53 . 1 . 1 13 13 GLU N N 15 118.345 0.014 . 1 . . . . . 125 GLU N . 50229 1 54 . 1 . 1 15 15 LEU H H 1 7.430 0.004 . 1 . . . . . 127 LEU H . 50229 1 55 . 1 . 1 15 15 LEU HD11 H 1 0.355 0.000 . 2 . . . . . 127 LEU HD11 . 50229 1 56 . 1 . 1 15 15 LEU HD12 H 1 0.355 0.000 . 2 . . . . . 127 LEU HD12 . 50229 1 57 . 1 . 1 15 15 LEU HD13 H 1 0.355 0.000 . 2 . . . . . 127 LEU HD13 . 50229 1 58 . 1 . 1 15 15 LEU HD21 H 1 0.514 0.000 . 2 . . . . . 127 LEU HD21 . 50229 1 59 . 1 . 1 15 15 LEU HD22 H 1 0.514 0.000 . 2 . . . . . 127 LEU HD22 . 50229 1 60 . 1 . 1 15 15 LEU HD23 H 1 0.514 0.000 . 2 . . . . . 127 LEU HD23 . 50229 1 61 . 1 . 1 15 15 LEU CD1 C 13 26.246 0.000 . 2 . . . . . 127 LEU CD1 . 50229 1 62 . 1 . 1 15 15 LEU CD2 C 13 21.839 0.000 . 2 . . . . . 127 LEU CD2 . 50229 1 63 . 1 . 1 15 15 LEU N N 15 121.938 0.008 . 1 . . . . . 127 LEU N . 50229 1 64 . 1 . 1 16 16 MET H H 1 8.568 0.005 . 1 . . . . . 128 MET H . 50229 1 65 . 1 . 1 16 16 MET N N 15 119.886 0.011 . 1 . . . . . 128 MET N . 50229 1 66 . 1 . 1 18 18 ARG H H 1 7.756 0.002 . 1 . . . . . 130 ARG H . 50229 1 67 . 1 . 1 18 18 ARG N N 15 119.492 0.012 . 1 . . . . . 130 ARG N . 50229 1 68 . 1 . 1 19 19 TYR H H 1 9.067 0.004 . 1 . . . . . 131 TYR H . 50229 1 69 . 1 . 1 19 19 TYR N N 15 122.960 0.005 . 1 . . . . . 131 TYR N . 50229 1 70 . 1 . 1 20 20 LYS H H 1 8.822 0.004 . 1 . . . . . 132 LYS H . 50229 1 71 . 1 . 1 20 20 LYS N N 15 118.573 0.024 . 1 . . . . . 132 LYS N . 50229 1 72 . 1 . 1 21 21 GLU H H 1 7.799 0.003 . 1 . . . . . 133 GLU H . 50229 1 73 . 1 . 1 21 21 GLU CA C 13 59.117 0.000 . 1 . . . . . 133 GLU CA . 50229 1 74 . 1 . 1 21 21 GLU N N 15 119.390 0.044 . 1 . . . . . 133 GLU N . 50229 1 75 . 1 . 1 22 22 LEU H H 1 7.828 0.002 . 1 . . . . . 134 LEU H . 50229 1 76 . 1 . 1 22 22 LEU HD11 H 1 0.480 0.000 . 2 . . . . . 134 LEU HD11 . 50229 1 77 . 1 . 1 22 22 LEU HD12 H 1 0.480 0.000 . 2 . . . . . 134 LEU HD12 . 50229 1 78 . 1 . 1 22 22 LEU HD13 H 1 0.480 0.000 . 2 . . . . . 134 LEU HD13 . 50229 1 79 . 1 . 1 22 22 LEU HD21 H 1 0.747 0.000 . 2 . . . . . 134 LEU HD21 . 50229 1 80 . 1 . 1 22 22 LEU HD22 H 1 0.747 0.000 . 2 . . . . . 134 LEU HD22 . 50229 1 81 . 1 . 1 22 22 LEU HD23 H 1 0.747 0.000 . 2 . . . . . 134 LEU HD23 . 50229 1 82 . 1 . 1 22 22 LEU CD1 C 13 25.104 0.000 . 2 . . . . . 134 LEU CD1 . 50229 1 83 . 1 . 1 22 22 LEU CD2 C 13 23.885 0.000 . 2 . . . . . 134 LEU CD2 . 50229 1 84 . 1 . 1 22 22 LEU N N 15 121.429 0.018 . 1 . . . . . 134 LEU N . 50229 1 85 . 1 . 1 23 23 GLU H H 1 8.687 0.002 . 1 . . . . . 135 GLU H . 50229 1 86 . 1 . 1 23 23 GLU N N 15 121.979 0.019 . 1 . . . . . 135 GLU N . 50229 1 87 . 1 . 1 24 24 LYS H H 1 7.745 0.004 . 1 . . . . . 136 LYS H . 50229 1 88 . 1 . 1 24 24 LYS N N 15 118.893 0.015 . 1 . . . . . 136 LYS N . 50229 1 89 . 1 . 1 25 25 GLN H H 1 7.838 0.003 . 1 . . . . . 137 GLN H . 50229 1 90 . 1 . 1 25 25 GLN CA C 13 57.645 0.000 . 1 . . . . . 137 GLN CA . 50229 1 91 . 1 . 1 25 25 GLN N N 15 117.675 0.011 . 1 . . . . . 137 GLN N . 50229 1 92 . 1 . 1 26 26 SER H H 1 8.006 0.002 . 1 . . . . . 138 SER H . 50229 1 93 . 1 . 1 26 26 SER CA C 13 60.318 0.000 . 1 . . . . . 138 SER CA . 50229 1 94 . 1 . 1 26 26 SER N N 15 115.061 0.016 . 1 . . . . . 138 SER N . 50229 1 95 . 1 . 1 27 27 HIS H H 1 7.856 0.002 . 1 . . . . . 139 HIS H . 50229 1 96 . 1 . 1 27 27 HIS C C 13 176.260 0.000 . 1 . . . . . 139 HIS C . 50229 1 97 . 1 . 1 27 27 HIS N N 15 120.550 0.022 . 1 . . . . . 139 HIS N . 50229 1 98 . 1 . 1 28 28 ARG H H 1 7.938 0.004 . 1 . . . . . 140 ARG H . 50229 1 99 . 1 . 1 28 28 ARG C C 13 176.801 0.000 . 1 . . . . . 140 ARG C . 50229 1 100 . 1 . 1 28 28 ARG CA C 13 56.916 0.000 . 1 . . . . . 140 ARG CA . 50229 1 101 . 1 . 1 28 28 ARG N N 15 120.599 0.030 . 1 . . . . . 140 ARG N . 50229 1 102 . 1 . 1 29 29 ARG H H 1 8.254 0.004 . 1 . . . . . 141 ARG H . 50229 1 103 . 1 . 1 29 29 ARG N N 15 121.243 0.030 . 1 . . . . . 141 ARG N . 50229 1 104 . 1 . 1 30 30 GLN H H 1 8.321 0.008 . 1 . . . . . 142 GLN H . 50229 1 105 . 1 . 1 30 30 GLN N N 15 120.714 0.034 . 1 . . . . . 142 GLN N . 50229 1 106 . 1 . 1 31 31 GLY H H 1 8.383 0.008 . 1 . . . . . 143 GLY H . 50229 1 107 . 1 . 1 31 31 GLY N N 15 109.974 0.036 . 1 . . . . . 143 GLY N . 50229 1 108 . 1 . 1 32 32 LYS H H 1 8.210 0.005 . 1 . . . . . 144 LYS H . 50229 1 109 . 1 . 1 32 32 LYS N N 15 121.051 0.029 . 1 . . . . . 144 LYS N . 50229 1 110 . 1 . 1 33 33 ARG H H 1 8.477 0.003 . 1 . . . . . 145 ARG H . 50229 1 111 . 1 . 1 33 33 ARG N N 15 122.745 0.019 . 1 . . . . . 145 ARG N . 50229 1 112 . 1 . 1 34 34 SER H H 1 8.411 0.003 . 1 . . . . . 146 SER H . 50229 1 113 . 1 . 1 34 34 SER CA C 13 58.294 0.000 . 1 . . . . . 146 SER CA . 50229 1 114 . 1 . 1 34 34 SER N N 15 117.481 0.031 . 1 . . . . . 146 SER N . 50229 1 115 . 1 . 1 35 35 GLU H H 1 8.350 0.003 . 1 . . . . . 147 GLU H . 50229 1 116 . 1 . 1 35 35 GLU CA C 13 54.459 0.000 . 1 . . . . . 147 GLU CA . 50229 1 117 . 1 . 1 35 35 GLU N N 15 123.892 0.020 . 1 . . . . . 147 GLU N . 50229 1 118 . 1 . 1 37 37 VAL H H 1 8.341 0.009 . 1 . . . . . 149 VAL H . 50229 1 119 . 1 . 1 37 37 VAL N N 15 121.152 0.031 . 1 . . . . . 149 VAL N . 50229 1 120 . 1 . 1 38 38 VAL H H 1 8.292 0.001 . 1 . . . . . 150 VAL H . 50229 1 121 . 1 . 1 38 38 VAL N N 15 124.055 0.010 . 1 . . . . . 150 VAL N . 50229 1 122 . 1 . 1 119 119 ASN HA H 1 4.654 0.000 . 1 . . . . . 231 ASN HA . 50229 1 123 . 1 . 1 119 119 ASN HB2 H 1 2.816 0.000 . 2 . . . . . 231 ASN HB2 . 50229 1 124 . 1 . 1 119 119 ASN HB3 H 1 2.704 0.000 . 2 . . . . . 231 ASN HB3 . 50229 1 125 . 1 . 1 119 119 ASN CB C 13 38.976 0.000 . 1 . . . . . 231 ASN CB . 50229 1 126 . 1 . 1 120 120 TYR H H 1 7.950 0.003 . 1 . . . . . 232 TYR H . 50229 1 127 . 1 . 1 120 120 TYR HA H 1 4.188 0.000 . 1 . . . . . 232 TYR HA . 50229 1 128 . 1 . 1 120 120 TYR CB C 13 39.052 0.000 . 1 . . . . . 232 TYR CB . 50229 1 129 . 1 . 1 120 120 TYR N N 15 119.006 0.078 . 1 . . . . . 232 TYR N . 50229 1 130 . 1 . 1 121 121 GLN C C 13 176.199 0.000 . 1 . . . . . 233 GLN C . 50229 1 131 . 1 . 1 121 121 GLN CA C 13 56.492 0.000 . 1 . . . . . 233 GLN CA . 50229 1 132 . 1 . 1 121 121 GLN CB C 13 29.534 0.000 . 1 . . . . . 233 GLN CB . 50229 1 133 . 1 . 1 122 122 THR H H 1 8.099 0.003 . 1 . . . . . 234 THR H . 50229 1 134 . 1 . 1 122 122 THR C C 13 174.286 0.000 . 1 . . . . . 234 THR C . 50229 1 135 . 1 . 1 122 122 THR CA C 13 62.339 0.023 . 1 . . . . . 234 THR CA . 50229 1 136 . 1 . 1 122 122 THR CB C 13 69.789 0.014 . 1 . . . . . 234 THR CB . 50229 1 137 . 1 . 1 122 122 THR N N 15 115.062 0.038 . 1 . . . . . 234 THR N . 50229 1 138 . 1 . 1 123 123 ALA H H 1 8.227 0.002 . 1 . . . . . 235 ALA H . 50229 1 139 . 1 . 1 123 123 ALA HA H 1 4.324 0.000 . 1 . . . . . 235 ALA HA . 50229 1 140 . 1 . 1 123 123 ALA HB1 H 1 1.388 0.008 . 1 . . . . . 235 ALA HB1 . 50229 1 141 . 1 . 1 123 123 ALA HB2 H 1 1.388 0.008 . 1 . . . . . 235 ALA HB2 . 50229 1 142 . 1 . 1 123 123 ALA HB3 H 1 1.388 0.008 . 1 . . . . . 235 ALA HB3 . 50229 1 143 . 1 . 1 123 123 ALA C C 13 177.841 0.000 . 1 . . . . . 235 ALA C . 50229 1 144 . 1 . 1 123 123 ALA CA C 13 52.748 0.000 . 1 . . . . . 235 ALA CA . 50229 1 145 . 1 . 1 123 123 ALA CB C 13 19.269 0.018 . 1 . . . . . 235 ALA CB . 50229 1 146 . 1 . 1 123 123 ALA N N 15 126.357 0.025 . 1 . . . . . 235 ALA N . 50229 1 147 . 1 . 1 124 124 VAL H H 1 8.106 0.005 . 1 . . . . . 236 VAL H . 50229 1 148 . 1 . 1 124 124 VAL HA H 1 4.050 0.001 . 1 . . . . . 236 VAL HA . 50229 1 149 . 1 . 1 124 124 VAL HB H 1 2.046 0.000 . 1 . . . . . 236 VAL HB . 50229 1 150 . 1 . 1 124 124 VAL C C 13 176.302 0.000 . 1 . . . . . 236 VAL C . 50229 1 151 . 1 . 1 124 124 VAL CA C 13 62.603 0.044 . 1 . . . . . 236 VAL CA . 50229 1 152 . 1 . 1 124 124 VAL CB C 13 32.668 0.015 . 1 . . . . . 236 VAL CB . 50229 1 153 . 1 . 1 124 124 VAL N N 15 119.251 0.028 . 1 . . . . . 236 VAL N . 50229 1 154 . 1 . 1 125 125 CYS HA H 1 4.448 0.002 . 1 . . . . . 237 CYS HA . 50229 1 155 . 1 . 1 125 125 CYS HB2 H 1 2.910 0.001 . 1 . . . . . 237 CYS HB2 . 50229 1 156 . 1 . 1 125 125 CYS HB3 H 1 2.910 0.001 . 1 . . . . . 237 CYS HB3 . 50229 1 157 . 1 . 1 125 125 CYS C C 13 174.441 0.000 . 1 . . . . . 237 CYS C . 50229 1 158 . 1 . 1 125 125 CYS CA C 13 58.732 0.029 . 1 . . . . . 237 CYS CA . 50229 1 159 . 1 . 1 125 125 CYS CB C 13 28.096 0.026 . 1 . . . . . 237 CYS CB . 50229 1 160 . 1 . 1 126 126 ALA H H 1 8.409 0.004 . 1 . . . . . 238 ALA H . 50229 1 161 . 1 . 1 126 126 ALA HA H 1 4.288 0.003 . 1 . . . . . 238 ALA HA . 50229 1 162 . 1 . 1 126 126 ALA HB1 H 1 1.380 0.002 . 1 . . . . . 238 ALA HB1 . 50229 1 163 . 1 . 1 126 126 ALA HB2 H 1 1.380 0.002 . 1 . . . . . 238 ALA HB2 . 50229 1 164 . 1 . 1 126 126 ALA HB3 H 1 1.380 0.002 . 1 . . . . . 238 ALA HB3 . 50229 1 165 . 1 . 1 126 126 ALA C C 13 177.353 0.000 . 1 . . . . . 238 ALA C . 50229 1 166 . 1 . 1 126 126 ALA CA C 13 52.879 0.020 . 1 . . . . . 238 ALA CA . 50229 1 167 . 1 . 1 126 126 ALA CB C 13 19.229 0.032 . 1 . . . . . 238 ALA CB . 50229 1 168 . 1 . 1 126 126 ALA N N 15 126.633 0.037 . 1 . . . . . 238 ALA N . 50229 1 169 . 1 . 1 127 127 ASN H H 1 8.357 0.006 . 1 . . . . . 239 ASN H . 50229 1 170 . 1 . 1 127 127 ASN HA H 1 4.685 0.019 . 1 . . . . . 239 ASN HA . 50229 1 171 . 1 . 1 127 127 ASN HB2 H 1 2.804 0.000 . 2 . . . . . 239 ASN HB2 . 50229 1 172 . 1 . 1 127 127 ASN HB3 H 1 2.741 0.000 . 2 . . . . . 239 ASN HB3 . 50229 1 173 . 1 . 1 127 127 ASN C C 13 174.928 0.000 . 1 . . . . . 239 ASN C . 50229 1 174 . 1 . 1 127 127 ASN CA C 13 53.279 0.055 . 1 . . . . . 239 ASN CA . 50229 1 175 . 1 . 1 127 127 ASN CB C 13 38.894 0.014 . 1 . . . . . 239 ASN CB . 50229 1 176 . 1 . 1 127 127 ASN N N 15 117.494 0.034 . 1 . . . . . 239 ASN N . 50229 1 177 . 1 . 1 128 128 ASN H H 1 8.351 0.004 . 1 . . . . . 240 ASN H . 50229 1 178 . 1 . 1 128 128 ASN HA H 1 4.715 0.012 . 1 . . . . . 240 ASN HA . 50229 1 179 . 1 . 1 128 128 ASN HB2 H 1 2.738 0.000 . 2 . . . . . 240 ASN HB2 . 50229 1 180 . 1 . 1 128 128 ASN HB3 H 1 2.813 0.000 . 2 . . . . . 240 ASN HB3 . 50229 1 181 . 1 . 1 128 128 ASN C C 13 175.315 0.005 . 1 . . . . . 240 ASN C . 50229 1 182 . 1 . 1 128 128 ASN CA C 13 53.218 0.033 . 1 . . . . . 240 ASN CA . 50229 1 183 . 1 . 1 128 128 ASN CB C 13 38.829 0.000 . 1 . . . . . 240 ASN CB . 50229 1 184 . 1 . 1 128 128 ASN N N 15 119.252 0.024 . 1 . . . . . 240 ASN N . 50229 1 185 . 1 . 1 129 129 VAL H H 1 8.107 0.005 . 1 . . . . . 241 VAL H . 50229 1 186 . 1 . 1 129 129 VAL HA H 1 4.117 0.003 . 1 . . . . . 241 VAL HA . 50229 1 187 . 1 . 1 129 129 VAL HB H 1 2.123 0.000 . 1 . . . . . 241 VAL HB . 50229 1 188 . 1 . 1 129 129 VAL HG11 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG11 . 50229 1 189 . 1 . 1 129 129 VAL HG12 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG12 . 50229 1 190 . 1 . 1 129 129 VAL HG13 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG13 . 50229 1 191 . 1 . 1 129 129 VAL HG21 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG21 . 50229 1 192 . 1 . 1 129 129 VAL HG22 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG22 . 50229 1 193 . 1 . 1 129 129 VAL HG23 H 1 0.916 0.000 . 1 . . . . . 241 VAL HG23 . 50229 1 194 . 1 . 1 129 129 VAL C C 13 176.860 0.006 . 1 . . . . . 241 VAL C . 50229 1 195 . 1 . 1 129 129 VAL CA C 13 62.742 0.020 . 1 . . . . . 241 VAL CA . 50229 1 196 . 1 . 1 129 129 VAL CB C 13 32.462 0.011 . 1 . . . . . 241 VAL CB . 50229 1 197 . 1 . 1 129 129 VAL CG1 C 13 20.407 0.000 . 2 . . . . . 241 VAL CG1 . 50229 1 198 . 1 . 1 129 129 VAL CG2 C 13 21.100 0.000 . 2 . . . . . 241 VAL CG2 . 50229 1 199 . 1 . 1 129 129 VAL N N 15 120.179 0.056 . 1 . . . . . 241 VAL N . 50229 1 200 . 1 . 1 130 130 GLY H H 1 8.523 0.003 . 1 . . . . . 242 GLY H . 50229 1 201 . 1 . 1 130 130 GLY HA2 H 1 3.980 0.005 . 2 . . . . . 242 GLY HA2 . 50229 1 202 . 1 . 1 130 130 GLY HA3 H 1 3.977 0.001 . 2 . . . . . 242 GLY HA3 . 50229 1 203 . 1 . 1 130 130 GLY C C 13 174.790 0.007 . 1 . . . . . 242 GLY C . 50229 1 204 . 1 . 1 130 130 GLY CA C 13 45.370 0.022 . 1 . . . . . 242 GLY CA . 50229 1 205 . 1 . 1 130 130 GLY N N 15 112.427 0.038 . 1 . . . . . 242 GLY N . 50229 1 206 . 1 . 1 131 131 GLY H H 1 8.294 0.004 . 1 . . . . . 243 GLY H . 50229 1 207 . 1 . 1 131 131 GLY HA2 H 1 3.972 0.004 . 1 . . . . . 243 GLY HA2 . 50229 1 208 . 1 . 1 131 131 GLY HA3 H 1 3.972 0.004 . 1 . . . . . 243 GLY HA3 . 50229 1 209 . 1 . 1 131 131 GLY C C 13 174.851 0.007 . 1 . . . . . 243 GLY C . 50229 1 210 . 1 . 1 131 131 GLY CA C 13 45.375 0.017 . 1 . . . . . 243 GLY CA . 50229 1 211 . 1 . 1 131 131 GLY N N 15 108.904 0.042 . 1 . . . . . 243 GLY N . 50229 1 212 . 1 . 1 132 132 GLY H H 1 8.365 0.002 . 1 . . . . . 244 GLY H . 50229 1 213 . 1 . 1 132 132 GLY HA2 H 1 3.958 0.002 . 1 . . . . . 244 GLY HA2 . 50229 1 214 . 1 . 1 132 132 GLY HA3 H 1 3.958 0.002 . 1 . . . . . 244 GLY HA3 . 50229 1 215 . 1 . 1 132 132 GLY C C 13 174.029 0.010 . 1 . . . . . 244 GLY C . 50229 1 216 . 1 . 1 132 132 GLY CA C 13 45.362 0.016 . 1 . . . . . 244 GLY CA . 50229 1 217 . 1 . 1 132 132 GLY N N 15 108.904 0.044 . 1 . . . . . 244 GLY N . 50229 1 218 . 1 . 1 133 133 ASN H H 1 8.386 0.002 . 1 . . . . . 245 ASN H . 50229 1 219 . 1 . 1 133 133 ASN HA H 1 4.759 0.000 . 1 . . . . . 245 ASN HA . 50229 1 220 . 1 . 1 133 133 ASN HB2 H 1 2.796 0.000 . 2 . . . . . 245 ASN HB2 . 50229 1 221 . 1 . 1 133 133 ASN HB3 H 1 2.750 0.000 . 2 . . . . . 245 ASN HB3 . 50229 1 222 . 1 . 1 133 133 ASN C C 13 175.335 0.000 . 1 . . . . . 245 ASN C . 50229 1 223 . 1 . 1 133 133 ASN CA C 13 53.165 0.000 . 1 . . . . . 245 ASN CA . 50229 1 224 . 1 . 1 133 133 ASN CB C 13 39.086 0.005 . 1 . . . . . 245 ASN CB . 50229 1 225 . 1 . 1 133 133 ASN N N 15 118.750 0.039 . 1 . . . . . 245 ASN N . 50229 1 226 . 1 . 1 134 134 SER H H 1 8.335 0.002 . 1 . . . . . 246 SER H . 50229 1 227 . 1 . 1 134 134 SER HA H 1 4.475 0.002 . 1 . . . . . 246 SER HA . 50229 1 228 . 1 . 1 134 134 SER HB2 H 1 3.857 0.000 . 1 . . . . . 246 SER HB2 . 50229 1 229 . 1 . 1 134 134 SER HB3 H 1 3.857 0.000 . 1 . . . . . 246 SER HB3 . 50229 1 230 . 1 . 1 134 134 SER C C 13 174.469 0.000 . 1 . . . . . 246 SER C . 50229 1 231 . 1 . 1 134 134 SER CA C 13 58.489 0.016 . 1 . . . . . 246 SER CA . 50229 1 232 . 1 . 1 134 134 SER CB C 13 63.854 0.032 . 1 . . . . . 246 SER CB . 50229 1 233 . 1 . 1 134 134 SER N N 15 116.422 0.035 . 1 . . . . . 246 SER N . 50229 1 234 . 1 . 1 135 135 VAL H H 1 8.186 0.003 . 1 . . . . . 247 VAL H . 50229 1 235 . 1 . 1 135 135 VAL HA H 1 4.194 0.003 . 1 . . . . . 247 VAL HA . 50229 1 236 . 1 . 1 135 135 VAL HB H 1 2.094 0.000 . 1 . . . . . 247 VAL HB . 50229 1 237 . 1 . 1 135 135 VAL C C 13 176.229 0.003 . 1 . . . . . 247 VAL C . 50229 1 238 . 1 . 1 135 135 VAL CA C 13 62.277 0.022 . 1 . . . . . 247 VAL CA . 50229 1 239 . 1 . 1 135 135 VAL CB C 13 32.698 0.052 . 1 . . . . . 247 VAL CB . 50229 1 240 . 1 . 1 135 135 VAL CG1 C 13 20.369 0.000 . 2 . . . . . 247 VAL CG1 . 50229 1 241 . 1 . 1 135 135 VAL CG2 C 13 21.181 0.000 . 2 . . . . . 247 VAL CG2 . 50229 1 242 . 1 . 1 135 135 VAL N N 15 121.455 0.031 . 1 . . . . . 247 VAL N . 50229 1 243 . 1 . 1 136 136 SER H H 1 8.435 0.003 . 1 . . . . . 248 SER H . 50229 1 244 . 1 . 1 136 136 SER HA H 1 4.558 0.001 . 1 . . . . . 248 SER HA . 50229 1 245 . 1 . 1 136 136 SER HB2 H 1 3.859 0.000 . 1 . . . . . 248 SER HB2 . 50229 1 246 . 1 . 1 136 136 SER HB3 H 1 3.859 0.000 . 1 . . . . . 248 SER HB3 . 50229 1 247 . 1 . 1 136 136 SER C C 13 175.012 0.000 . 1 . . . . . 248 SER C . 50229 1 248 . 1 . 1 136 136 SER CA C 13 58.204 0.001 . 1 . . . . . 248 SER CA . 50229 1 249 . 1 . 1 136 136 SER CB C 13 64.001 0.000 . 1 . . . . . 248 SER CB . 50229 1 250 . 1 . 1 136 136 SER N N 15 119.332 0.033 . 1 . . . . . 248 SER N . 50229 1 251 . 1 . 1 137 137 THR H H 1 8.299 0.003 . 1 . . . . . 249 THR H . 50229 1 252 . 1 . 1 137 137 THR CA C 13 61.758 0.000 . 1 . . . . . 249 THR CA . 50229 1 253 . 1 . 1 137 137 THR CB C 13 69.828 0.000 . 1 . . . . . 249 THR CB . 50229 1 254 . 1 . 1 137 137 THR N N 15 116.124 0.019 . 1 . . . . . 249 THR N . 50229 1 255 . 1 . 1 138 138 THR HA H 1 4.456 0.005 . 1 . . . . . 250 THR HA . 50229 1 256 . 1 . 1 138 138 THR HB H 1 4.316 0.001 . 1 . . . . . 250 THR HB . 50229 1 257 . 1 . 1 138 138 THR CA C 13 61.924 0.003 . 1 . . . . . 250 THR CA . 50229 1 258 . 1 . 1 138 138 THR CB C 13 69.757 0.021 . 1 . . . . . 250 THR CB . 50229 1 259 . 1 . 1 139 139 SER H H 1 8.213 0.006 . 1 . . . . . 251 SER H . 50229 1 260 . 1 . 1 139 139 SER HA H 1 4.404 0.000 . 1 . . . . . 251 SER HA . 50229 1 261 . 1 . 1 139 139 SER HB2 H 1 3.883 0.000 . 1 . . . . . 251 SER HB2 . 50229 1 262 . 1 . 1 139 139 SER HB3 H 1 3.883 0.000 . 1 . . . . . 251 SER HB3 . 50229 1 263 . 1 . 1 139 139 SER C C 13 174.991 0.000 . 1 . . . . . 251 SER C . 50229 1 264 . 1 . 1 139 139 SER CA C 13 58.611 0.008 . 1 . . . . . 251 SER CA . 50229 1 265 . 1 . 1 139 139 SER CB C 13 63.961 0.000 . 1 . . . . . 251 SER CB . 50229 1 266 . 1 . 1 139 139 SER N N 15 115.577 0.040 . 1 . . . . . 251 SER N . 50229 1 267 . 1 . 1 140 140 GLY H H 1 8.418 0.004 . 1 . . . . . 252 GLY H . 50229 1 268 . 1 . 1 140 140 GLY HA2 H 1 3.955 0.002 . 1 . . . . . 252 GLY HA2 . 50229 1 269 . 1 . 1 140 140 GLY HA3 H 1 3.955 0.002 . 1 . . . . . 252 GLY HA3 . 50229 1 270 . 1 . 1 140 140 GLY C C 13 173.759 0.007 . 1 . . . . . 252 GLY C . 50229 1 271 . 1 . 1 140 140 GLY CA C 13 45.284 0.057 . 1 . . . . . 252 GLY CA . 50229 1 272 . 1 . 1 140 140 GLY N N 15 110.968 0.041 . 1 . . . . . 252 GLY N . 50229 1 273 . 1 . 1 141 141 GLN H H 1 8.146 0.003 . 1 . . . . . 253 GLN H . 50229 1 274 . 1 . 1 141 141 GLN HA H 1 4.612 0.002 . 1 . . . . . 253 GLN HA . 50229 1 275 . 1 . 1 141 141 GLN HB2 H 1 1.897 0.000 . 2 . . . . . 253 GLN HB2 . 50229 1 276 . 1 . 1 141 141 GLN HB3 H 1 2.076 0.000 . 2 . . . . . 253 GLN HB3 . 50229 1 277 . 1 . 1 141 141 GLN HG2 H 1 2.348 0.000 . 1 . . . . . 253 GLN HG2 . 50229 1 278 . 1 . 1 141 141 GLN HG3 H 1 2.348 0.000 . 1 . . . . . 253 GLN HG3 . 50229 1 279 . 1 . 1 141 141 GLN C C 13 173.986 0.000 . 1 . . . . . 253 GLN C . 50229 1 280 . 1 . 1 141 141 GLN CA C 13 53.656 0.032 . 1 . . . . . 253 GLN CA . 50229 1 281 . 1 . 1 141 141 GLN CB C 13 28.932 0.007 . 1 . . . . . 253 GLN CB . 50229 1 282 . 1 . 1 141 141 GLN N N 15 120.753 0.029 . 1 . . . . . 253 GLN N . 50229 1 283 . 1 . 1 142 142 PRO HA H 1 4.420 0.005 . 1 . . . . . 254 PRO HA . 50229 1 284 . 1 . 1 142 142 PRO HB2 H 1 2.268 0.000 . 2 . . . . . 254 PRO HB2 . 50229 1 285 . 1 . 1 142 142 PRO HB3 H 1 1.883 0.000 . 2 . . . . . 254 PRO HB3 . 50229 1 286 . 1 . 1 142 142 PRO HD2 H 1 3.781 0.005 . 2 . . . . . 254 PRO HD2 . 50229 1 287 . 1 . 1 142 142 PRO HD3 H 1 3.630 0.001 . 2 . . . . . 254 PRO HD3 . 50229 1 288 . 1 . 1 142 142 PRO C C 13 176.951 0.000 . 1 . . . . . 254 PRO C . 50229 1 289 . 1 . 1 142 142 PRO CA C 13 63.100 0.048 . 1 . . . . . 254 PRO CA . 50229 1 290 . 1 . 1 142 142 PRO CB C 13 32.062 0.043 . 1 . . . . . 254 PRO CB . 50229 1 291 . 1 . 1 142 142 PRO CG C 13 27.361 0.000 . 1 . . . . . 254 PRO CG . 50229 1 292 . 1 . 1 142 142 PRO CD C 13 50.594 0.052 . 1 . . . . . 254 PRO CD . 50229 1 293 . 1 . 1 142 142 PRO N N 15 137.080 0.033 . 1 . . . . . 254 PRO N . 50229 1 294 . 1 . 1 143 143 LEU H H 1 8.436 0.003 . 1 . . . . . 255 LEU H . 50229 1 295 . 1 . 1 143 143 LEU HA H 1 4.311 0.009 . 1 . . . . . 255 LEU HA . 50229 1 296 . 1 . 1 143 143 LEU HB2 H 1 1.563 0.000 . 2 . . . . . 255 LEU HB2 . 50229 1 297 . 1 . 1 143 143 LEU HB3 H 1 1.624 0.000 . 2 . . . . . 255 LEU HB3 . 50229 1 298 . 1 . 1 143 143 LEU C C 13 177.646 0.003 . 1 . . . . . 255 LEU C . 50229 1 299 . 1 . 1 143 143 LEU CA C 13 55.301 0.012 . 1 . . . . . 255 LEU CA . 50229 1 300 . 1 . 1 143 143 LEU CB C 13 42.317 0.007 . 1 . . . . . 255 LEU CB . 50229 1 301 . 1 . 1 143 143 LEU N N 15 122.637 0.047 . 1 . . . . . 255 LEU N . 50229 1 302 . 1 . 1 144 144 SER H H 1 8.298 0.003 . 1 . . . . . 256 SER H . 50229 1 303 . 1 . 1 144 144 SER HA H 1 4.418 0.000 . 1 . . . . . 256 SER HA . 50229 1 304 . 1 . 1 144 144 SER HB2 H 1 3.840 0.000 . 1 . . . . . 256 SER HB2 . 50229 1 305 . 1 . 1 144 144 SER HB3 H 1 3.840 0.000 . 1 . . . . . 256 SER HB3 . 50229 1 306 . 1 . 1 144 144 SER C C 13 174.311 0.015 . 1 . . . . . 256 SER C . 50229 1 307 . 1 . 1 144 144 SER CA C 13 58.239 0.000 . 1 . . . . . 256 SER CA . 50229 1 308 . 1 . 1 144 144 SER CB C 13 63.869 0.000 . 1 . . . . . 256 SER CB . 50229 1 309 . 1 . 1 144 144 SER N N 15 116.139 0.045 . 1 . . . . . 256 SER N . 50229 1 310 . 1 . 1 145 145 ASN H H 1 8.480 0.004 . 1 . . . . . 257 ASN H . 50229 1 311 . 1 . 1 145 145 ASN HA H 1 4.772 0.000 . 1 . . . . . 257 ASN HA . 50229 1 312 . 1 . 1 145 145 ASN HB2 H 1 2.805 0.000 . 1 . . . . . 257 ASN HB2 . 50229 1 313 . 1 . 1 145 145 ASN HB3 H 1 2.805 0.000 . 1 . . . . . 257 ASN HB3 . 50229 1 314 . 1 . 1 145 145 ASN C C 13 175.355 0.033 . 1 . . . . . 257 ASN C . 50229 1 315 . 1 . 1 145 145 ASN CA C 13 53.366 0.012 . 1 . . . . . 257 ASN CA . 50229 1 316 . 1 . 1 145 145 ASN CB C 13 38.811 0.021 . 1 . . . . . 257 ASN CB . 50229 1 317 . 1 . 1 145 145 ASN N N 15 120.917 0.050 . 1 . . . . . 257 ASN N . 50229 1 318 . 1 . 1 146 146 THR H H 1 8.121 0.003 . 1 . . . . . 258 THR H . 50229 1 319 . 1 . 1 146 146 THR HA H 1 4.311 0.004 . 1 . . . . . 258 THR HA . 50229 1 320 . 1 . 1 146 146 THR HB H 1 4.201 0.002 . 1 . . . . . 258 THR HB . 50229 1 321 . 1 . 1 146 146 THR HG21 H 1 1.171 0.000 . 1 . . . . . 258 THR HG21 . 50229 1 322 . 1 . 1 146 146 THR HG22 H 1 1.171 0.000 . 1 . . . . . 258 THR HG22 . 50229 1 323 . 1 . 1 146 146 THR HG23 H 1 1.171 0.000 . 1 . . . . . 258 THR HG23 . 50229 1 324 . 1 . 1 146 146 THR C C 13 174.602 0.005 . 1 . . . . . 258 THR C . 50229 1 325 . 1 . 1 146 146 THR CA C 13 62.124 0.032 . 1 . . . . . 258 THR CA . 50229 1 326 . 1 . 1 146 146 THR CB C 13 69.868 0.026 . 1 . . . . . 258 THR CB . 50229 1 327 . 1 . 1 146 146 THR CG2 C 13 21.641 0.000 . 1 . . . . . 258 THR CG2 . 50229 1 328 . 1 . 1 146 146 THR N N 15 114.217 0.032 . 1 . . . . . 258 THR N . 50229 1 329 . 1 . 1 147 147 VAL H H 1 8.100 0.002 . 1 . . . . . 259 VAL H . 50229 1 330 . 1 . 1 147 147 VAL HA H 1 4.052 0.002 . 1 . . . . . 259 VAL HA . 50229 1 331 . 1 . 1 147 147 VAL HB H 1 1.996 0.003 . 1 . . . . . 259 VAL HB . 50229 1 332 . 1 . 1 147 147 VAL C C 13 175.642 0.015 . 1 . . . . . 259 VAL C . 50229 1 333 . 1 . 1 147 147 VAL CA C 13 62.531 0.026 . 1 . . . . . 259 VAL CA . 50229 1 334 . 1 . 1 147 147 VAL CB C 13 32.660 0.021 . 1 . . . . . 259 VAL CB . 50229 1 335 . 1 . 1 147 147 VAL N N 15 122.186 0.033 . 1 . . . . . 259 VAL N . 50229 1 336 . 1 . 1 148 148 ASN H H 1 8.440 0.003 . 1 . . . . . 260 ASN H . 50229 1 337 . 1 . 1 148 148 ASN HA H 1 4.697 0.006 . 1 . . . . . 260 ASN HA . 50229 1 338 . 1 . 1 148 148 ASN HB2 H 1 2.684 0.000 . 2 . . . . . 260 ASN HB2 . 50229 1 339 . 1 . 1 148 148 ASN HB3 H 1 2.781 0.000 . 2 . . . . . 260 ASN HB3 . 50229 1 340 . 1 . 1 148 148 ASN C C 13 175.057 0.000 . 1 . . . . . 260 ASN C . 50229 1 341 . 1 . 1 148 148 ASN CA C 13 53.160 0.025 . 1 . . . . . 260 ASN CA . 50229 1 342 . 1 . 1 148 148 ASN CB C 13 38.930 0.000 . 1 . . . . . 260 ASN CB . 50229 1 343 . 1 . 1 148 148 ASN N N 15 122.193 0.044 . 1 . . . . . 260 ASN N . 50229 1 344 . 1 . 1 149 149 HIS HA H 1 4.644 0.005 . 1 . . . . . 261 HIS HA . 50229 1 345 . 1 . 1 149 149 HIS HB2 H 1 3.069 0.006 . 2 . . . . . 261 HIS HB2 . 50229 1 346 . 1 . 1 149 149 HIS HB3 H 1 3.131 0.008 . 2 . . . . . 261 HIS HB3 . 50229 1 347 . 1 . 1 149 149 HIS C C 13 175.797 0.000 . 1 . . . . . 261 HIS C . 50229 1 348 . 1 . 1 149 149 HIS CA C 13 56.660 0.035 . 1 . . . . . 261 HIS CA . 50229 1 349 . 1 . 1 149 149 HIS CB C 13 30.967 0.048 . 1 . . . . . 261 HIS CB . 50229 1 350 . 1 . 1 150 150 THR H H 1 8.161 0.004 . 1 . . . . . 262 THR H . 50229 1 351 . 1 . 1 150 150 THR HA H 1 4.294 0.007 . 1 . . . . . 262 THR HA . 50229 1 352 . 1 . 1 150 150 THR HB H 1 4.210 0.000 . 1 . . . . . 262 THR HB . 50229 1 353 . 1 . 1 150 150 THR C C 13 174.647 0.000 . 1 . . . . . 262 THR C . 50229 1 354 . 1 . 1 150 150 THR CA C 13 62.211 0.037 . 1 . . . . . 262 THR CA . 50229 1 355 . 1 . 1 150 150 THR CB C 13 69.700 0.000 . 1 . . . . . 262 THR CB . 50229 1 356 . 1 . 1 150 150 THR CG2 C 13 21.493 0.000 . 1 . . . . . 262 THR CG2 . 50229 1 357 . 1 . 1 150 150 THR N N 15 115.185 0.045 . 1 . . . . . 262 THR N . 50229 1 358 . 1 . 1 151 151 ARG H H 1 8.429 0.003 . 1 . . . . . 263 ARG H . 50229 1 359 . 1 . 1 151 151 ARG HA H 1 4.302 0.009 . 1 . . . . . 263 ARG HA . 50229 1 360 . 1 . 1 151 151 ARG HB2 H 1 1.866 0.000 . 2 . . . . . 263 ARG HB2 . 50229 1 361 . 1 . 1 151 151 ARG HB3 H 1 1.769 0.000 . 2 . . . . . 263 ARG HB3 . 50229 1 362 . 1 . 1 151 151 ARG C C 13 176.673 0.000 . 1 . . . . . 263 ARG C . 50229 1 363 . 1 . 1 151 151 ARG CA C 13 56.511 0.014 . 1 . . . . . 263 ARG CA . 50229 1 364 . 1 . 1 151 151 ARG CB C 13 30.659 0.000 . 1 . . . . . 263 ARG CB . 50229 1 365 . 1 . 1 151 151 ARG CG C 13 27.141 0.000 . 1 . . . . . 263 ARG CG . 50229 1 366 . 1 . 1 151 151 ARG CD C 13 43.280 0.000 . 1 . . . . . 263 ARG CD . 50229 1 367 . 1 . 1 151 151 ARG N N 15 123.637 0.066 . 1 . . . . . 263 ARG N . 50229 1 368 . 1 . 1 152 152 GLY H H 1 8.400 0.003 . 1 . . . . . 264 GLY H . 50229 1 369 . 1 . 1 152 152 GLY HA2 H 1 3.935 0.003 . 1 . . . . . 264 GLY HA2 . 50229 1 370 . 1 . 1 152 152 GLY HA3 H 1 3.935 0.003 . 1 . . . . . 264 GLY HA3 . 50229 1 371 . 1 . 1 152 152 GLY C C 13 173.955 0.000 . 1 . . . . . 264 GLY C . 50229 1 372 . 1 . 1 152 152 GLY CA C 13 45.268 0.013 . 1 . . . . . 264 GLY CA . 50229 1 373 . 1 . 1 152 152 GLY N N 15 109.890 0.042 . 1 . . . . . 264 GLY N . 50229 1 374 . 1 . 1 153 153 LEU H H 1 8.141 0.003 . 1 . . . . . 265 LEU H . 50229 1 375 . 1 . 1 153 153 LEU HA H 1 4.420 0.003 . 1 . . . . . 265 LEU HA . 50229 1 376 . 1 . 1 153 153 LEU HB2 H 1 1.618 0.002 . 1 . . . . . 265 LEU HB2 . 50229 1 377 . 1 . 1 153 153 LEU HB3 H 1 1.618 0.002 . 1 . . . . . 265 LEU HB3 . 50229 1 378 . 1 . 1 153 153 LEU C C 13 177.729 0.000 . 1 . . . . . 265 LEU C . 50229 1 379 . 1 . 1 153 153 LEU CA C 13 55.272 0.020 . 1 . . . . . 265 LEU CA . 50229 1 380 . 1 . 1 153 153 LEU CB C 13 42.571 0.021 . 1 . . . . . 265 LEU CB . 50229 1 381 . 1 . 1 153 153 LEU CG C 13 26.987 0.000 . 1 . . . . . 265 LEU CG . 50229 1 382 . 1 . 1 153 153 LEU CD1 C 13 23.465 0.000 . 2 . . . . . 265 LEU CD1 . 50229 1 383 . 1 . 1 153 153 LEU CD2 C 13 24.770 0.000 . 2 . . . . . 265 LEU CD2 . 50229 1 384 . 1 . 1 153 153 LEU N N 15 121.665 0.038 . 1 . . . . . 265 LEU N . 50229 1 385 . 1 . 1 154 154 THR H H 1 8.261 0.006 . 1 . . . . . 266 THR H . 50229 1 386 . 1 . 1 154 154 THR HA H 1 4.447 0.004 . 1 . . . . . 266 THR HA . 50229 1 387 . 1 . 1 154 154 THR HB H 1 4.250 0.000 . 1 . . . . . 266 THR HB . 50229 1 388 . 1 . 1 154 154 THR HG21 H 1 1.178 0.000 . 1 . . . . . 266 THR HG21 . 50229 1 389 . 1 . 1 154 154 THR HG22 H 1 1.178 0.000 . 1 . . . . . 266 THR HG22 . 50229 1 390 . 1 . 1 154 154 THR HG23 H 1 1.178 0.000 . 1 . . . . . 266 THR HG23 . 50229 1 391 . 1 . 1 154 154 THR C C 13 174.705 0.000 . 1 . . . . . 266 THR C . 50229 1 392 . 1 . 1 154 154 THR CA C 13 61.685 0.017 . 1 . . . . . 266 THR CA . 50229 1 393 . 1 . 1 154 154 THR CB C 13 69.906 0.000 . 1 . . . . . 266 THR CB . 50229 1 394 . 1 . 1 154 154 THR N N 15 114.949 0.052 . 1 . . . . . 266 THR N . 50229 1 395 . 1 . 1 158 158 SER HA H 1 4.468 0.003 . 1 . . . . . 270 SER HA . 50229 1 396 . 1 . 1 158 158 SER HB2 H 1 3.883 0.000 . 1 . . . . . 270 SER HB2 . 50229 1 397 . 1 . 1 158 158 SER HB3 H 1 3.883 0.000 . 1 . . . . . 270 SER HB3 . 50229 1 398 . 1 . 1 158 158 SER C C 13 174.991 0.000 . 1 . . . . . 270 SER C . 50229 1 399 . 1 . 1 158 158 SER CA C 13 58.611 0.008 . 1 . . . . . 270 SER CA . 50229 1 400 . 1 . 1 158 158 SER CB C 13 63.961 0.000 . 1 . . . . . 270 SER CB . 50229 1 401 . 1 . 1 159 159 GLY H H 1 8.418 0.004 . 1 . . . . . 271 GLY H . 50229 1 402 . 1 . 1 159 159 GLY HA2 H 1 3.992 0.026 . 1 . . . . . 271 GLY HA2 . 50229 1 403 . 1 . 1 159 159 GLY HA3 H 1 3.992 0.026 . 1 . . . . . 271 GLY HA3 . 50229 1 404 . 1 . 1 159 159 GLY C C 13 174.043 0.000 . 1 . . . . . 271 GLY C . 50229 1 405 . 1 . 1 159 159 GLY CA C 13 45.377 0.072 . 1 . . . . . 271 GLY CA . 50229 1 406 . 1 . 1 159 159 GLY N N 15 110.974 0.046 . 1 . . . . . 271 GLY N . 50229 1 407 . 1 . 1 160 160 SER H H 1 8.244 0.005 . 1 . . . . . 272 SER H . 50229 1 408 . 1 . 1 160 160 SER HA H 1 4.524 0.004 . 1 . . . . . 272 SER HA . 50229 1 409 . 1 . 1 160 160 SER HB2 H 1 3.855 0.001 . 1 . . . . . 272 SER HB2 . 50229 1 410 . 1 . 1 160 160 SER HB3 H 1 3.855 0.001 . 1 . . . . . 272 SER HB3 . 50229 1 411 . 1 . 1 160 160 SER C C 13 174.553 0.000 . 1 . . . . . 272 SER C . 50229 1 412 . 1 . 1 160 160 SER CA C 13 58.204 0.017 . 1 . . . . . 272 SER CA . 50229 1 413 . 1 . 1 160 160 SER CB C 13 64.101 0.066 . 1 . . . . . 272 SER CB . 50229 1 414 . 1 . 1 160 160 SER N N 15 115.556 0.026 . 1 . . . . . 272 SER N . 50229 1 415 . 1 . 1 161 161 GLY H H 1 8.310 0.004 . 1 . . . . . 273 GLY H . 50229 1 416 . 1 . 1 161 161 GLY HA2 H 1 4.109 0.003 . 1 . . . . . 273 GLY HA2 . 50229 1 417 . 1 . 1 161 161 GLY HA3 H 1 4.109 0.003 . 1 . . . . . 273 GLY HA3 . 50229 1 418 . 1 . 1 161 161 GLY C C 13 171.965 0.000 . 1 . . . . . 273 GLY C . 50229 1 419 . 1 . 1 161 161 GLY CA C 13 44.763 0.012 . 1 . . . . . 273 GLY CA . 50229 1 420 . 1 . 1 161 161 GLY N N 15 110.863 0.048 . 1 . . . . . 273 GLY N . 50229 1 421 . 1 . 1 162 162 PRO HA H 1 4.425 0.003 . 1 . . . . . 274 PRO HA . 50229 1 422 . 1 . 1 162 162 PRO HB2 H 1 1.912 0.000 . 2 . . . . . 274 PRO HB2 . 50229 1 423 . 1 . 1 162 162 PRO HB3 H 1 2.237 0.000 . 2 . . . . . 274 PRO HB3 . 50229 1 424 . 1 . 1 162 162 PRO HD2 H 1 3.625 0.002 . 2 . . . . . 274 PRO HD2 . 50229 1 425 . 1 . 1 162 162 PRO HD3 H 1 3.587 0.002 . 2 . . . . . 274 PRO HD3 . 50229 1 426 . 1 . 1 162 162 PRO C C 13 176.921 0.000 . 1 . . . . . 274 PRO C . 50229 1 427 . 1 . 1 162 162 PRO CA C 13 63.305 0.031 . 1 . . . . . 274 PRO CA . 50229 1 428 . 1 . 1 162 162 PRO CB C 13 32.132 0.031 . 1 . . . . . 274 PRO CB . 50229 1 429 . 1 . 1 162 162 PRO CG C 13 26.980 0.000 . 1 . . . . . 274 PRO CG . 50229 1 430 . 1 . 1 162 162 PRO CD C 13 49.766 0.028 . 1 . . . . . 274 PRO CD . 50229 1 431 . 1 . 1 162 162 PRO N N 15 133.901 0.005 . 1 . . . . . 274 PRO N . 50229 1 432 . 1 . 1 163 163 ASN H H 1 8.546 0.006 . 1 . . . . . 275 ASN H . 50229 1 433 . 1 . 1 163 163 ASN HA H 1 4.649 0.003 . 1 . . . . . 275 ASN HA . 50229 1 434 . 1 . 1 163 163 ASN HB2 H 1 2.712 0.003 . 2 . . . . . 275 ASN HB2 . 50229 1 435 . 1 . 1 163 163 ASN HB3 H 1 2.791 0.001 . 2 . . . . . 275 ASN HB3 . 50229 1 436 . 1 . 1 163 163 ASN C C 13 174.741 0.001 . 1 . . . . . 275 ASN C . 50229 1 437 . 1 . 1 163 163 ASN CA C 13 53.319 0.046 . 1 . . . . . 275 ASN CA . 50229 1 438 . 1 . 1 163 163 ASN CB C 13 38.762 0.009 . 1 . . . . . 275 ASN CB . 50229 1 439 . 1 . 1 163 163 ASN N N 15 118.503 0.043 . 1 . . . . . 275 ASN N . 50229 1 440 . 1 . 1 164 164 GLN H H 1 8.161 0.003 . 1 . . . . . 276 GLN H . 50229 1 441 . 1 . 1 164 164 GLN HA H 1 4.593 0.001 . 1 . . . . . 276 GLN HA . 50229 1 442 . 1 . 1 164 164 GLN HB2 H 1 1.865 0.000 . 2 . . . . . 276 GLN HB2 . 50229 1 443 . 1 . 1 164 164 GLN HB3 H 1 2.015 0.000 . 2 . . . . . 276 GLN HB3 . 50229 1 444 . 1 . 1 164 164 GLN HG2 H 1 2.305 0.000 . 1 . . . . . 276 GLN HG2 . 50229 1 445 . 1 . 1 164 164 GLN C C 13 173.889 0.000 . 1 . . . . . 276 GLN C . 50229 1 446 . 1 . 1 164 164 GLN CA C 13 53.616 0.006 . 1 . . . . . 276 GLN CA . 50229 1 447 . 1 . 1 164 164 GLN CB C 13 29.054 0.000 . 1 . . . . . 276 GLN CB . 50229 1 448 . 1 . 1 164 164 GLN N N 15 121.155 0.038 . 1 . . . . . 276 GLN N . 50229 1 449 . 1 . 1 165 165 PRO HA H 1 4.373 0.006 . 1 . . . . . 277 PRO HA . 50229 1 450 . 1 . 1 165 165 PRO HB2 H 1 2.185 0.000 . 2 . . . . . 277 PRO HB2 . 50229 1 451 . 1 . 1 165 165 PRO HB3 H 1 1.785 0.000 . 2 . . . . . 277 PRO HB3 . 50229 1 452 . 1 . 1 165 165 PRO C C 13 176.372 0.013 . 1 . . . . . 277 PRO C . 50229 1 453 . 1 . 1 165 165 PRO CA C 13 63.252 0.065 . 1 . . . . . 277 PRO CA . 50229 1 454 . 1 . 1 165 165 PRO CB C 13 31.969 0.000 . 1 . . . . . 277 PRO CB . 50229 1 455 . 1 . 1 165 165 PRO CG C 13 27.201 0.000 . 1 . . . . . 277 PRO CG . 50229 1 456 . 1 . 1 165 165 PRO N N 15 136.788 0.053 . 1 . . . . . 277 PRO N . 50229 1 457 . 1 . 1 166 166 TYR H H 1 8.194 0.003 . 1 . . . . . 278 TYR H . 50229 1 458 . 1 . 1 166 166 TYR HA H 1 4.587 0.002 . 1 . . . . . 278 TYR HA . 50229 1 459 . 1 . 1 166 166 TYR HB2 H 1 2.987 0.003 . 1 . . . . . 278 TYR HB2 . 50229 1 460 . 1 . 1 166 166 TYR HB3 H 1 2.987 0.003 . 1 . . . . . 278 TYR HB3 . 50229 1 461 . 1 . 1 166 166 TYR C C 13 175.628 0.007 . 1 . . . . . 278 TYR C . 50229 1 462 . 1 . 1 166 166 TYR CA C 13 57.823 0.032 . 1 . . . . . 278 TYR CA . 50229 1 463 . 1 . 1 166 166 TYR CB C 13 38.772 0.013 . 1 . . . . . 278 TYR CB . 50229 1 464 . 1 . 1 166 166 TYR N N 15 120.338 0.036 . 1 . . . . . 278 TYR N . 50229 1 465 . 1 . 1 167 167 THR H H 1 7.948 0.003 . 1 . . . . . 279 THR H . 50229 1 466 . 1 . 1 167 167 THR HA H 1 4.266 0.005 . 1 . . . . . 279 THR HA . 50229 1 467 . 1 . 1 167 167 THR HB H 1 4.035 0.003 . 1 . . . . . 279 THR HB . 50229 1 468 . 1 . 1 167 167 THR HG21 H 1 1.105 0.000 . 1 . . . . . 279 THR HG21 . 50229 1 469 . 1 . 1 167 167 THR HG22 H 1 1.105 0.000 . 1 . . . . . 279 THR HG22 . 50229 1 470 . 1 . 1 167 167 THR HG23 H 1 1.105 0.000 . 1 . . . . . 279 THR HG23 . 50229 1 471 . 1 . 1 167 167 THR C C 13 173.426 0.002 . 1 . . . . . 279 THR C . 50229 1 472 . 1 . 1 167 167 THR CA C 13 61.346 0.034 . 1 . . . . . 279 THR CA . 50229 1 473 . 1 . 1 167 167 THR CB C 13 70.226 0.025 . 1 . . . . . 279 THR CB . 50229 1 474 . 1 . 1 167 167 THR CG2 C 13 21.555 0.018 . 1 . . . . . 279 THR CG2 . 50229 1 475 . 1 . 1 167 167 THR N N 15 117.318 0.038 . 1 . . . . . 279 THR N . 50229 1 476 . 1 . 1 168 168 LEU H H 1 8.164 0.002 . 1 . . . . . 280 LEU H . 50229 1 477 . 1 . 1 168 168 LEU HA H 1 4.513 0.004 . 1 . . . . . 280 LEU HA . 50229 1 478 . 1 . 1 168 168 LEU HB2 H 1 1.534 0.000 . 1 . . . . . 280 LEU HB2 . 50229 1 479 . 1 . 1 168 168 LEU HB3 H 1 1.534 0.000 . 1 . . . . . 280 LEU HB3 . 50229 1 480 . 1 . 1 168 168 LEU C C 13 175.092 0.000 . 1 . . . . . 280 LEU C . 50229 1 481 . 1 . 1 168 168 LEU CA C 13 53.022 0.035 . 1 . . . . . 280 LEU CA . 50229 1 482 . 1 . 1 168 168 LEU CB C 13 41.900 0.006 . 1 . . . . . 280 LEU CB . 50229 1 483 . 1 . 1 168 168 LEU N N 15 126.252 0.035 . 1 . . . . . 280 LEU N . 50229 1 484 . 1 . 1 169 169 PRO HA H 1 4.349 0.003 . 1 . . . . . 281 PRO HA . 50229 1 485 . 1 . 1 169 169 PRO HB2 H 1 2.189 0.000 . 2 . . . . . 281 PRO HB2 . 50229 1 486 . 1 . 1 169 169 PRO HB3 H 1 1.790 0.000 . 2 . . . . . 281 PRO HB3 . 50229 1 487 . 1 . 1 169 169 PRO HD2 H 1 3.657 0.000 . 2 . . . . . 281 PRO HD2 . 50229 1 488 . 1 . 1 169 169 PRO HD3 H 1 3.808 0.003 . 2 . . . . . 281 PRO HD3 . 50229 1 489 . 1 . 1 169 169 PRO C C 13 176.241 0.000 . 1 . . . . . 281 PRO C . 50229 1 490 . 1 . 1 169 169 PRO CA C 13 62.926 0.019 . 1 . . . . . 281 PRO CA . 50229 1 491 . 1 . 1 169 169 PRO CB C 13 32.033 0.000 . 1 . . . . . 281 PRO CB . 50229 1 492 . 1 . 1 169 169 PRO CG C 13 27.222 0.000 . 1 . . . . . 281 PRO CG . 50229 1 493 . 1 . 1 169 169 PRO CD C 13 50.574 0.007 . 1 . . . . . 281 PRO CD . 50229 1 494 . 1 . 1 169 169 PRO N N 15 135.745 0.049 . 1 . . . . . 281 PRO N . 50229 1 495 . 1 . 1 170 170 HIS H H 1 8.322 0.004 . 1 . . . . . 282 HIS H . 50229 1 496 . 1 . 1 170 170 HIS HB2 H 1 3.034 0.002 . 2 . . . . . 282 HIS HB2 . 50229 1 497 . 1 . 1 170 170 HIS HB3 H 1 2.973 0.007 . 2 . . . . . 282 HIS HB3 . 50229 1 498 . 1 . 1 170 170 HIS C C 13 174.044 0.000 . 1 . . . . . 282 HIS C . 50229 1 499 . 1 . 1 170 170 HIS CB C 13 30.484 0.014 . 1 . . . . . 282 HIS CB . 50229 1 500 . 1 . 1 170 170 HIS N N 15 121.232 0.072 . 1 . . . . . 282 HIS N . 50229 1 501 . 1 . 1 171 171 PRO HA H 1 4.354 0.002 . 1 . . . . . 283 PRO HA . 50229 1 502 . 1 . 1 171 171 PRO HB2 H 1 1.880 0.000 . 2 . . . . . 283 PRO HB2 . 50229 1 503 . 1 . 1 171 171 PRO HB3 H 1 2.213 0.000 . 2 . . . . . 283 PRO HB3 . 50229 1 504 . 1 . 1 171 171 PRO HD2 H 1 3.658 0.000 . 2 . . . . . 283 PRO HD2 . 50229 1 505 . 1 . 1 171 171 PRO HD3 H 1 3.228 0.001 . 2 . . . . . 283 PRO HD3 . 50229 1 506 . 1 . 1 171 171 PRO C C 13 176.812 0.000 . 1 . . . . . 283 PRO C . 50229 1 507 . 1 . 1 171 171 PRO CA C 13 63.782 0.033 . 1 . . . . . 283 PRO CA . 50229 1 508 . 1 . 1 171 171 PRO CB C 13 32.032 0.000 . 1 . . . . . 283 PRO CB . 50229 1 509 . 1 . 1 171 171 PRO CG C 13 27.235 0.000 . 1 . . . . . 283 PRO CG . 50229 1 510 . 1 . 1 171 171 PRO CD C 13 50.598 0.042 . 1 . . . . . 283 PRO CD . 50229 1 511 . 1 . 1 171 171 PRO N N 15 138.204 0.020 . 1 . . . . . 283 PRO N . 50229 1 512 . 1 . 1 172 172 ASP H H 1 8.882 0.008 . 1 . . . . . 284 ASP H . 50229 1 513 . 1 . 1 172 172 ASP HA H 1 4.642 0.002 . 1 . . . . . 284 ASP HA . 50229 1 514 . 1 . 1 172 172 ASP HB2 H 1 2.697 0.004 . 1 . . . . . 284 ASP HB2 . 50229 1 515 . 1 . 1 172 172 ASP HB3 H 1 2.697 0.004 . 1 . . . . . 284 ASP HB3 . 50229 1 516 . 1 . 1 172 172 ASP C C 13 177.047 0.000 . 1 . . . . . 284 ASP C . 50229 1 517 . 1 . 1 172 172 ASP CA C 13 54.371 0.022 . 1 . . . . . 284 ASP CA . 50229 1 518 . 1 . 1 172 172 ASP CB C 13 41.257 0.010 . 1 . . . . . 284 ASP CB . 50229 1 519 . 1 . 1 172 172 ASP N N 15 120.634 0.050 . 1 . . . . . 284 ASP N . 50229 1 520 . 1 . 1 173 173 GLY H H 1 8.350 0.004 . 1 . . . . . 285 GLY H . 50229 1 521 . 1 . 1 173 173 GLY HA2 H 1 3.941 0.004 . 1 . . . . . 285 GLY HA2 . 50229 1 522 . 1 . 1 173 173 GLY HA3 H 1 3.941 0.004 . 1 . . . . . 285 GLY HA3 . 50229 1 523 . 1 . 1 173 173 GLY C C 13 174.168 0.001 . 1 . . . . . 285 GLY C . 50229 1 524 . 1 . 1 173 173 GLY CA C 13 45.753 0.006 . 1 . . . . . 285 GLY CA . 50229 1 525 . 1 . 1 173 173 GLY N N 15 109.407 0.034 . 1 . . . . . 285 GLY N . 50229 1 526 . 1 . 1 174 174 ASN H H 1 8.321 0.005 . 1 . . . . . 286 ASN H . 50229 1 527 . 1 . 1 174 174 ASN HA H 1 4.647 0.002 . 1 . . . . . 286 ASN HA . 50229 1 528 . 1 . 1 174 174 ASN HB2 H 1 2.643 0.000 . 1 . . . . . 286 ASN HB2 . 50229 1 529 . 1 . 1 174 174 ASN HB3 H 1 2.643 0.000 . 1 . . . . . 286 ASN HB3 . 50229 1 530 . 1 . 1 174 174 ASN C C 13 175.530 0.005 . 1 . . . . . 286 ASN C . 50229 1 531 . 1 . 1 174 174 ASN CA C 13 53.250 0.020 . 1 . . . . . 286 ASN CA . 50229 1 532 . 1 . 1 174 174 ASN CB C 13 38.913 0.030 . 1 . . . . . 286 ASN CB . 50229 1 533 . 1 . 1 174 174 ASN N N 15 118.402 0.028 . 1 . . . . . 286 ASN N . 50229 1 534 . 1 . 1 175 175 ALA H H 1 8.211 0.003 . 1 . . . . . 287 ALA H . 50229 1 535 . 1 . 1 175 175 ALA HA H 1 4.168 0.001 . 1 . . . . . 287 ALA HA . 50229 1 536 . 1 . 1 175 175 ALA HB1 H 1 1.297 0.003 . 1 . . . . . 287 ALA HB1 . 50229 1 537 . 1 . 1 175 175 ALA HB2 H 1 1.297 0.003 . 1 . . . . . 287 ALA HB2 . 50229 1 538 . 1 . 1 175 175 ALA HB3 H 1 1.297 0.003 . 1 . . . . . 287 ALA HB3 . 50229 1 539 . 1 . 1 175 175 ALA C C 13 177.687 0.001 . 1 . . . . . 287 ALA C . 50229 1 540 . 1 . 1 175 175 ALA CA C 13 53.365 0.023 . 1 . . . . . 287 ALA CA . 50229 1 541 . 1 . 1 175 175 ALA CB C 13 18.796 0.020 . 1 . . . . . 287 ALA CB . 50229 1 542 . 1 . 1 175 175 ALA N N 15 124.219 0.035 . 1 . . . . . 287 ALA N . 50229 1 543 . 1 . 1 176 176 TRP H H 1 7.948 0.004 . 1 . . . . . 288 TRP H . 50229 1 544 . 1 . 1 176 176 TRP HA H 1 4.550 0.001 . 1 . . . . . 288 TRP HA . 50229 1 545 . 1 . 1 176 176 TRP HB2 H 1 3.247 0.003 . 1 . . . . . 288 TRP HB2 . 50229 1 546 . 1 . 1 176 176 TRP HB3 H 1 3.247 0.003 . 1 . . . . . 288 TRP HB3 . 50229 1 547 . 1 . 1 176 176 TRP HD1 H 1 7.261 0.000 . 1 . . . . . 288 TRP HD1 . 50229 1 548 . 1 . 1 176 176 TRP HE1 H 1 10.155 0.002 . 1 . . . . . 288 TRP HE1 . 50229 1 549 . 1 . 1 176 176 TRP C C 13 176.406 0.002 . 1 . . . . . 288 TRP C . 50229 1 550 . 1 . 1 176 176 TRP CA C 13 57.468 0.045 . 1 . . . . . 288 TRP CA . 50229 1 551 . 1 . 1 176 176 TRP CB C 13 29.050 0.029 . 1 . . . . . 288 TRP CB . 50229 1 552 . 1 . 1 176 176 TRP N N 15 118.913 0.033 . 1 . . . . . 288 TRP N . 50229 1 553 . 1 . 1 176 176 TRP NE1 N 15 129.784 0.038 . 1 . . . . . 288 TRP NE1 . 50229 1 554 . 1 . 1 177 177 MET H H 1 7.764 0.003 . 1 . . . . . 289 MET H . 50229 1 555 . 1 . 1 177 177 MET HA H 1 4.213 0.002 . 1 . . . . . 289 MET HA . 50229 1 556 . 1 . 1 177 177 MET HB2 H 1 1.875 0.001 . 2 . . . . . 289 MET HB2 . 50229 1 557 . 1 . 1 177 177 MET HB3 H 1 1.757 0.001 . 2 . . . . . 289 MET HB3 . 50229 1 558 . 1 . 1 177 177 MET HG2 H 1 2.098 0.000 . 1 . . . . . 289 MET HG2 . 50229 1 559 . 1 . 1 177 177 MET HG3 H 1 2.098 0.000 . 1 . . . . . 289 MET HG3 . 50229 1 560 . 1 . 1 177 177 MET C C 13 175.904 0.008 . 1 . . . . . 289 MET C . 50229 1 561 . 1 . 1 177 177 MET CA C 13 55.884 0.032 . 1 . . . . . 289 MET CA . 50229 1 562 . 1 . 1 177 177 MET CB C 13 32.794 0.017 . 1 . . . . . 289 MET CB . 50229 1 563 . 1 . 1 177 177 MET CG C 13 31.490 0.000 . 1 . . . . . 289 MET CG . 50229 1 564 . 1 . 1 177 177 MET N N 15 121.361 0.034 . 1 . . . . . 289 MET N . 50229 1 565 . 1 . 1 178 178 SER H H 1 8.034 0.003 . 1 . . . . . 290 SER H . 50229 1 566 . 1 . 1 178 178 SER HA H 1 4.337 0.003 . 1 . . . . . 290 SER HA . 50229 1 567 . 1 . 1 178 178 SER HB2 H 1 3.820 0.000 . 1 . . . . . 290 SER HB2 . 50229 1 568 . 1 . 1 178 178 SER HB3 H 1 3.820 0.000 . 1 . . . . . 290 SER HB3 . 50229 1 569 . 1 . 1 178 178 SER C C 13 174.200 0.005 . 1 . . . . . 290 SER C . 50229 1 570 . 1 . 1 178 178 SER CA C 13 58.338 0.011 . 1 . . . . . 290 SER CA . 50229 1 571 . 1 . 1 178 178 SER CB C 13 63.850 0.022 . 1 . . . . . 290 SER CB . 50229 1 572 . 1 . 1 178 178 SER N N 15 116.215 0.041 . 1 . . . . . 290 SER N . 50229 1 573 . 1 . 1 179 179 ALA H H 1 8.257 0.004 . 1 . . . . . 291 ALA H . 50229 1 574 . 1 . 1 179 179 ALA HA H 1 4.391 0.002 . 1 . . . . . 291 ALA HA . 50229 1 575 . 1 . 1 179 179 ALA HB1 H 1 1.411 0.004 . 1 . . . . . 291 ALA HB1 . 50229 1 576 . 1 . 1 179 179 ALA HB2 H 1 1.411 0.004 . 1 . . . . . 291 ALA HB2 . 50229 1 577 . 1 . 1 179 179 ALA HB3 H 1 1.411 0.004 . 1 . . . . . 291 ALA HB3 . 50229 1 578 . 1 . 1 179 179 ALA C C 13 177.904 0.005 . 1 . . . . . 291 ALA C . 50229 1 579 . 1 . 1 179 179 ALA CA C 13 52.670 0.018 . 1 . . . . . 291 ALA CA . 50229 1 580 . 1 . 1 179 179 ALA CB C 13 19.423 0.025 . 1 . . . . . 291 ALA CB . 50229 1 581 . 1 . 1 179 179 ALA N N 15 125.873 0.037 . 1 . . . . . 291 ALA N . 50229 1 582 . 1 . 1 180 180 THR H H 1 8.183 0.003 . 1 . . . . . 292 THR H . 50229 1 583 . 1 . 1 180 180 THR HA H 1 4.420 0.006 . 1 . . . . . 292 THR HA . 50229 1 584 . 1 . 1 180 180 THR HB H 1 4.245 0.003 . 1 . . . . . 292 THR HB . 50229 1 585 . 1 . 1 180 180 THR HG21 H 1 1.194 0.000 . 1 . . . . . 292 THR HG21 . 50229 1 586 . 1 . 1 180 180 THR HG22 H 1 1.194 0.000 . 1 . . . . . 292 THR HG22 . 50229 1 587 . 1 . 1 180 180 THR HG23 H 1 1.194 0.000 . 1 . . . . . 292 THR HG23 . 50229 1 588 . 1 . 1 180 180 THR C C 13 174.818 0.000 . 1 . . . . . 292 THR C . 50229 1 589 . 1 . 1 180 180 THR CA C 13 61.777 0.014 . 1 . . . . . 292 THR CA . 50229 1 590 . 1 . 1 180 180 THR CB C 13 69.891 0.000 . 1 . . . . . 292 THR CB . 50229 1 591 . 1 . 1 180 180 THR CG2 C 13 21.551 0.000 . 1 . . . . . 292 THR CG2 . 50229 1 592 . 1 . 1 180 180 THR N N 15 113.062 0.043 . 1 . . . . . 292 THR N . 50229 1 593 . 1 . 1 181 181 THR H H 1 8.177 0.003 . 1 . . . . . 293 THR H . 50229 1 594 . 1 . 1 181 181 THR HA H 1 4.430 0.003 . 1 . . . . . 293 THR HA . 50229 1 595 . 1 . 1 181 181 THR HB H 1 4.282 0.000 . 1 . . . . . 293 THR HB . 50229 1 596 . 1 . 1 181 181 THR HG21 H 1 1.197 0.000 . 1 . . . . . 293 THR HG21 . 50229 1 597 . 1 . 1 181 181 THR HG22 H 1 1.197 0.000 . 1 . . . . . 293 THR HG22 . 50229 1 598 . 1 . 1 181 181 THR HG23 H 1 1.197 0.000 . 1 . . . . . 293 THR HG23 . 50229 1 599 . 1 . 1 181 181 THR C C 13 174.546 0.000 . 1 . . . . . 293 THR C . 50229 1 600 . 1 . 1 181 181 THR CA C 13 61.675 0.002 . 1 . . . . . 293 THR CA . 50229 1 601 . 1 . 1 181 181 THR CB C 13 70.032 0.000 . 1 . . . . . 293 THR CB . 50229 1 602 . 1 . 1 181 181 THR CG2 C 13 21.580 0.000 . 1 . . . . . 293 THR CG2 . 50229 1 603 . 1 . 1 181 181 THR N N 15 115.927 0.033 . 1 . . . . . 293 THR N . 50229 1 604 . 1 . 1 182 182 SER H H 1 8.373 0.003 . 1 . . . . . 294 SER H . 50229 1 605 . 1 . 1 182 182 SER HA H 1 4.456 0.003 . 1 . . . . . 294 SER HA . 50229 1 606 . 1 . 1 182 182 SER HB2 H 1 3.852 0.000 . 1 . . . . . 294 SER HB2 . 50229 1 607 . 1 . 1 182 182 SER HB3 H 1 3.852 0.000 . 1 . . . . . 294 SER HB3 . 50229 1 608 . 1 . 1 182 182 SER C C 13 174.203 0.016 . 1 . . . . . 294 SER C . 50229 1 609 . 1 . 1 182 182 SER CA C 13 58.402 0.028 . 1 . . . . . 294 SER CA . 50229 1 610 . 1 . 1 182 182 SER CB C 13 63.969 0.028 . 1 . . . . . 294 SER CB . 50229 1 611 . 1 . 1 182 182 SER N N 15 117.903 0.024 . 1 . . . . . 294 SER N . 50229 1 612 . 1 . 1 183 183 ASP H H 1 8.367 0.004 . 1 . . . . . 295 ASP H . 50229 1 613 . 1 . 1 183 183 ASP HA H 1 4.607 0.002 . 1 . . . . . 295 ASP HA . 50229 1 614 . 1 . 1 183 183 ASP HB2 H 1 2.620 0.007 . 2 . . . . . 295 ASP HB2 . 50229 1 615 . 1 . 1 183 183 ASP HB3 H 1 2.702 0.004 . 2 . . . . . 295 ASP HB3 . 50229 1 616 . 1 . 1 183 183 ASP C C 13 175.909 0.000 . 1 . . . . . 295 ASP C . 50229 1 617 . 1 . 1 183 183 ASP CA C 13 54.372 0.030 . 1 . . . . . 295 ASP CA . 50229 1 618 . 1 . 1 183 183 ASP CB C 13 41.205 0.002 . 1 . . . . . 295 ASP CB . 50229 1 619 . 1 . 1 183 183 ASP N N 15 122.597 0.062 . 1 . . . . . 295 ASP N . 50229 1 620 . 1 . 1 184 184 ASP H H 1 8.286 0.003 . 1 . . . . . 296 ASP H . 50229 1 621 . 1 . 1 184 184 ASP HA H 1 4.557 0.001 . 1 . . . . . 296 ASP HA . 50229 1 622 . 1 . 1 184 184 ASP HB2 H 1 2.677 0.000 . 1 . . . . . 296 ASP HB2 . 50229 1 623 . 1 . 1 184 184 ASP HB3 H 1 2.677 0.000 . 1 . . . . . 296 ASP HB3 . 50229 1 624 . 1 . 1 184 184 ASP C C 13 176.661 0.000 . 1 . . . . . 296 ASP C . 50229 1 625 . 1 . 1 184 184 ASP CA C 13 54.493 0.053 . 1 . . . . . 296 ASP CA . 50229 1 626 . 1 . 1 184 184 ASP CB C 13 40.886 0.017 . 1 . . . . . 296 ASP CB . 50229 1 627 . 1 . 1 184 184 ASP N N 15 121.078 0.042 . 1 . . . . . 296 ASP N . 50229 1 628 . 1 . 1 185 185 ARG H H 1 8.324 0.005 . 1 . . . . . 297 ARG H . 50229 1 629 . 1 . 1 185 185 ARG HA H 1 4.319 0.005 . 1 . . . . . 297 ARG HA . 50229 1 630 . 1 . 1 185 185 ARG HB2 H 1 1.911 0.000 . 2 . . . . . 297 ARG HB2 . 50229 1 631 . 1 . 1 185 185 ARG HB3 H 1 1.782 0.004 . 2 . . . . . 297 ARG HB3 . 50229 1 632 . 1 . 1 185 185 ARG HG2 H 1 1.623 0.000 . 1 . . . . . 297 ARG HG2 . 50229 1 633 . 1 . 1 185 185 ARG HD2 H 1 3.177 0.000 . 1 . . . . . 297 ARG HD2 . 50229 1 634 . 1 . 1 185 185 ARG C C 13 176.595 0.000 . 1 . . . . . 297 ARG C . 50229 1 635 . 1 . 1 185 185 ARG CA C 13 56.340 0.007 . 1 . . . . . 297 ARG CA . 50229 1 636 . 1 . 1 185 185 ARG CB C 13 30.360 0.000 . 1 . . . . . 297 ARG CB . 50229 1 637 . 1 . 1 185 185 ARG CG C 13 26.964 0.000 . 1 . . . . . 297 ARG CG . 50229 1 638 . 1 . 1 185 185 ARG CD C 13 43.210 0.000 . 1 . . . . . 297 ARG CD . 50229 1 639 . 1 . 1 185 185 ARG N N 15 121.480 0.068 . 1 . . . . . 297 ARG N . 50229 1 640 . 1 . 1 186 186 SER H H 1 8.264 0.003 . 1 . . . . . 298 SER H . 50229 1 641 . 1 . 1 186 186 SER HA H 1 4.389 0.001 . 1 . . . . . 298 SER HA . 50229 1 642 . 1 . 1 186 186 SER HB2 H 1 3.849 0.000 . 1 . . . . . 298 SER HB2 . 50229 1 643 . 1 . 1 186 186 SER HB3 H 1 3.849 0.000 . 1 . . . . . 298 SER HB3 . 50229 1 644 . 1 . 1 186 186 SER C C 13 173.802 0.010 . 1 . . . . . 298 SER C . 50229 1 645 . 1 . 1 186 186 SER CA C 13 58.492 0.010 . 1 . . . . . 298 SER CA . 50229 1 646 . 1 . 1 186 186 SER CB C 13 63.999 0.000 . 1 . . . . . 298 SER CB . 50229 1 647 . 1 . 1 186 186 SER N N 15 116.352 0.042 . 1 . . . . . 298 SER N . 50229 1 648 . 1 . 1 187 187 ALA H H 1 8.142 0.003 . 1 . . . . . 299 ALA H . 50229 1 649 . 1 . 1 187 187 ALA HA H 1 4.570 0.003 . 1 . . . . . 299 ALA HA . 50229 1 650 . 1 . 1 187 187 ALA HB1 H 1 1.340 0.003 . 1 . . . . . 299 ALA HB1 . 50229 1 651 . 1 . 1 187 187 ALA HB2 H 1 1.340 0.003 . 1 . . . . . 299 ALA HB2 . 50229 1 652 . 1 . 1 187 187 ALA HB3 H 1 1.340 0.003 . 1 . . . . . 299 ALA HB3 . 50229 1 653 . 1 . 1 187 187 ALA C C 13 175.334 0.000 . 1 . . . . . 299 ALA C . 50229 1 654 . 1 . 1 187 187 ALA CA C 13 50.631 0.012 . 1 . . . . . 299 ALA CA . 50229 1 655 . 1 . 1 187 187 ALA CB C 13 18.250 0.026 . 1 . . . . . 299 ALA CB . 50229 1 656 . 1 . 1 187 187 ALA N N 15 126.915 0.049 . 1 . . . . . 299 ALA N . 50229 1 657 . 1 . 1 188 188 PRO HA H 1 4.443 0.002 . 1 . . . . . 300 PRO HA . 50229 1 658 . 1 . 1 188 188 PRO HB2 H 1 2.260 0.000 . 2 . . . . . 300 PRO HB2 . 50229 1 659 . 1 . 1 188 188 PRO HB3 H 1 1.855 0.000 . 2 . . . . . 300 PRO HB3 . 50229 1 660 . 1 . 1 188 188 PRO HD2 H 1 3.772 0.000 . 2 . . . . . 300 PRO HD2 . 50229 1 661 . 1 . 1 188 188 PRO HD3 H 1 3.610 0.000 . 2 . . . . . 300 PRO HD3 . 50229 1 662 . 1 . 1 188 188 PRO C C 13 176.971 0.007 . 1 . . . . . 300 PRO C . 50229 1 663 . 1 . 1 188 188 PRO CA C 13 63.016 0.014 . 1 . . . . . 300 PRO CA . 50229 1 664 . 1 . 1 188 188 PRO CB C 13 32.065 0.000 . 1 . . . . . 300 PRO CB . 50229 1 665 . 1 . 1 188 188 PRO CG C 13 27.344 0.000 . 1 . . . . . 300 PRO CG . 50229 1 666 . 1 . 1 188 188 PRO CD C 13 50.474 0.006 . 1 . . . . . 300 PRO CD . 50229 1 667 . 1 . 1 188 188 PRO N N 15 135.807 0.007 . 1 . . . . . 300 PRO N . 50229 1 668 . 1 . 1 189 189 VAL H H 1 8.342 0.005 . 1 . . . . . 301 VAL H . 50229 1 669 . 1 . 1 189 189 VAL HA H 1 4.150 0.003 . 1 . . . . . 301 VAL HA . 50229 1 670 . 1 . 1 189 189 VAL HB H 1 2.072 0.005 . 1 . . . . . 301 VAL HB . 50229 1 671 . 1 . 1 189 189 VAL HG11 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG11 . 50229 1 672 . 1 . 1 189 189 VAL HG12 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG12 . 50229 1 673 . 1 . 1 189 189 VAL HG13 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG13 . 50229 1 674 . 1 . 1 189 189 VAL HG21 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG21 . 50229 1 675 . 1 . 1 189 189 VAL HG22 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG22 . 50229 1 676 . 1 . 1 189 189 VAL HG23 H 1 0.948 0.000 . 1 . . . . . 301 VAL HG23 . 50229 1 677 . 1 . 1 189 189 VAL C C 13 176.626 0.013 . 1 . . . . . 301 VAL C . 50229 1 678 . 1 . 1 189 189 VAL CA C 13 62.450 0.021 . 1 . . . . . 301 VAL CA . 50229 1 679 . 1 . 1 189 189 VAL CB C 13 32.717 0.001 . 1 . . . . . 301 VAL CB . 50229 1 680 . 1 . 1 189 189 VAL CG1 C 13 20.650 0.000 . 2 . . . . . 301 VAL CG1 . 50229 1 681 . 1 . 1 189 189 VAL CG2 C 13 21.280 0.000 . 2 . . . . . 301 VAL CG2 . 50229 1 682 . 1 . 1 189 189 VAL N N 15 120.811 0.037 . 1 . . . . . 301 VAL N . 50229 1 683 . 1 . 1 190 190 THR H H 1 8.304 0.004 . 1 . . . . . 302 THR H . 50229 1 684 . 1 . 1 190 190 THR HA H 1 4.435 0.001 . 1 . . . . . 302 THR HA . 50229 1 685 . 1 . 1 190 190 THR HB H 1 4.234 0.000 . 1 . . . . . 302 THR HB . 50229 1 686 . 1 . 1 190 190 THR HG21 H 1 1.179 0.000 . 1 . . . . . 302 THR HG21 . 50229 1 687 . 1 . 1 190 190 THR HG22 H 1 1.179 0.000 . 1 . . . . . 302 THR HG22 . 50229 1 688 . 1 . 1 190 190 THR HG23 H 1 1.179 0.000 . 1 . . . . . 302 THR HG23 . 50229 1 689 . 1 . 1 190 190 THR C C 13 174.620 0.005 . 1 . . . . . 302 THR C . 50229 1 690 . 1 . 1 190 190 THR CA C 13 61.599 0.006 . 1 . . . . . 302 THR CA . 50229 1 691 . 1 . 1 190 190 THR CB C 13 69.911 0.007 . 1 . . . . . 302 THR CB . 50229 1 692 . 1 . 1 190 190 THR CG2 C 13 21.521 0.000 . 1 . . . . . 302 THR CG2 . 50229 1 693 . 1 . 1 190 190 THR N N 15 118.027 0.037 . 1 . . . . . 302 THR N . 50229 1 694 . 1 . 1 191 191 THR H H 1 8.180 0.003 . 1 . . . . . 303 THR H . 50229 1 695 . 1 . 1 191 191 THR HA H 1 4.341 0.005 . 1 . . . . . 303 THR HA . 50229 1 696 . 1 . 1 191 191 THR C C 13 174.551 0.000 . 1 . . . . . 303 THR C . 50229 1 697 . 1 . 1 191 191 THR CA C 13 61.819 0.068 . 1 . . . . . 303 THR CA . 50229 1 698 . 1 . 1 191 191 THR CB C 13 69.888 0.030 . 1 . . . . . 303 THR CB . 50229 1 699 . 1 . 1 191 191 THR CG2 C 13 21.640 0.000 . 1 . . . . . 303 THR CG2 . 50229 1 700 . 1 . 1 191 191 THR N N 15 116.586 0.050 . 1 . . . . . 303 THR N . 50229 1 701 . 1 . 1 192 192 LYS H H 1 8.359 0.011 . 1 . . . . . 304 LYS H . 50229 1 702 . 1 . 1 192 192 LYS CB C 13 33.012 0.000 . 1 . . . . . 304 LYS CB . 50229 1 703 . 1 . 1 192 192 LYS N N 15 123.628 0.046 . 1 . . . . . 304 LYS N . 50229 1 704 . 1 . 1 195 195 HIS HA H 1 4.633 0.005 . 1 . . . . . 307 HIS HA . 50229 1 705 . 1 . 1 195 195 HIS HB2 H 1 3.061 0.002 . 2 . . . . . 307 HIS HB2 . 50229 1 706 . 1 . 1 195 195 HIS HB3 H 1 3.130 0.009 . 2 . . . . . 307 HIS HB3 . 50229 1 707 . 1 . 1 195 195 HIS CA C 13 56.571 0.033 . 1 . . . . . 307 HIS CA . 50229 1 708 . 1 . 1 195 195 HIS CB C 13 30.905 0.039 . 1 . . . . . 307 HIS CB . 50229 1 709 . 1 . 1 196 196 SER H H 1 8.154 0.007 . 1 . . . . . 308 SER H . 50229 1 710 . 1 . 1 196 196 SER HA H 1 4.429 0.000 . 1 . . . . . 308 SER HA . 50229 1 711 . 1 . 1 196 196 SER CA C 13 58.410 0.002 . 1 . . . . . 308 SER CA . 50229 1 712 . 1 . 1 196 196 SER N N 15 116.874 0.061 . 1 . . . . . 308 SER N . 50229 1 713 . 1 . 1 197 197 VAL H H 1 8.129 0.004 . 1 . . . . . 309 VAL H . 50229 1 714 . 1 . 1 197 197 VAL HA H 1 4.093 0.004 . 1 . . . . . 309 VAL HA . 50229 1 715 . 1 . 1 197 197 VAL HB H 1 2.051 0.006 . 1 . . . . . 309 VAL HB . 50229 1 716 . 1 . 1 197 197 VAL C C 13 176.059 0.000 . 1 . . . . . 309 VAL C . 50229 1 717 . 1 . 1 197 197 VAL CA C 13 62.446 0.014 . 1 . . . . . 309 VAL CA . 50229 1 718 . 1 . 1 197 197 VAL CB C 13 32.709 0.042 . 1 . . . . . 309 VAL CB . 50229 1 719 . 1 . 1 197 197 VAL CG1 C 13 20.578 0.000 . 2 . . . . . 309 VAL CG1 . 50229 1 720 . 1 . 1 197 197 VAL CG2 C 13 21.262 0.000 . 2 . . . . . 309 VAL CG2 . 50229 1 721 . 1 . 1 197 197 VAL N N 15 122.164 0.013 . 1 . . . . . 309 VAL N . 50229 1 722 . 1 . 1 198 198 LYS H H 1 8.358 0.004 . 1 . . . . . 310 LYS H . 50229 1 723 . 1 . 1 198 198 LYS HA H 1 4.279 0.000 . 1 . . . . . 310 LYS HA . 50229 1 724 . 1 . 1 198 198 LYS HB2 H 1 1.747 0.000 . 1 . . . . . 310 LYS HB2 . 50229 1 725 . 1 . 1 198 198 LYS HB3 H 1 1.747 0.000 . 1 . . . . . 310 LYS HB3 . 50229 1 726 . 1 . 1 198 198 LYS C C 13 176.425 0.000 . 1 . . . . . 310 LYS C . 50229 1 727 . 1 . 1 198 198 LYS CA C 13 56.442 0.012 . 1 . . . . . 310 LYS CA . 50229 1 728 . 1 . 1 198 198 LYS CB C 13 32.975 0.084 . 1 . . . . . 310 LYS CB . 50229 1 729 . 1 . 1 198 198 LYS CG C 13 24.750 0.000 . 1 . . . . . 310 LYS CG . 50229 1 730 . 1 . 1 198 198 LYS CD C 13 29.136 0.000 . 1 . . . . . 310 LYS CD . 50229 1 731 . 1 . 1 198 198 LYS N N 15 125.436 0.031 . 1 . . . . . 310 LYS N . 50229 1 732 . 1 . 1 199 199 ARG H H 1 8.408 0.003 . 1 . . . . . 311 ARG H . 50229 1 733 . 1 . 1 199 199 ARG HA H 1 4.285 0.000 . 1 . . . . . 311 ARG HA . 50229 1 734 . 1 . 1 199 199 ARG HB2 H 1 1.745 0.000 . 1 . . . . . 311 ARG HB2 . 50229 1 735 . 1 . 1 199 199 ARG HB3 H 1 1.745 0.000 . 1 . . . . . 311 ARG HB3 . 50229 1 736 . 1 . 1 199 199 ARG C C 13 176.385 0.000 . 1 . . . . . 311 ARG C . 50229 1 737 . 1 . 1 199 199 ARG CA C 13 56.188 0.000 . 1 . . . . . 311 ARG CA . 50229 1 738 . 1 . 1 199 199 ARG CB C 13 30.898 0.000 . 1 . . . . . 311 ARG CB . 50229 1 739 . 1 . 1 199 199 ARG N N 15 123.255 0.019 . 1 . . . . . 311 ARG N . 50229 1 740 . 1 . 1 200 200 GLU H H 1 8.508 0.003 . 1 . . . . . 312 GLU H . 50229 1 741 . 1 . 1 200 200 GLU HA H 1 4.254 0.005 . 1 . . . . . 312 GLU HA . 50229 1 742 . 1 . 1 200 200 GLU HB2 H 1 2.028 0.000 . 2 . . . . . 312 GLU HB2 . 50229 1 743 . 1 . 1 200 200 GLU HB3 H 1 1.940 0.020 . 2 . . . . . 312 GLU HB3 . 50229 1 744 . 1 . 1 200 200 GLU C C 13 176.559 0.000 . 1 . . . . . 312 GLU C . 50229 1 745 . 1 . 1 200 200 GLU CA C 13 56.827 0.085 . 1 . . . . . 312 GLU CA . 50229 1 746 . 1 . 1 200 200 GLU CB C 13 30.259 0.022 . 1 . . . . . 312 GLU CB . 50229 1 747 . 1 . 1 200 200 GLU CG C 13 36.215 0.017 . 1 . . . . . 312 GLU CG . 50229 1 748 . 1 . 1 200 200 GLU N N 15 122.470 0.035 . 1 . . . . . 312 GLU N . 50229 1 749 . 1 . 1 201 201 ARG H H 1 8.420 0.004 . 1 . . . . . 313 ARG H . 50229 1 750 . 1 . 1 201 201 ARG HA H 1 4.282 0.004 . 1 . . . . . 313 ARG HA . 50229 1 751 . 1 . 1 201 201 ARG HB2 H 1 1.775 0.003 . 2 . . . . . 313 ARG HB2 . 50229 1 752 . 1 . 1 201 201 ARG HB3 H 1 1.832 0.005 . 2 . . . . . 313 ARG HB3 . 50229 1 753 . 1 . 1 201 201 ARG HG2 H 1 1.622 0.000 . 1 . . . . . 313 ARG HG2 . 50229 1 754 . 1 . 1 201 201 ARG HD2 H 1 3.182 0.000 . 1 . . . . . 313 ARG HD2 . 50229 1 755 . 1 . 1 201 201 ARG HD3 H 1 3.182 0.000 . 1 . . . . . 313 ARG HD3 . 50229 1 756 . 1 . 1 201 201 ARG C C 13 176.420 0.041 . 1 . . . . . 313 ARG C . 50229 1 757 . 1 . 1 201 201 ARG CA C 13 56.320 0.062 . 1 . . . . . 313 ARG CA . 50229 1 758 . 1 . 1 201 201 ARG CB C 13 30.731 0.085 . 1 . . . . . 313 ARG CB . 50229 1 759 . 1 . 1 201 201 ARG CG C 13 27.085 0.000 . 1 . . . . . 313 ARG CG . 50229 1 760 . 1 . 1 201 201 ARG CD C 13 43.272 0.000 . 1 . . . . . 313 ARG CD . 50229 1 761 . 1 . 1 201 201 ARG N N 15 121.482 0.041 . 1 . . . . . 313 ARG N . 50229 1 762 . 1 . 1 202 202 GLU H H 1 8.507 0.003 . 1 . . . . . 314 GLU H . 50229 1 763 . 1 . 1 202 202 GLU HA H 1 4.259 0.004 . 1 . . . . . 314 GLU HA . 50229 1 764 . 1 . 1 202 202 GLU HB2 H 1 2.051 0.003 . 2 . . . . . 314 GLU HB2 . 50229 1 765 . 1 . 1 202 202 GLU HB3 H 1 1.943 0.020 . 2 . . . . . 314 GLU HB3 . 50229 1 766 . 1 . 1 202 202 GLU HG2 H 1 2.273 0.000 . 1 . . . . . 314 GLU HG2 . 50229 1 767 . 1 . 1 202 202 GLU HG3 H 1 2.273 0.000 . 1 . . . . . 314 GLU HG3 . 50229 1 768 . 1 . 1 202 202 GLU C C 13 176.972 0.005 . 1 . . . . . 314 GLU C . 50229 1 769 . 1 . 1 202 202 GLU CA C 13 56.867 0.041 . 1 . . . . . 314 GLU CA . 50229 1 770 . 1 . 1 202 202 GLU CB C 13 30.306 0.052 . 1 . . . . . 314 GLU CB . 50229 1 771 . 1 . 1 202 202 GLU CG C 13 36.252 0.020 . 1 . . . . . 314 GLU CG . 50229 1 772 . 1 . 1 202 202 GLU N N 15 122.477 0.039 . 1 . . . . . 314 GLU N . 50229 1 773 . 1 . 1 203 203 GLY H H 1 8.485 0.003 . 1 . . . . . 315 GLY H . 50229 1 774 . 1 . 1 203 203 GLY HA2 H 1 3.994 0.002 . 1 . . . . . 315 GLY HA2 . 50229 1 775 . 1 . 1 203 203 GLY HA3 H 1 3.994 0.002 . 1 . . . . . 315 GLY HA3 . 50229 1 776 . 1 . 1 203 203 GLY C C 13 174.234 0.010 . 1 . . . . . 315 GLY C . 50229 1 777 . 1 . 1 203 203 GLY CA C 13 45.336 0.011 . 1 . . . . . 315 GLY CA . 50229 1 778 . 1 . 1 203 203 GLY N N 15 110.204 0.035 . 1 . . . . . 315 GLY N . 50229 1 779 . 1 . 1 204 204 THR H H 1 8.083 0.003 . 1 . . . . . 316 THR H . 50229 1 780 . 1 . 1 204 204 THR HA H 1 4.361 0.002 . 1 . . . . . 316 THR HA . 50229 1 781 . 1 . 1 204 204 THR HB H 1 4.172 0.000 . 1 . . . . . 316 THR HB . 50229 1 782 . 1 . 1 204 204 THR HG21 H 1 1.171 0.000 . 1 . . . . . 316 THR HG21 . 50229 1 783 . 1 . 1 204 204 THR HG22 H 1 1.171 0.000 . 1 . . . . . 316 THR HG22 . 50229 1 784 . 1 . 1 204 204 THR HG23 H 1 1.171 0.000 . 1 . . . . . 316 THR HG23 . 50229 1 785 . 1 . 1 204 204 THR C C 13 174.612 0.009 . 1 . . . . . 316 THR C . 50229 1 786 . 1 . 1 204 204 THR CA C 13 61.990 0.024 . 1 . . . . . 316 THR CA . 50229 1 787 . 1 . 1 204 204 THR CB C 13 70.051 0.020 . 1 . . . . . 316 THR CB . 50229 1 788 . 1 . 1 204 204 THR CG2 C 13 21.631 0.000 . 1 . . . . . 316 THR CG2 . 50229 1 789 . 1 . 1 204 204 THR N N 15 114.307 0.055 . 1 . . . . . 316 THR N . 50229 1 790 . 1 . 1 205 205 VAL H H 1 8.277 0.004 . 1 . . . . . 317 VAL H . 50229 1 791 . 1 . 1 205 205 VAL HA H 1 4.183 0.004 . 1 . . . . . 317 VAL HA . 50229 1 792 . 1 . 1 205 205 VAL HB H 1 2.078 0.001 . 1 . . . . . 317 VAL HB . 50229 1 793 . 1 . 1 205 205 VAL HG11 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG11 . 50229 1 794 . 1 . 1 205 205 VAL HG12 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG12 . 50229 1 795 . 1 . 1 205 205 VAL HG13 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG13 . 50229 1 796 . 1 . 1 205 205 VAL HG21 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG21 . 50229 1 797 . 1 . 1 205 205 VAL HG22 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG22 . 50229 1 798 . 1 . 1 205 205 VAL HG23 H 1 0.924 0.000 . 1 . . . . . 317 VAL HG23 . 50229 1 799 . 1 . 1 205 205 VAL C C 13 176.119 0.003 . 1 . . . . . 317 VAL C . 50229 1 800 . 1 . 1 205 205 VAL CA C 13 62.240 0.031 . 1 . . . . . 317 VAL CA . 50229 1 801 . 1 . 1 205 205 VAL CB C 13 32.890 0.079 . 1 . . . . . 317 VAL CB . 50229 1 802 . 1 . 1 205 205 VAL CG1 C 13 20.490 0.000 . 2 . . . . . 317 VAL CG1 . 50229 1 803 . 1 . 1 205 205 VAL CG2 C 13 21.089 0.000 . 2 . . . . . 317 VAL CG2 . 50229 1 804 . 1 . 1 205 205 VAL N N 15 122.964 0.042 . 1 . . . . . 317 VAL N . 50229 1 805 . 1 . 1 206 206 SER H H 1 8.509 0.004 . 1 . . . . . 318 SER H . 50229 1 806 . 1 . 1 206 206 SER HA H 1 4.545 0.004 . 1 . . . . . 318 SER HA . 50229 1 807 . 1 . 1 206 206 SER HB2 H 1 3.849 0.000 . 1 . . . . . 318 SER HB2 . 50229 1 808 . 1 . 1 206 206 SER HB3 H 1 3.849 0.000 . 1 . . . . . 318 SER HB3 . 50229 1 809 . 1 . 1 206 206 SER C C 13 174.778 0.000 . 1 . . . . . 318 SER C . 50229 1 810 . 1 . 1 206 206 SER CA C 13 58.171 0.028 . 1 . . . . . 318 SER CA . 50229 1 811 . 1 . 1 206 206 SER CB C 13 63.931 0.000 . 1 . . . . . 318 SER CB . 50229 1 812 . 1 . 1 206 206 SER N N 15 120.122 0.041 . 1 . . . . . 318 SER N . 50229 1 813 . 1 . 1 207 207 THR H H 1 8.282 0.001 . 1 . . . . . 319 THR H . 50229 1 814 . 1 . 1 207 207 THR HA H 1 4.401 0.004 . 1 . . . . . 319 THR HA . 50229 1 815 . 1 . 1 207 207 THR HB H 1 4.252 0.000 . 1 . . . . . 319 THR HB . 50229 1 816 . 1 . 1 207 207 THR C C 13 174.470 0.001 . 1 . . . . . 319 THR C . 50229 1 817 . 1 . 1 207 207 THR CA C 13 61.651 0.031 . 1 . . . . . 319 THR CA . 50229 1 818 . 1 . 1 207 207 THR CB C 13 69.766 0.019 . 1 . . . . . 319 THR CB . 50229 1 819 . 1 . 1 207 207 THR CG2 C 13 21.649 0.000 . 1 . . . . . 319 THR CG2 . 50229 1 820 . 1 . 1 207 207 THR N N 15 116.202 0.047 . 1 . . . . . 319 THR N . 50229 1 821 . 1 . 1 208 208 THR H H 1 8.232 0.003 . 1 . . . . . 320 THR H . 50229 1 822 . 1 . 1 208 208 THR HA H 1 4.592 0.003 . 1 . . . . . 320 THR HA . 50229 1 823 . 1 . 1 208 208 THR HG21 H 1 1.232 0.000 . 1 . . . . . 320 THR HG21 . 50229 1 824 . 1 . 1 208 208 THR HG22 H 1 1.232 0.000 . 1 . . . . . 320 THR HG22 . 50229 1 825 . 1 . 1 208 208 THR HG23 H 1 1.232 0.000 . 1 . . . . . 320 THR HG23 . 50229 1 826 . 1 . 1 208 208 THR C C 13 172.761 0.000 . 1 . . . . . 320 THR C . 50229 1 827 . 1 . 1 208 208 THR CA C 13 59.962 0.025 . 1 . . . . . 320 THR CA . 50229 1 828 . 1 . 1 208 208 THR CB C 13 69.797 0.000 . 1 . . . . . 320 THR CB . 50229 1 829 . 1 . 1 208 208 THR N N 15 119.357 0.039 . 1 . . . . . 320 THR N . 50229 1 830 . 1 . 1 209 209 PRO HA H 1 4.478 0.003 . 1 . . . . . 321 PRO HA . 50229 1 831 . 1 . 1 209 209 PRO HB2 H 1 2.307 0.007 . 2 . . . . . 321 PRO HB2 . 50229 1 832 . 1 . 1 209 209 PRO HB3 H 1 1.895 0.000 . 2 . . . . . 321 PRO HB3 . 50229 1 833 . 1 . 1 209 209 PRO HD2 H 1 3.871 0.003 . 2 . . . . . 321 PRO HD2 . 50229 1 834 . 1 . 1 209 209 PRO HD3 H 1 3.713 0.005 . 2 . . . . . 321 PRO HD3 . 50229 1 835 . 1 . 1 209 209 PRO C C 13 177.008 0.000 . 1 . . . . . 321 PRO C . 50229 1 836 . 1 . 1 209 209 PRO CA C 13 63.277 0.031 . 1 . . . . . 321 PRO CA . 50229 1 837 . 1 . 1 209 209 PRO CB C 13 32.205 0.000 . 1 . . . . . 321 PRO CB . 50229 1 838 . 1 . 1 209 209 PRO CG C 13 27.309 0.000 . 1 . . . . . 321 PRO CG . 50229 1 839 . 1 . 1 209 209 PRO CD C 13 51.216 0.000 . 1 . . . . . 321 PRO CD . 50229 1 840 . 1 . 1 209 209 PRO N N 15 139.272 0.040 . 1 . . . . . 321 PRO N . 50229 1 841 . 1 . 1 210 210 THR H H 1 8.297 0.005 . 1 . . . . . 322 THR H . 50229 1 842 . 1 . 1 210 210 THR HA H 1 4.252 0.003 . 1 . . . . . 322 THR HA . 50229 1 843 . 1 . 1 210 210 THR HB H 1 4.130 0.008 . 1 . . . . . 322 THR HB . 50229 1 844 . 1 . 1 210 210 THR HG21 H 1 1.186 0.000 . 1 . . . . . 322 THR HG21 . 50229 1 845 . 1 . 1 210 210 THR HG22 H 1 1.186 0.000 . 1 . . . . . 322 THR HG22 . 50229 1 846 . 1 . 1 210 210 THR HG23 H 1 1.186 0.000 . 1 . . . . . 322 THR HG23 . 50229 1 847 . 1 . 1 210 210 THR C C 13 174.310 0.008 . 1 . . . . . 322 THR C . 50229 1 848 . 1 . 1 210 210 THR CA C 13 62.060 0.037 . 1 . . . . . 322 THR CA . 50229 1 849 . 1 . 1 210 210 THR CB C 13 69.839 0.025 . 1 . . . . . 322 THR CB . 50229 1 850 . 1 . 1 210 210 THR N N 15 115.468 0.053 . 1 . . . . . 322 THR N . 50229 1 851 . 1 . 1 211 211 ARG H H 1 8.324 0.004 . 1 . . . . . 323 ARG H . 50229 1 852 . 1 . 1 211 211 ARG HA H 1 4.634 0.003 . 1 . . . . . 323 ARG HA . 50229 1 853 . 1 . 1 211 211 ARG HB2 H 1 1.823 0.000 . 2 . . . . . 323 ARG HB2 . 50229 1 854 . 1 . 1 211 211 ARG HB3 H 1 1.706 0.000 . 2 . . . . . 323 ARG HB3 . 50229 1 855 . 1 . 1 211 211 ARG C C 13 173.927 0.000 . 1 . . . . . 323 ARG C . 50229 1 856 . 1 . 1 211 211 ARG CA C 13 53.871 0.019 . 1 . . . . . 323 ARG CA . 50229 1 857 . 1 . 1 211 211 ARG CB C 13 30.286 0.022 . 1 . . . . . 323 ARG CB . 50229 1 858 . 1 . 1 211 211 ARG N N 15 124.716 0.034 . 1 . . . . . 323 ARG N . 50229 1 859 . 1 . 1 212 212 PRO HA H 1 4.395 0.003 . 1 . . . . . 324 PRO HA . 50229 1 860 . 1 . 1 212 212 PRO HB2 H 1 1.855 0.000 . 2 . . . . . 324 PRO HB2 . 50229 1 861 . 1 . 1 212 212 PRO HB3 H 1 2.265 0.003 . 2 . . . . . 324 PRO HB3 . 50229 1 862 . 1 . 1 212 212 PRO C C 13 176.712 0.004 . 1 . . . . . 324 PRO C . 50229 1 863 . 1 . 1 212 212 PRO CA C 13 62.976 0.048 . 1 . . . . . 324 PRO CA . 50229 1 864 . 1 . 1 212 212 PRO CB C 13 32.122 0.018 . 1 . . . . . 324 PRO CB . 50229 1 865 . 1 . 1 212 212 PRO CG C 13 27.312 0.000 . 1 . . . . . 324 PRO CG . 50229 1 866 . 1 . 1 212 212 PRO CD C 13 50.698 0.000 . 1 . . . . . 324 PRO CD . 50229 1 867 . 1 . 1 212 212 PRO N N 15 136.756 0.000 . 1 . . . . . 324 PRO N . 50229 1 868 . 1 . 1 213 213 LEU H H 1 8.371 0.004 . 1 . . . . . 325 LEU H . 50229 1 869 . 1 . 1 213 213 LEU HA H 1 4.293 0.001 . 1 . . . . . 325 LEU HA . 50229 1 870 . 1 . 1 213 213 LEU HB2 H 1 1.557 0.002 . 2 . . . . . 325 LEU HB2 . 50229 1 871 . 1 . 1 213 213 LEU HB3 H 1 1.611 0.001 . 2 . . . . . 325 LEU HB3 . 50229 1 872 . 1 . 1 213 213 LEU C C 13 177.359 0.025 . 1 . . . . . 325 LEU C . 50229 1 873 . 1 . 1 213 213 LEU CA C 13 55.193 0.026 . 1 . . . . . 325 LEU CA . 50229 1 874 . 1 . 1 213 213 LEU CB C 13 42.500 0.034 . 1 . . . . . 325 LEU CB . 50229 1 875 . 1 . 1 213 213 LEU CD1 C 13 23.657 0.000 . 2 . . . . . 325 LEU CD1 . 50229 1 876 . 1 . 1 213 213 LEU CD2 C 13 24.752 0.000 . 2 . . . . . 325 LEU CD2 . 50229 1 877 . 1 . 1 213 213 LEU N N 15 123.110 0.044 . 1 . . . . . 325 LEU N . 50229 1 878 . 1 . 1 214 214 LYS H H 1 8.305 0.005 . 1 . . . . . 326 LYS H . 50229 1 879 . 1 . 1 214 214 LYS HA H 1 4.282 0.007 . 1 . . . . . 326 LYS HA . 50229 1 880 . 1 . 1 214 214 LYS HB2 H 1 1.742 0.000 . 1 . . . . . 326 LYS HB2 . 50229 1 881 . 1 . 1 214 214 LYS HB3 H 1 1.742 0.000 . 1 . . . . . 326 LYS HB3 . 50229 1 882 . 1 . 1 214 214 LYS C C 13 176.266 0.000 . 1 . . . . . 326 LYS C . 50229 1 883 . 1 . 1 214 214 LYS CA C 13 56.161 0.030 . 1 . . . . . 326 LYS CA . 50229 1 884 . 1 . 1 214 214 LYS CB C 13 33.129 0.011 . 1 . . . . . 326 LYS CB . 50229 1 885 . 1 . 1 214 214 LYS CG C 13 24.692 0.000 . 1 . . . . . 326 LYS CG . 50229 1 886 . 1 . 1 214 214 LYS N N 15 122.793 0.037 . 1 . . . . . 326 LYS N . 50229 1 887 . 1 . 1 215 215 LYS H H 1 8.349 0.004 . 1 . . . . . 327 LYS H . 50229 1 888 . 1 . 1 215 215 LYS HA H 1 4.278 0.007 . 1 . . . . . 327 LYS HA . 50229 1 889 . 1 . 1 215 215 LYS HB2 H 1 1.754 0.000 . 1 . . . . . 327 LYS HB2 . 50229 1 890 . 1 . 1 215 215 LYS HB3 H 1 1.754 0.000 . 1 . . . . . 327 LYS HB3 . 50229 1 891 . 1 . 1 215 215 LYS C C 13 176.330 0.000 . 1 . . . . . 327 LYS C . 50229 1 892 . 1 . 1 215 215 LYS CA C 13 56.190 0.004 . 1 . . . . . 327 LYS CA . 50229 1 893 . 1 . 1 215 215 LYS CB C 13 33.097 0.053 . 1 . . . . . 327 LYS CB . 50229 1 894 . 1 . 1 215 215 LYS N N 15 123.580 0.061 . 1 . . . . . 327 LYS N . 50229 1 895 . 1 . 1 216 216 ARG H H 1 8.413 0.009 . 1 . . . . . 328 ARG H . 50229 1 896 . 1 . 1 216 216 ARG HA H 1 4.319 0.000 . 1 . . . . . 328 ARG HA . 50229 1 897 . 1 . 1 216 216 ARG CB C 13 30.831 0.000 . 1 . . . . . 328 ARG CB . 50229 1 898 . 1 . 1 216 216 ARG N N 15 123.266 0.028 . 1 . . . . . 328 ARG N . 50229 1 899 . 1 . 1 217 217 ASN HA H 1 4.932 0.003 . 1 . . . . . 329 ASN HA . 50229 1 900 . 1 . 1 217 217 ASN HB2 H 1 2.864 0.000 . 2 . . . . . 329 ASN HB2 . 50229 1 901 . 1 . 1 217 217 ASN HB3 H 1 2.678 0.000 . 2 . . . . . 329 ASN HB3 . 50229 1 902 . 1 . 1 217 217 ASN HD21 H 1 7.643 0.000 . 1 . . . . . 329 ASN HD21 . 50229 1 903 . 1 . 1 217 217 ASN HD22 H 1 6.954 0.000 . 1 . . . . . 329 ASN HD22 . 50229 1 904 . 1 . 1 217 217 ASN CA C 13 51.299 0.030 . 1 . . . . . 329 ASN CA . 50229 1 905 . 1 . 1 217 217 ASN CB C 13 38.790 0.000 . 1 . . . . . 329 ASN CB . 50229 1 906 . 1 . 1 218 218 PRO HA H 1 4.384 0.001 . 1 . . . . . 330 PRO HA . 50229 1 907 . 1 . 1 218 218 PRO HB2 H 1 2.261 0.000 . 2 . . . . . 330 PRO HB2 . 50229 1 908 . 1 . 1 218 218 PRO HB3 H 1 1.921 0.000 . 2 . . . . . 330 PRO HB3 . 50229 1 909 . 1 . 1 218 218 PRO C C 13 176.753 0.000 . 1 . . . . . 330 PRO C . 50229 1 910 . 1 . 1 218 218 PRO CA C 13 63.389 0.044 . 1 . . . . . 330 PRO CA . 50229 1 911 . 1 . 1 218 218 PRO CB C 13 32.219 0.000 . 1 . . . . . 330 PRO CB . 50229 1 912 . 1 . 1 218 218 PRO N N 15 136.649 0.022 . 1 . . . . . 330 PRO N . 50229 1 913 . 1 . 1 219 219 ARG H H 1 8.365 0.003 . 1 . . . . . 331 ARG H . 50229 1 914 . 1 . 1 219 219 ARG HA H 1 4.307 0.006 . 1 . . . . . 331 ARG HA . 50229 1 915 . 1 . 1 219 219 ARG HB2 H 1 1.747 0.001 . 2 . . . . . 331 ARG HB2 . 50229 1 916 . 1 . 1 219 219 ARG HB3 H 1 1.836 0.001 . 2 . . . . . 331 ARG HB3 . 50229 1 917 . 1 . 1 219 219 ARG C C 13 176.303 0.019 . 1 . . . . . 331 ARG C . 50229 1 918 . 1 . 1 219 219 ARG CA C 13 56.120 0.024 . 1 . . . . . 331 ARG CA . 50229 1 919 . 1 . 1 219 219 ARG CB C 13 30.569 0.046 . 1 . . . . . 331 ARG CB . 50229 1 920 . 1 . 1 219 219 ARG CG C 13 27.190 0.000 . 1 . . . . . 331 ARG CG . 50229 1 921 . 1 . 1 219 219 ARG CD C 13 43.214 0.000 . 1 . . . . . 331 ARG CD . 50229 1 922 . 1 . 1 219 219 ARG N N 15 120.309 0.049 . 1 . . . . . 331 ARG N . 50229 1 923 . 1 . 1 220 220 THR H H 1 8.085 0.002 . 1 . . . . . 332 THR H . 50229 1 924 . 1 . 1 220 220 THR HA H 1 4.556 0.003 . 1 . . . . . 332 THR HA . 50229 1 925 . 1 . 1 220 220 THR HB H 1 4.144 0.000 . 1 . . . . . 332 THR HB . 50229 1 926 . 1 . 1 220 220 THR HG21 H 1 1.238 0.000 . 1 . . . . . 332 THR HG21 . 50229 1 927 . 1 . 1 220 220 THR HG22 H 1 1.238 0.000 . 1 . . . . . 332 THR HG22 . 50229 1 928 . 1 . 1 220 220 THR HG23 H 1 1.238 0.000 . 1 . . . . . 332 THR HG23 . 50229 1 929 . 1 . 1 220 220 THR C C 13 172.782 0.000 . 1 . . . . . 332 THR C . 50229 1 930 . 1 . 1 220 220 THR CA C 13 59.871 0.039 . 1 . . . . . 332 THR CA . 50229 1 931 . 1 . 1 220 220 THR CB C 13 69.663 0.049 . 1 . . . . . 332 THR CB . 50229 1 932 . 1 . 1 220 220 THR N N 15 117.818 0.050 . 1 . . . . . 332 THR N . 50229 1 933 . 1 . 1 221 221 PRO HA H 1 4.376 0.002 . 1 . . . . . 333 PRO HA . 50229 1 934 . 1 . 1 221 221 PRO HB2 H 1 2.203 0.000 . 2 . . . . . 333 PRO HB2 . 50229 1 935 . 1 . 1 221 221 PRO HB3 H 1 1.729 0.001 . 2 . . . . . 333 PRO HB3 . 50229 1 936 . 1 . 1 221 221 PRO HD2 H 1 3.844 0.001 . 2 . . . . . 333 PRO HD2 . 50229 1 937 . 1 . 1 221 221 PRO HD3 H 1 3.690 0.000 . 2 . . . . . 333 PRO HD3 . 50229 1 938 . 1 . 1 221 221 PRO C C 13 176.649 0.010 . 1 . . . . . 333 PRO C . 50229 1 939 . 1 . 1 221 221 PRO CA C 13 63.354 0.033 . 1 . . . . . 333 PRO CA . 50229 1 940 . 1 . 1 221 221 PRO CB C 13 32.164 0.031 . 1 . . . . . 333 PRO CB . 50229 1 941 . 1 . 1 221 221 PRO CG C 13 27.385 0.000 . 1 . . . . . 333 PRO CG . 50229 1 942 . 1 . 1 221 221 PRO CD C 13 51.117 0.009 . 1 . . . . . 333 PRO CD . 50229 1 943 . 1 . 1 221 221 PRO N N 15 138.989 0.022 . 1 . . . . . 333 PRO N . 50229 1 944 . 1 . 1 222 222 SER H H 1 8.333 0.004 . 1 . . . . . 334 SER H . 50229 1 945 . 1 . 1 222 222 SER HA H 1 4.423 0.011 . 1 . . . . . 334 SER HA . 50229 1 946 . 1 . 1 222 222 SER HB2 H 1 3.806 0.000 . 1 . . . . . 334 SER HB2 . 50229 1 947 . 1 . 1 222 222 SER HB3 H 1 3.806 0.000 . 1 . . . . . 334 SER HB3 . 50229 1 948 . 1 . 1 222 222 SER C C 13 174.040 0.012 . 1 . . . . . 334 SER C . 50229 1 949 . 1 . 1 222 222 SER CA C 13 58.309 0.074 . 1 . . . . . 334 SER CA . 50229 1 950 . 1 . 1 222 222 SER CB C 13 63.771 0.051 . 1 . . . . . 334 SER CB . 50229 1 951 . 1 . 1 222 222 SER N N 15 115.868 0.052 . 1 . . . . . 334 SER N . 50229 1 952 . 1 . 1 223 223 TYR H H 1 8.126 0.004 . 1 . . . . . 335 TYR H . 50229 1 953 . 1 . 1 223 223 TYR HA H 1 4.656 0.001 . 1 . . . . . 335 TYR HA . 50229 1 954 . 1 . 1 223 223 TYR HB2 H 1 2.968 0.001 . 2 . . . . . 335 TYR HB2 . 50229 1 955 . 1 . 1 223 223 TYR HB3 H 1 3.063 0.003 . 2 . . . . . 335 TYR HB3 . 50229 1 956 . 1 . 1 223 223 TYR C C 13 175.627 0.001 . 1 . . . . . 335 TYR C . 50229 1 957 . 1 . 1 223 223 TYR CA C 13 57.763 0.019 . 1 . . . . . 335 TYR CA . 50229 1 958 . 1 . 1 223 223 TYR CB C 13 38.885 0.050 . 1 . . . . . 335 TYR CB . 50229 1 959 . 1 . 1 223 223 TYR N N 15 122.156 0.043 . 1 . . . . . 335 TYR N . 50229 1 960 . 1 . 1 224 224 THR H H 1 8.143 0.005 . 1 . . . . . 336 THR H . 50229 1 961 . 1 . 1 224 224 THR HA H 1 4.346 0.003 . 1 . . . . . 336 THR HA . 50229 1 962 . 1 . 1 224 224 THR HB H 1 4.137 0.004 . 1 . . . . . 336 THR HB . 50229 1 963 . 1 . 1 224 224 THR HG21 H 1 1.135 0.000 . 1 . . . . . 336 THR HG21 . 50229 1 964 . 1 . 1 224 224 THR HG22 H 1 1.135 0.000 . 1 . . . . . 336 THR HG22 . 50229 1 965 . 1 . 1 224 224 THR HG23 H 1 1.135 0.000 . 1 . . . . . 336 THR HG23 . 50229 1 966 . 1 . 1 224 224 THR C C 13 174.151 0.030 . 1 . . . . . 336 THR C . 50229 1 967 . 1 . 1 224 224 THR CA C 13 61.592 0.061 . 1 . . . . . 336 THR CA . 50229 1 968 . 1 . 1 224 224 THR CB C 13 70.248 0.023 . 1 . . . . . 336 THR CB . 50229 1 969 . 1 . 1 224 224 THR CG2 C 13 21.531 0.000 . 1 . . . . . 336 THR CG2 . 50229 1 970 . 1 . 1 224 224 THR N N 15 116.559 0.064 . 1 . . . . . 336 THR N . 50229 1 971 . 1 . 1 225 225 VAL H H 1 8.162 0.002 . 1 . . . . . 337 VAL H . 50229 1 972 . 1 . 1 225 225 VAL HA H 1 4.045 0.004 . 1 . . . . . 337 VAL HA . 50229 1 973 . 1 . 1 225 225 VAL HB H 1 2.057 0.002 . 1 . . . . . 337 VAL HB . 50229 1 974 . 1 . 1 225 225 VAL HG11 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG11 . 50229 1 975 . 1 . 1 225 225 VAL HG12 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG12 . 50229 1 976 . 1 . 1 225 225 VAL HG13 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG13 . 50229 1 977 . 1 . 1 225 225 VAL HG21 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG21 . 50229 1 978 . 1 . 1 225 225 VAL HG22 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG22 . 50229 1 979 . 1 . 1 225 225 VAL HG23 H 1 0.938 0.000 . 1 . . . . . 337 VAL HG23 . 50229 1 980 . 1 . 1 225 225 VAL C C 13 175.861 0.006 . 1 . . . . . 337 VAL C . 50229 1 981 . 1 . 1 225 225 VAL CA C 13 62.524 0.016 . 1 . . . . . 337 VAL CA . 50229 1 982 . 1 . 1 225 225 VAL CB C 13 32.681 0.047 . 1 . . . . . 337 VAL CB . 50229 1 983 . 1 . 1 225 225 VAL CG1 C 13 21.249 0.000 . 2 . . . . . 337 VAL CG1 . 50229 1 984 . 1 . 1 225 225 VAL CG2 C 13 20.630 0.000 . 2 . . . . . 337 VAL CG2 . 50229 1 985 . 1 . 1 225 225 VAL N N 15 122.591 0.046 . 1 . . . . . 337 VAL N . 50229 1 986 . 1 . 1 226 226 ALA H H 1 8.307 0.004 . 1 . . . . . 338 ALA H . 50229 1 987 . 1 . 1 226 226 ALA HA H 1 4.270 0.004 . 1 . . . . . 338 ALA HA . 50229 1 988 . 1 . 1 226 226 ALA HB1 H 1 1.360 0.002 . 1 . . . . . 338 ALA HB1 . 50229 1 989 . 1 . 1 226 226 ALA HB2 H 1 1.360 0.002 . 1 . . . . . 338 ALA HB2 . 50229 1 990 . 1 . 1 226 226 ALA HB3 H 1 1.360 0.002 . 1 . . . . . 338 ALA HB3 . 50229 1 991 . 1 . 1 226 226 ALA C C 13 177.390 0.005 . 1 . . . . . 338 ALA C . 50229 1 992 . 1 . 1 226 226 ALA CA C 13 52.648 0.027 . 1 . . . . . 338 ALA CA . 50229 1 993 . 1 . 1 226 226 ALA CB C 13 19.299 0.031 . 1 . . . . . 338 ALA CB . 50229 1 994 . 1 . 1 226 226 ALA N N 15 127.235 0.054 . 1 . . . . . 338 ALA N . 50229 1 995 . 1 . 1 227 227 ASP H H 1 8.186 0.003 . 1 . . . . . 339 ASP H . 50229 1 996 . 1 . 1 227 227 ASP HA H 1 4.520 0.003 . 1 . . . . . 339 ASP HA . 50229 1 997 . 1 . 1 227 227 ASP HB2 H 1 2.623 0.004 . 1 . . . . . 339 ASP HB2 . 50229 1 998 . 1 . 1 227 227 ASP HB3 H 1 2.623 0.004 . 1 . . . . . 339 ASP HB3 . 50229 1 999 . 1 . 1 227 227 ASP C C 13 175.952 0.004 . 1 . . . . . 339 ASP C . 50229 1 1000 . 1 . 1 227 227 ASP CA C 13 54.509 0.028 . 1 . . . . . 339 ASP CA . 50229 1 1001 . 1 . 1 227 227 ASP CB C 13 41.158 0.006 . 1 . . . . . 339 ASP CB . 50229 1 1002 . 1 . 1 227 227 ASP N N 15 119.386 0.054 . 1 . . . . . 339 ASP N . 50229 1 1003 . 1 . 1 228 228 ARG H H 1 8.122 0.002 . 1 . . . . . 340 ARG H . 50229 1 1004 . 1 . 1 228 228 ARG HA H 1 4.338 0.004 . 1 . . . . . 340 ARG HA . 50229 1 1005 . 1 . 1 228 228 ARG HB2 H 1 1.829 0.001 . 2 . . . . . 340 ARG HB2 . 50229 1 1006 . 1 . 1 228 228 ARG HB3 H 1 1.738 0.000 . 2 . . . . . 340 ARG HB3 . 50229 1 1007 . 1 . 1 228 228 ARG HD2 H 1 3.161 0.000 . 1 . . . . . 340 ARG HD2 . 50229 1 1008 . 1 . 1 228 228 ARG HD3 H 1 3.161 0.000 . 1 . . . . . 340 ARG HD3 . 50229 1 1009 . 1 . 1 228 228 ARG C C 13 176.062 0.011 . 1 . . . . . 340 ARG C . 50229 1 1010 . 1 . 1 228 228 ARG CA C 13 55.967 0.013 . 1 . . . . . 340 ARG CA . 50229 1 1011 . 1 . 1 228 228 ARG CB C 13 30.904 0.011 . 1 . . . . . 340 ARG CB . 50229 1 1012 . 1 . 1 228 228 ARG CG C 13 26.948 0.000 . 1 . . . . . 340 ARG CG . 50229 1 1013 . 1 . 1 228 228 ARG CD C 13 43.300 0.000 . 1 . . . . . 340 ARG CD . 50229 1 1014 . 1 . 1 228 228 ARG N N 15 120.733 0.030 . 1 . . . . . 340 ARG N . 50229 1 1015 . 1 . 1 229 229 ILE H H 1 8.262 0.005 . 1 . . . . . 341 ILE H . 50229 1 1016 . 1 . 1 229 229 ILE HA H 1 4.182 0.003 . 1 . . . . . 341 ILE HA . 50229 1 1017 . 1 . 1 229 229 ILE HB H 1 1.868 0.001 . 1 . . . . . 341 ILE HB . 50229 1 1018 . 1 . 1 229 229 ILE HG12 H 1 1.175 0.000 . 1 . . . . . 341 ILE HG12 . 50229 1 1019 . 1 . 1 229 229 ILE HG21 H 1 0.899 0.001 . 1 . . . . . 341 ILE HG21 . 50229 1 1020 . 1 . 1 229 229 ILE HG22 H 1 0.899 0.001 . 1 . . . . . 341 ILE HG22 . 50229 1 1021 . 1 . 1 229 229 ILE HG23 H 1 0.899 0.001 . 1 . . . . . 341 ILE HG23 . 50229 1 1022 . 1 . 1 229 229 ILE HD11 H 1 0.840 0.000 . 1 . . . . . 341 ILE HD11 . 50229 1 1023 . 1 . 1 229 229 ILE HD12 H 1 0.840 0.000 . 1 . . . . . 341 ILE HD12 . 50229 1 1024 . 1 . 1 229 229 ILE HD13 H 1 0.840 0.000 . 1 . . . . . 341 ILE HD13 . 50229 1 1025 . 1 . 1 229 229 ILE C C 13 176.180 0.023 . 1 . . . . . 341 ILE C . 50229 1 1026 . 1 . 1 229 229 ILE CA C 13 61.258 0.021 . 1 . . . . . 341 ILE CA . 50229 1 1027 . 1 . 1 229 229 ILE CB C 13 38.663 0.030 . 1 . . . . . 341 ILE CB . 50229 1 1028 . 1 . 1 229 229 ILE CG1 C 13 27.212 0.000 . 1 . . . . . 341 ILE CG1 . 50229 1 1029 . 1 . 1 229 229 ILE CG2 C 13 17.485 0.051 . 1 . . . . . 341 ILE CG2 . 50229 1 1030 . 1 . 1 229 229 ILE CD1 C 13 12.798 0.101 . 1 . . . . . 341 ILE CD1 . 50229 1 1031 . 1 . 1 229 229 ILE N N 15 122.564 0.068 . 1 . . . . . 341 ILE N . 50229 1 1032 . 1 . 1 230 230 SER H H 1 8.365 0.005 . 1 . . . . . 342 SER H . 50229 1 1033 . 1 . 1 230 230 SER HA H 1 4.476 0.001 . 1 . . . . . 342 SER HA . 50229 1 1034 . 1 . 1 230 230 SER HB2 H 1 3.831 0.001 . 2 . . . . . 342 SER HB2 . 50229 1 1035 . 1 . 1 230 230 SER HB3 H 1 3.832 0.000 . 2 . . . . . 342 SER HB3 . 50229 1 1036 . 1 . 1 230 230 SER C C 13 173.430 0.003 . 1 . . . . . 342 SER C . 50229 1 1037 . 1 . 1 230 230 SER CA C 13 58.193 0.017 . 1 . . . . . 342 SER CA . 50229 1 1038 . 1 . 1 230 230 SER CB C 13 64.085 0.010 . 1 . . . . . 342 SER CB . 50229 1 1039 . 1 . 1 230 230 SER N N 15 120.314 0.041 . 1 . . . . . 342 SER N . 50229 1 1040 . 1 . 1 231 231 GLU H H 1 8.074 0.003 . 1 . . . . . 343 GLU H . 50229 1 1041 . 1 . 1 231 231 GLU HA H 1 4.121 0.003 . 1 . . . . . 343 GLU HA . 50229 1 1042 . 1 . 1 231 231 GLU HB2 H 1 1.878 0.003 . 2 . . . . . 343 GLU HB2 . 50229 1 1043 . 1 . 1 231 231 GLU HB3 H 1 2.032 0.000 . 2 . . . . . 343 GLU HB3 . 50229 1 1044 . 1 . 1 231 231 GLU HG2 H 1 2.189 0.000 . 1 . . . . . 343 GLU HG2 . 50229 1 1045 . 1 . 1 231 231 GLU HG3 H 1 2.189 0.000 . 1 . . . . . 343 GLU HG3 . 50229 1 1046 . 1 . 1 231 231 GLU C C 13 181.068 0.000 . 1 . . . . . 343 GLU C . 50229 1 1047 . 1 . 1 231 231 GLU CA C 13 58.171 0.008 . 1 . . . . . 343 GLU CA . 50229 1 1048 . 1 . 1 231 231 GLU CB C 13 31.120 0.018 . 1 . . . . . 343 GLU CB . 50229 1 1049 . 1 . 1 231 231 GLU CG C 13 36.727 0.022 . 1 . . . . . 343 GLU CG . 50229 1 1050 . 1 . 1 231 231 GLU N N 15 128.274 0.038 . 1 . . . . . 343 GLU N . 50229 1 stop_ save_